# as currently required by QS, they are reordered so that no shell contains identical primitives.
#
#
# Citation: In addition to the original scientific reference,
# users of this form are requested to include the following citation
# in any publications resulting from its use:
# Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database,
# Version 02/25/04, as developed and distributed by the Molecular Science Computing Facility,
# Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory,
# P.O. Box 999, Richland, Washington 99352, USA, and funded by the U.S. Department of Energy.
# The Pacific Northwest Laboratory is a multi-program laboratory operated by Battelle Memorial Institute
# for the U.S. Department of Energy under contract DE-AC06-76RLO 1830.
# Contact Karen Schuchardt for further information.
#
# Currently contains the following basis sets for the atoms H-Xe if present in the original database
#
# BASIS="3-21G*"
#Elements                             References
#--------                             ----------
# H - Ne: J.S. Binkley, J.A. Pople, W.J. Hehre, J. Am. Chem. Soc 102 939 (1980)
#Na - Ar: M.S. Gordon, J.S. Binkley, J.A. Pople, W.J. Pietro and W.J. Hehre,
#         J. Am. Chem. Soc. 104, 2797 (1983).
# K - Ca: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 7, 359 (1986).
#Ga - Kr: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 7, 359 (1986).
#Sc - Zn: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 8, 861 (1987).
# Y - Cd: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 8, 880 (1987).
#Cs     : A 3-21G quality set derived from the Huzinage MIDI basis sets.
#         E.D. Glendening and D. Feller, J. Phys. Chem. 99, 3060 (1995)
#Elements                             Reference
#--------                             ----------
#Na - Ar:  W.J. Pietro, M.M. Francl, W.J. Hehre, D.J. DeFrees, J.A. Pople and
#          J.S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982)
#
# HYDROGEN    (3s) -> [2s]
H  3-21Gx 3-21G*
  2
  1  0  0  2  1
          5.44717800          0.15628500
          0.82454700          0.90469100
  1  0  0  1  1
          0.18319200          1.00000000
# HELIUM      (3s) -> [2s]
HE 3-21Gx 3-21G*
  2
  1  0  0  2  1
         13.62670000          0.17523000
          1.99935000          0.89348300
  1  0  0  1  1
          0.38299300          1.00000000
# LITHIUM     (6s,3p) -> [3s,2p]
LI 3-21Gx 3-21G*
  3
  1  0  0  3  1
         36.83820000          0.06966860
          5.48172000          0.38134600
          1.11327000          0.68170200
  1  0  1  2  1  1
          0.54020500         -0.26312700          0.16154600
          0.10225500          1.14339000          0.91566300
  1  0  1  1  1  1
          0.02856500          1.00000000          1.00000000
# BERYLLIUM   (6s,3p) -> [3s,2p]
BE 3-21Gx 3-21G*
  3
  1  0  0  3  1
         71.88760000          0.06442630
         10.72890000          0.36609600
          2.22205000          0.69593400
  1  0  1  2  1  1
          1.29548000         -0.42106400          0.20513200
          0.26888100          1.22407000          0.88252800
  1  0  1  1  1  1
          0.07735000          1.00000000          1.00000000
# BORON       (6s,3p) -> [3s,2p]
B  3-21Gx 3-21G*
  3
  1  0  0  3  1
        116.43400000          0.06296050
         17.43140000          0.36330400
          3.68016000          0.69725500
  1  0  1  2  1  1
          2.28187000         -0.36866200          0.23115200
          0.46524800          1.19944000          0.86676400
  1  0  1  1  1  1
          0.12432800          1.00000000          1.00000000
# CARBON      (6s,3p) -> [3s,2p]
C  3-21Gx 3-21G*
  3
  1  0  0  3  1
        172.25600000          0.06176690
         25.91090000          0.35879400
          5.53335000          0.70071300
  1  0  1  2  1  1
          3.66498000         -0.39589700          0.23646000
          0.77054500          1.21584000          0.86061900
  1  0  1  1  1  1
          0.19585700          1.00000000          1.00000000
# NITROGEN    (6s,3p) -> [3s,2p]
N  3-21Gx 3-21G*
  3
  1  0  0  3  1
        242.76600000          0.05986570
         36.48510000          0.35295500
          7.81449000          0.70651300
  1  0  1  2  1  1
          5.42522000         -0.41330100          0.23797200
          1.14915000          1.22442000          0.85895300
  1  0  1  1  1  1
          0.28320500          1.00000000          1.00000000
# OXYGEN      (6s,3p) -> [3s,2p]
O  3-21Gx 3-21G*
  3
  1  0  0  3  1
        322.03700000          0.05923940
         48.43080000          0.35150000
         10.42060000          0.70765800
  1  0  1  2  1  1
          7.40294000         -0.40445300          0.24458600
          1.57620000          1.22156000          0.85395500
  1  0  1  1  1  1
          0.37368400          1.00000000          1.00000000
# FLUORINE    (6s,3p) -> [3s,2p]
F  3-21Gx 3-21G*
  3
  1  0  0  3  1
        413.80100000          0.05854830
         62.24460000          0.34930800
         13.43400000          0.70963200
  1  0  1  2  1  1
          9.77759000         -0.40732700          0.24668000
          2.08617000          1.22314000          0.85232100
  1  0  1  1  1  1
          0.48238300          1.00000000          1.00000000
# NEON        (6s,3p) -> [3s,2p]
NE 3-21Gx 3-21G*
  3
  1  0  0  3  1
        515.72400000          0.05814300
         77.65380000          0.34795100
         16.81360000          0.71071400
  1  0  1  2  1  1
         12.48300000         -0.40992200          0.24746000
          2.66451000          1.22431000          0.85174300
  1  0  1  1  1  1
          0.60625000          1.00000000          1.00000000
# SODIUM      (9s,6p) -> [4s,3p]
# SODIUM      (1d)
NA 3-21Gx 3-21G*
  5
  1  0  0  3  1
        547.61300000          0.06749110
         82.06780000          0.39350500
         17.69170000          0.66560500
  1  0  1  3  1  1
         17.54070000         -0.11193700          0.12823300
          3.79398000          0.25465400          0.47153300
          0.90644100          0.84441700          0.60427300
  1  0  1  2  1  1
          0.50182400         -0.21966000          0.00906650
          0.06094580          1.08912000          0.99720200
  1  0  1  1  1  1
          0.02443490          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (9s,6p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 3-21Gx 3-21G*
  5
  1  0  0  3  1
        652.84100000          0.06759820
         98.38050000          0.39177800
         21.29960000          0.66666100
  1  0  1  3  1  1
         23.37270000         -0.11024600          0.12101400
          5.19953000          0.18411900          0.46281000
          1.31508000          0.89639900          0.60690700
  1  0  1  2  1  1
          0.61134900         -0.36110100          0.02426330
          0.14184100          1.21505000          0.98667300
  1  0  1  1  1  1
          0.04640110          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (9s,6p) -> [4s,3p]
# ALUMINUM    (1d)
AL 3-21Gx 3-21G*
  5
  1  0  0  3  1
        775.73700000          0.06683470
        116.95200000          0.38906100
         25.33260000          0.66946800
  1  0  1  3  1  1
         29.47960000         -0.10790200          0.11757400
          6.63314000          0.14624500          0.46117400
          1.72675000          0.92373000          0.60553500
  1  0  1  2  1  1
          0.94616000         -0.32032700          0.05193830
          0.20250600          1.18412000          0.97266000
  1  0  1  1  1  1
          0.06390880          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (9s,6p) -> [4s,3p]
# SILICON     (1d)
SI 3-21Gx 3-21G*
  5
  1  0  0  3  1
        910.65500000          0.06608230
        137.33600000          0.38622900
         29.76010000          0.67238000
  1  0  1  3  1  1
         36.67160000         -0.10451100          0.11335500
          8.31729000          0.10741000          0.45757800
          2.21645000          0.95144600          0.60742700
  1  0  1  2  1  1
          1.07913000         -0.37610800          0.06710300
          0.30242200          1.25165000          0.95688300
  1  0  1  1  1  1
          0.09333920          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (9s,6p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  3-21Gx 3-21G*
  5
  1  0  0  3  1
       1054.90000000          0.06554100
        159.19500000          0.38403600
         34.53040000          0.67454100
  1  0  1  3  1  1
         44.28660000         -0.10213000          0.11085100
         10.10190000          0.08159200          0.45649500
          2.73997000          0.96978800          0.60693600
  1  0  1  2  1  1
          1.21865000         -0.37149500          0.09158200
          0.39554600          1.27099000          0.93492400
  1  0  1  1  1  1
          0.12281100          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (9s,6p) -> [4s,3p]
# SULFUR      (1d)
S  3-21Gx 3-21G*
  5
  1  0  0  3  1
       1210.62000000          0.06500700
        182.74700000          0.38204000
         39.66730000          0.67654500
  1  0  1  3  1  1
         52.22360000         -0.10031000          0.10964600
         11.96290000          0.06508800          0.45764900
          3.28911000          0.98145500          0.60426100
  1  0  1  2  1  1
          1.22384000         -0.28608900          0.16477700
          0.45730300          1.22806000          0.87085500
  1  0  1  1  1  1
          0.14226900          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (9s,6p) -> [4s,3p]
# CHLORINE    (1d)
CL 3-21Gx 3-21G*
  5
  1  0  0  3  1
       1376.40000000          0.06458270
        207.85700000          0.38036300
         45.15540000          0.67819000
  1  0  1  3  1  1
         60.80140000         -0.09876390          0.10859800
         13.97650000          0.05113380          0.45868200
          3.88710000          0.99133700          0.60196200
  1  0  1  2  1  1
          1.35299000         -0.22240100          0.21921600
          0.52695500          1.18252000          0.82232100
  1  0  1  1  1  1
          0.16671400          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (9s,6p) -> [4s,3p]
# ARGON       (1d)
AR 3-21Gx 3-21G*
  5
  1  0  0  3  1
       1553.71000000          0.06417070
        234.67800000          0.37879700
         51.01210000          0.67975200
  1  0  1  3  1  1
         70.04530000         -0.09746610          0.10761900
         16.14730000          0.03905690          0.45957600
          4.53492000          0.99991600          0.60004100
  1  0  1  2  1  1
          1.54209000         -0.17686600          0.25568700
          0.60726700          1.14690000          0.78984200
  1  0  1  1  1  1
          0.19537300          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# BASIS="6-31G*"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             References
#--------                             ----------
#Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#         DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
H  6-31Gx 6-31G*
  2
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
# HELIUM      (4s) -> [2s]
HE 6-31Gx 6-31G*
  2
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31Gx 6-31G*
  4
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31Gx 6-31G*
  4
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31Gx 6-31G*
  4
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31Gx 6-31G*
  4
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
# NITROGEN    (1d)
N  6-31Gx 6-31G*
  4
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31Gx 6-31G*
  4
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31Gx 6-31G*
  4
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31Gx 6-31G*
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31Gx 6-31G*
  5
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31Gx 6-31G*
  5
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31Gx 6-31G*
  5
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31Gx 6-31G*
  5
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31Gx 6-31G*
  5
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31Gx 6-31G*
  5
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31Gx 6-31G*
  5
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
# ARGON       (1d)
AR 6-31Gx 6-31G*
  5
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (22s,16p) -> [5s,4p]
# POTASSIUM   (1d)
K  6-31Gx 6-31G*
  6
  1  0  0  6  1
      31594.42000000          0.00182801
       4744.33000000          0.01399403
       1080.41900000          0.06887129
        304.23380000          0.23697600
         97.24586000          0.48290400
         33.02495000          0.34047950
  1  0  1  6  1  1
        622.76250000         -0.00250298          0.00409464
        147.88390000         -0.03315550          0.03145199
         47.32735000         -0.12263870          0.13515580
         17.51495000          0.05353643          0.33905000
          6.92272200          0.61938600          0.46294550
          2.76827700          0.43458780          0.22426380
  1  0  1  6  1  1
         11.84802000          0.01277689         -0.01221377
          4.07921100          0.20987670         -0.00690054
          1.76348100         -0.00309527          0.20074660
          0.78892700         -0.55938840          0.42813320
          0.35038700         -0.51347600          0.39701560
          0.14634400         -0.06598035          0.11047180
  1  0  1  3  1  1
          0.71680100         -0.05237772          0.03164300
          0.23374100         -0.27985030         -0.04046160
          0.03867500          1.14154700          1.01202900
  1  0  1  1  1  1
          0.01652100          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# CALCIUM     (22s,16p) -> [5s,4p]
# CALCIUM     (1d)
CA 6-31Gx 6-31G*
  6
  1  0  0  6  1
      35264.86000000          0.00181350
       5295.50300000          0.01388493
       1206.02000000          0.06836162
        339.68390000          0.23561880
        108.62640000          0.48206390
         36.92103000          0.34298190
  1  0  1  6  1  1
        706.30960000          0.00244823          0.00402037
        167.81870000          0.03241504          0.03100601
         53.82558000          0.12262190          0.13372790
         20.01638000         -0.04316965          0.33679830
          7.97027900         -0.61269950          0.46312810
          3.21205900         -0.44875400          0.22575320
  1  0  1  6  1  1
         14.19518000          0.01084500         -0.01289621
          4.88082800          0.20883330         -0.01025198
          2.16039000          0.03150338          0.19597810
          0.98789900         -0.55265180          0.43579330
          0.44951700         -0.54379970          0.39964520
          0.18738700         -0.06669342          0.09713636
  1  0  1  3  1  1
          1.03227100         -0.04439720         -0.42986210
          0.38117100         -0.32845630          0.00693583
          0.06513100          1.16301000          0.97059330
  1  0  1  1  1  1
          0.02601000          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# SCANDIUM    (22s,16p,4d) -> [5s,4p,2d]
# SCANDIUM    (1f)
SC 6-31Gx 6-31G*
  8
  1  0  0  6  1
      39088.98000000          0.00180326
       5869.79200000          0.01380769
       1336.91000000          0.06800396
        376.60310000          0.23470990
        120.46790000          0.48156900
         40.98032000          0.34456520
  1  0  1  6  1  1
        786.28520000          0.00245186          0.00403953
        186.88700000          0.03259579          0.03122570
         60.00935000          0.12382420          0.13498330
         22.25883000         -0.04359890          0.34247930
          8.88514900         -0.61771810          0.46231130
          3.60921100         -0.44328230          0.21775240
  1  0  1  6  1  1
         29.84355000         -0.00258630         -0.00609665
          9.54238300          0.07188424         -0.02628884
          4.05679000          0.25032600          0.05091001
          1.70470300         -0.29910030          0.37980970
          0.70623400         -0.74468180          0.51708830
          0.27953600         -0.17997760          0.18297720
  1  0  1  3  1  1
          1.06560900          0.06482978         -0.29384400
          0.42593300          0.32537560          0.09235323
          0.07632000         -1.17080600          0.98479300
  1  0  1  1  1  1
          0.02959400          1.00000000          1.00000000
  1  2  2  3  1
         11.14701000          0.08747672
          2.82104300          0.37956350
          0.81962000          0.71803930
  1  2  2  1  1
          0.22146800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# TITANIUM    (22s,16p,4d) -> [5s,4p,2d]
# TITANIUM    (1f)
TI 6-31Gx 6-31G*
  8
  1  0  0  6  1
      43152.95000000          0.00179187
       6479.57100000          0.01372392
       1475.67500000          0.06762830
        415.69910000          0.23376420
        133.00060000          0.48106960
         45.27222000          0.34622800
  1  0  1  6  1  1
        874.68260000          0.00243101          0.00401768
        207.97850000          0.03233027          0.03113966
         66.87918000          0.12425200          0.13490770
         24.87347000         -0.03903905          0.34316720
          9.96844100         -0.61717890          0.46257600
          4.06382600         -0.44730970          0.21546030
  1  0  1  6  1  1
         33.64363000         -0.00294036         -0.00631162
         10.87565000          0.07163103         -0.02697638
          4.62822500          0.25289150          0.05316847
          1.95012600         -0.29664010          0.38455490
          0.80945200         -0.74322150          0.51276620
          0.32047400         -0.18535200          0.18111350
  1  0  1  3  1  1
          1.22414800          0.06351465         -0.21120700
          0.48426300          0.31514040          0.07771998
          0.08409600         -1.16259500          0.98982140
  1  0  1  1  1  1
          0.03203600          1.00000000          1.00000000
  1  2  2  3  1
         13.69085000          0.08589418
          3.51315400          0.37846710
          1.04043400          0.71612390
  1  2  2  1  1
          0.28696200          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# VANADIUM    (22s,16p,4d) -> [5s,4p,2d]
# VANADIUM    (1f)
V  6-31Gx 6-31G*
  8
  1  0  0  6  1
      47354.33000000          0.00178451
       7110.78700000          0.01366754
       1619.59100000          0.06736122
        456.33790000          0.23305520
        146.06060000          0.48063160
         49.75791000          0.34748020
  1  0  1  6  1  1
        968.14840000          0.00241060          0.00399500
        230.28210000          0.03207243          0.03104061
         74.14591000          0.12459420          0.13477470
         27.64107000         -0.03482177          0.34372790
         11.11475000         -0.61673740          0.46287590
          4.54311300         -0.45098440          0.21355470
  1  0  1  6  1  1
         37.64050000         -0.00323320         -0.00649406
         12.28238000          0.07130744         -0.02753453
          5.23336600          0.25438200          0.05516284
          2.20895000         -0.29338870          0.38796720
          0.91788000         -0.74156950          0.50902580
          0.36341200         -0.19094100          0.18038400
  1  0  1  3  1  1
          1.39278100          0.06139703         -0.18912650
          0.54391300          0.30611300          0.08005453
          0.09147600         -1.15489000          0.98773990
  1  0  1  1  1  1
          0.03431200          1.00000000          1.00000000
  1  2  2  3  1
         16.05025000          0.08599899
          4.16006300          0.38029960
          1.24326500          0.71276590
  1  2  2  1  1
          0.34427700          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# CHROMIUM    (22s,16p,4d) -> [5s,4p,2d]
# CHROMIUM    (1f)
CR 6-31Gx 6-31G*
  8
  1  0  0  6  1
      51789.81000000          0.00177618
       7776.84900000          0.01360476
       1771.38500000          0.06706925
        499.15880000          0.23231040
        159.79820000          0.48024100
         54.47021000          0.34876530
  1  0  1  6  1  1
       1064.32800000          0.00239967          0.00398700
        253.21380000          0.03194886          0.03104662
         81.60924000          0.12508680          0.13505180
         30.48193000         -0.03221866          0.34488650
         12.29439000         -0.61722840          0.46285710
          5.03772200         -0.45259360          0.21104260
  1  0  1  6  1  1
         41.56291000         -0.00345422         -0.00672250
         13.67627000          0.07218428         -0.02806471
          5.84439000          0.25448200          0.05820028
          2.47160900         -0.29345340          0.39169880
          1.02830800         -0.73854550          0.50478230
          0.40725000         -0.19471570          0.17902900
  1  0  1  3  1  1
          1.57146400          0.05892219         -0.19301000
          0.60558000          0.29760550          0.09605620
          0.09856100         -1.14750600          0.98176090
  1  0  1  1  1  1
          0.03645900          1.00000000          1.00000000
  1  2  2  3  1
         18.41930000          0.08650816
          4.81266100          0.38266990
          1.44644700          0.70937720
  1  2  2  1  1
          0.40041300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# MANGANESE   (22s,16p,4d) -> [5s,4p,2d]
# MANGANESE   (1f)
MN 6-31Gx 6-31G*
  8
  1  0  0  6  1
      56347.14000000          0.00177158
       8460.94300000          0.01357081
       1927.32500000          0.06690605
        543.23430000          0.23185410
        173.99050000          0.47990460
         59.36005000          0.34957370
  1  0  1  6  1  1
       1165.41200000          0.00238875          0.00397732
        277.32760000          0.03181708          0.03103112
         89.47278000          0.12546700          0.13518940
         33.48256000         -0.02955431          0.34573870
         13.54037000         -0.61751600          0.46292050
          5.55797200         -0.45444580          0.20905920
  1  0  1  6  1  1
         45.83532000         -0.00366586         -0.00688758
         15.18777000          0.07231971         -0.02846816
          6.50071000          0.25444860          0.06031832
          2.75158300         -0.29103800          0.39389610
          1.14540400         -0.73598600          0.50137690
          0.45368700         -0.19976170          0.17922640
  1  0  1  3  1  1
          1.75799900          0.05628572         -0.50350240
          0.66702200          0.28974910          0.23450110
          0.10512900         -1.14065300          0.91412570
  1  0  1  1  1  1
          0.03841800          1.00000000          1.00000000
  1  2  2  3  1
         20.94355000          0.08672702
          5.51048600          0.38418830
          1.66503800          0.70690710
  1  2  2  1  1
          0.46173300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# IRON        (22s,16p,4d) -> [5s,4p,2d]
# IRON        (1f)
FE 6-31Gx 6-31G*
  8
  1  0  0  6  1
      61132.62000000          0.00176611
       9179.34200000          0.01353038
       2090.85700000          0.06673128
        589.24790000          0.23148230
        188.75430000          0.47970580
         64.44629000          0.35019760
  1  0  1  6  1  1
       1259.98000000          0.00243801          0.00402802
        299.87610000          0.03224048          0.03144647
         96.84917000          0.12657240          0.13683170
         36.31020000         -0.03139902          0.34872360
         14.72996000         -0.62075930          0.46179310
          6.06607500         -0.45029140          0.20430580
  1  0  1  6  1  1
         50.43485000         -0.00387326         -0.00701713
         16.83929000          0.07196598         -0.02877660
          7.19208600          0.25565910          0.06181383
          3.05342000         -0.28828370          0.39549460
          1.27364300         -0.73428220          0.49890590
          0.50409100         -0.20493530          0.17912510
  1  0  1  3  1  1
          1.95031600          0.05694869         -0.45937960
          0.73672100          0.28829150          0.28521390
          0.11417700         -1.13815900          0.90764850
  1  0  1  1  1  1
          0.04114800          1.00000000          1.00000000
  1  2  2  3  1
         23.14994000          0.08876935
          6.12236800          0.38963190
          1.84660100          0.70148160
  1  2  2  1  1
          0.50436100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COBALT      (22s,16p,4d) -> [5s,4p,2d]
# COBALT      (1f)
CO 6-31Gx 6-31G*
  8
  1  0  0  6  1
      66148.99000000          0.00175979
       9933.07700000          0.01348162
       2262.81600000          0.06649342
        637.91540000          0.23079390
        204.41220000          0.47929190
         69.82538000          0.35140970
  1  0  1  6  1  1
       1378.84100000          0.00237628          0.00397149
        328.26940000          0.03167450          0.03108174
        106.09460000          0.12628880          0.13574390
         39.83275000         -0.02584552          0.34768270
         16.18622000         -0.61834910          0.46263400
          6.66778800         -0.45670080          0.20516320
  1  0  1  6  1  1
         54.52355000         -0.00399300         -0.00729077
         18.29783000          0.07409663         -0.02926027
          7.86734800          0.25420000          0.06564150
          3.34053400         -0.29216570          0.40006520
          1.39375600         -0.73187030          0.49502360
          0.55132600         -0.20407840          0.17582400
  1  0  1  3  1  1
          2.15194700          0.05379843         -0.21654960
          0.81106300          0.27599710          0.12404880
          0.12101700         -1.12969200          0.97240640
  1  0  1  1  1  1
          0.04303700          1.00000000          1.00000000
  1  2  2  3  1
         25.59306000          0.09004748
          6.80099000          0.39317030
          2.05164700          0.69768440
  1  2  2  1  1
          0.55567100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NICKEL      (22s,16p,4d) -> [5s,4p,2d]
# NICKEL      (1f)
NI 6-31Gx 6-31G*
  8
  1  0  0  6  1
      71396.35000000          0.00175300
      10720.84000000          0.01343122
       2442.12900000          0.06627041
        688.42650000          0.23025080
        220.61530000          0.47901860
         75.39373000          0.35234440
  1  0  1  6  1  1
       1492.53200000          0.00237071          0.00396755
        355.40130000          0.03160566          0.03109479
        114.95340000          0.12663350          0.13595170
         43.22043000         -0.02417037          0.34851360
         17.59710000         -0.61877750          0.46254980
          7.25776500         -0.45767700          0.20351860
  1  0  1  6  1  1
         59.35261000         -0.00416200         -0.00742145
         20.02181000          0.07425111         -0.02953410
          8.61456100          0.25413600          0.06731852
          3.66053100         -0.29034770          0.40166600
          1.52811100         -0.73021210          0.49266230
          0.60405700         -0.20760570          0.17568930
  1  0  1  3  1  1
          2.37927600          0.05157888         -0.18876630
          0.88583900          0.27076110          0.10151990
          0.12852900         -1.12477000          0.97909060
  1  0  1  1  1  1
          0.04519500          1.00000000          1.00000000
  1  2  2  3  1
         28.19147000          0.09098881
          7.52358400          0.39582080
          2.27122800          0.69471540
  1  2  2  1  1
          0.61160300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COPPER      (22s,16p,4d) -> [5s,4p,2d]
# COPPER      (1f)
CU 6-31Gx 6-31G*
  8
  1  0  0  6  1
      76794.38000000          0.00174816
      11530.70000000          0.01339602
       2626.57500000          0.06610885
        740.49030000          0.22982650
        237.35280000          0.47876750
         81.15818000          0.35307390
  1  0  1  6  1  1
       1610.81400000          0.00236405          0.00396331
        383.63670000          0.03153635          0.03110223
        124.17330000          0.12694520          0.13613500
         46.74678000         -0.02262840          0.34929140
         19.06569000         -0.61920800          0.46247800
          7.87156700         -0.45853930          0.20201020
  1  0  1  6  1  1
         64.45732000         -0.00433108         -0.00752373
         21.85212000          0.07412307         -0.02975687
          9.40534300          0.25421080          0.06849654
          3.99916800         -0.28748430          0.40271410
          1.67029700         -0.72914360          0.49084900
          0.65962700         -0.21139510          0.17592680
  1  0  1  3  1  1
          2.60008800          0.05027577         -0.17029110
          0.96309400          0.26500400          0.09310133
          0.13616100         -1.12015500          0.98143360
  1  0  1  1  1  1
          0.04733200          1.00000000          1.00000000
  1  2  2  3  1
         30.85341000          0.09199905
          8.26498500          0.39850210
          2.49533200          0.69178970
  1  2  2  1  1
          0.66765800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# ZINC        (22s,16p,4d) -> [5s,4p,2d]
# ZINC        (1f)
ZN 6-31Gx 6-31G*
  8
  1  0  0  6  1
      82400.94000000          0.00174333
      12372.55000000          0.01335966
       2818.35100000          0.06594365
        794.57170000          0.22941510
        254.72320000          0.47854530
         87.13880000          0.35377530
  1  0  1  6  1  1
       1732.56900000          0.00236146          0.00396313
        412.71490000          0.03150177          0.03113411
        133.67800000          0.12727740          0.13639310
         50.38585000         -0.02145928          0.35012660
         20.58358000         -0.61976520          0.46231790
          8.50594000         -0.45901800          0.20049950
  1  0  1  6  1  1
         69.36492000         -0.00444010         -0.00768926
         23.62082000          0.07505253         -0.02997982
         10.18471000          0.25331110          0.07082411
          4.33408200         -0.28818970          0.40461410
          1.81091800         -0.72670520          0.48823250
          0.71484100         -0.21334390          0.17519700
  1  0  1  3  1  1
          2.82384200          0.04898543         -0.15867630
          1.03954300          0.25927930          0.08379327
          0.14326400         -1.11571100          0.98405470
  1  0  1  1  1  1
          0.04929600          1.00000000          1.00000000
  1  2  2  3  1
         33.70764000          0.09262648
          9.06110600          0.40029800
          2.73838300          0.68966080
  1  2  2  1  1
          0.73029400          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# BASIS="6-31G**"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             References
#--------                             ----------
#H,Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#
#Na - Ar  : M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#
#           DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn:   V.A. Rassolov, J.A. Pople, M.A. Ratner, and T.L. Windus
#           J. Chem. Phys. 109, 1223 (1998)
#           Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (1p)
H  6-31Gxx 6-31G**
  3
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE 6-31Gxx 6-31G**
  3
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31Gxx 6-31G**
  4
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31Gxx 6-31G**
  4
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
N  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31Gxx 6-31G**
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31Gxx 6-31G**
  5
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31Gxx 6-31G**
  5
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31Gxx 6-31G**
  5
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
# ARGON       (1d)
AR 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (22s,16p) -> [5s,4p]
# POTASSIUM   (1d)
K  6-31Gxx 6-31G**
  6
  1  0  0  6  1
      31594.42000000          0.00182801
       4744.33000000          0.01399403
       1080.41900000          0.06887129
        304.23380000          0.23697600
         97.24586000          0.48290400
         33.02495000          0.34047950
  1  0  1  6  1  1
        622.76250000         -0.00250298          0.00409464
        147.88390000         -0.03315550          0.03145199
         47.32735000         -0.12263870          0.13515580
         17.51495000          0.05353643          0.33905000
          6.92272200          0.61938600          0.46294550
          2.76827700          0.43458780          0.22426380
  1  0  1  6  1  1
         11.84802000          0.01277689         -0.01221377
          4.07921100          0.20987670         -0.00690054
          1.76348100         -0.00309527          0.20074660
          0.78892700         -0.55938840          0.42813320
          0.35038700         -0.51347600          0.39701560
          0.14634400         -0.06598035          0.11047180
  1  0  1  3  1  1
          0.71680100         -0.05237772          0.03164300
          0.23374100         -0.27985030         -0.04046160
          0.03867500          1.14154700          1.01202900
  1  0  1  1  1  1
          0.01652100          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# CALCIUM     (22s,16p) -> [5s,4p]
# CALCIUM     (1d)
CA 6-31Gxx 6-31G**
  6
  1  0  0  6  1
      35264.86000000          0.00181350
       5295.50300000          0.01388493
       1206.02000000          0.06836162
        339.68390000          0.23561880
        108.62640000          0.48206390
         36.92103000          0.34298190
  1  0  1  6  1  1
        706.30960000          0.00244823          0.00402037
        167.81870000          0.03241504          0.03100601
         53.82558000          0.12262190          0.13372790
         20.01638000         -0.04316965          0.33679830
          7.97027900         -0.61269950          0.46312810
          3.21205900         -0.44875400          0.22575320
  1  0  1  6  1  1
         14.19518000          0.01084500         -0.01289621
          4.88082800          0.20883330         -0.01025198
          2.16039000          0.03150338          0.19597810
          0.98789900         -0.55265180          0.43579330
          0.44951700         -0.54379970          0.39964520
          0.18738700         -0.06669342          0.09713636
  1  0  1  3  1  1
          1.03227100         -0.04439720         -0.42986210
          0.38117100         -0.32845630          0.00693583
          0.06513100          1.16301000          0.97059330
  1  0  1  1  1  1
          0.02601000          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# SCANDIUM    (22s,16p,4d) -> [5s,4p,2d]
# SCANDIUM    (1f)
SC 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      39088.98000000          0.00180326
       5869.79200000          0.01380769
       1336.91000000          0.06800396
        376.60310000          0.23470990
        120.46790000          0.48156900
         40.98032000          0.34456520
  1  0  1  6  1  1
        786.28520000          0.00245186          0.00403953
        186.88700000          0.03259579          0.03122570
         60.00935000          0.12382420          0.13498330
         22.25883000         -0.04359890          0.34247930
          8.88514900         -0.61771810          0.46231130
          3.60921100         -0.44328230          0.21775240
  1  0  1  6  1  1
         29.84355000         -0.00258630         -0.00609665
          9.54238300          0.07188424         -0.02628884
          4.05679000          0.25032600          0.05091001
          1.70470300         -0.29910030          0.37980970
          0.70623400         -0.74468180          0.51708830
          0.27953600         -0.17997760          0.18297720
  1  0  1  3  1  1
          1.06560900          0.06482978         -0.29384400
          0.42593300          0.32537560          0.09235323
          0.07632000         -1.17080600          0.98479300
  1  0  1  1  1  1
          0.02959400          1.00000000          1.00000000
  1  2  2  3  1
         11.14701000          0.08747672
          2.82104300          0.37956350
          0.81962000          0.71803930
  1  2  2  1  1
          0.22146800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# TITANIUM    (22s,16p,4d) -> [5s,4p,2d]
# TITANIUM    (1f)
TI 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      43152.95000000          0.00179187
       6479.57100000          0.01372392
       1475.67500000          0.06762830
        415.69910000          0.23376420
        133.00060000          0.48106960
         45.27222000          0.34622800
  1  0  1  6  1  1
        874.68260000          0.00243101          0.00401768
        207.97850000          0.03233027          0.03113966
         66.87918000          0.12425200          0.13490770
         24.87347000         -0.03903905          0.34316720
          9.96844100         -0.61717890          0.46257600
          4.06382600         -0.44730970          0.21546030
  1  0  1  6  1  1
         33.64363000         -0.00294036         -0.00631162
         10.87565000          0.07163103         -0.02697638
          4.62822500          0.25289150          0.05316847
          1.95012600         -0.29664010          0.38455490
          0.80945200         -0.74322150          0.51276620
          0.32047400         -0.18535200          0.18111350
  1  0  1  3  1  1
          1.22414800          0.06351465         -0.21120700
          0.48426300          0.31514040          0.07771998
          0.08409600         -1.16259500          0.98982140
  1  0  1  1  1  1
          0.03203600          1.00000000          1.00000000
  1  2  2  3  1
         13.69085000          0.08589418
          3.51315400          0.37846710
          1.04043400          0.71612390
  1  2  2  1  1
          0.28696200          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# VANADIUM    (22s,16p,4d) -> [5s,4p,2d]
# VANADIUM    (1f)
V  6-31Gxx 6-31G**
  8
  1  0  0  6  1
      47354.33000000          0.00178451
       7110.78700000          0.01366754
       1619.59100000          0.06736122
        456.33790000          0.23305520
        146.06060000          0.48063160
         49.75791000          0.34748020
  1  0  1  6  1  1
        968.14840000          0.00241060          0.00399500
        230.28210000          0.03207243          0.03104061
         74.14591000          0.12459420          0.13477470
         27.64107000         -0.03482177          0.34372790
         11.11475000         -0.61673740          0.46287590
          4.54311300         -0.45098440          0.21355470
  1  0  1  6  1  1
         37.64050000         -0.00323320         -0.00649406
         12.28238000          0.07130744         -0.02753453
          5.23336600          0.25438200          0.05516284
          2.20895000         -0.29338870          0.38796720
          0.91788000         -0.74156950          0.50902580
          0.36341200         -0.19094100          0.18038400
  1  0  1  3  1  1
          1.39278100          0.06139703         -0.18912650
          0.54391300          0.30611300          0.08005453
          0.09147600         -1.15489000          0.98773990
  1  0  1  1  1  1
          0.03431200          1.00000000          1.00000000
  1  2  2  3  1
         16.05025000          0.08599899
          4.16006300          0.38029960
          1.24326500          0.71276590
  1  2  2  1  1
          0.34427700          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# CHROMIUM    (22s,16p,4d) -> [5s,4p,2d]
# CHROMIUM    (1f)
CR 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      51789.81000000          0.00177618
       7776.84900000          0.01360476
       1771.38500000          0.06706925
        499.15880000          0.23231040
        159.79820000          0.48024100
         54.47021000          0.34876530
  1  0  1  6  1  1
       1064.32800000          0.00239967          0.00398700
        253.21380000          0.03194886          0.03104662
         81.60924000          0.12508680          0.13505180
         30.48193000         -0.03221866          0.34488650
         12.29439000         -0.61722840          0.46285710
          5.03772200         -0.45259360          0.21104260
  1  0  1  6  1  1
         41.56291000         -0.00345422         -0.00672250
         13.67627000          0.07218428         -0.02806471
          5.84439000          0.25448200          0.05820028
          2.47160900         -0.29345340          0.39169880
          1.02830800         -0.73854550          0.50478230
          0.40725000         -0.19471570          0.17902900
  1  0  1  3  1  1
          1.57146400          0.05892219         -0.19301000
          0.60558000          0.29760550          0.09605620
          0.09856100         -1.14750600          0.98176090
  1  0  1  1  1  1
          0.03645900          1.00000000          1.00000000
  1  2  2  3  1
         18.41930000          0.08650816
          4.81266100          0.38266990
          1.44644700          0.70937720
  1  2  2  1  1
          0.40041300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# MANGANESE   (22s,16p,4d) -> [5s,4p,2d]
# MANGANESE   (1f)
MN 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      56347.14000000          0.00177158
       8460.94300000          0.01357081
       1927.32500000          0.06690605
        543.23430000          0.23185410
        173.99050000          0.47990460
         59.36005000          0.34957370
  1  0  1  6  1  1
       1165.41200000          0.00238875          0.00397732
        277.32760000          0.03181708          0.03103112
         89.47278000          0.12546700          0.13518940
         33.48256000         -0.02955431          0.34573870
         13.54037000         -0.61751600          0.46292050
          5.55797200         -0.45444580          0.20905920
  1  0  1  6  1  1
         45.83532000         -0.00366586         -0.00688758
         15.18777000          0.07231971         -0.02846816
          6.50071000          0.25444860          0.06031832
          2.75158300         -0.29103800          0.39389610
          1.14540400         -0.73598600          0.50137690
          0.45368700         -0.19976170          0.17922640
  1  0  1  3  1  1
          1.75799900          0.05628572         -0.50350240
          0.66702200          0.28974910          0.23450110
          0.10512900         -1.14065300          0.91412570
  1  0  1  1  1  1
          0.03841800          1.00000000          1.00000000
  1  2  2  3  1
         20.94355000          0.08672702
          5.51048600          0.38418830
          1.66503800          0.70690710
  1  2  2  1  1
          0.46173300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# IRON        (22s,16p,4d) -> [5s,4p,2d]
# IRON        (1f)
FE 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      61132.62000000          0.00176611
       9179.34200000          0.01353038
       2090.85700000          0.06673128
        589.24790000          0.23148230
        188.75430000          0.47970580
         64.44629000          0.35019760
  1  0  1  6  1  1
       1259.98000000          0.00243801          0.00402802
        299.87610000          0.03224048          0.03144647
         96.84917000          0.12657240          0.13683170
         36.31020000         -0.03139902          0.34872360
         14.72996000         -0.62075930          0.46179310
          6.06607500         -0.45029140          0.20430580
  1  0  1  6  1  1
         50.43485000         -0.00387326         -0.00701713
         16.83929000          0.07196598         -0.02877660
          7.19208600          0.25565910          0.06181383
          3.05342000         -0.28828370          0.39549460
          1.27364300         -0.73428220          0.49890590
          0.50409100         -0.20493530          0.17912510
  1  0  1  3  1  1
          1.95031600          0.05694869         -0.45937960
          0.73672100          0.28829150          0.28521390
          0.11417700         -1.13815900          0.90764850
  1  0  1  1  1  1
          0.04114800          1.00000000          1.00000000
  1  2  2  3  1
         23.14994000          0.08876935
          6.12236800          0.38963190
          1.84660100          0.70148160
  1  2  2  1  1
          0.50436100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COBALT      (22s,16p,4d) -> [5s,4p,2d]
# COBALT      (1f)
CO 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      66148.99000000          0.00175979
       9933.07700000          0.01348162
       2262.81600000          0.06649342
        637.91540000          0.23079390
        204.41220000          0.47929190
         69.82538000          0.35140970
  1  0  1  6  1  1
       1378.84100000          0.00237628          0.00397149
        328.26940000          0.03167450          0.03108174
        106.09460000          0.12628880          0.13574390
         39.83275000         -0.02584552          0.34768270
         16.18622000         -0.61834910          0.46263400
          6.66778800         -0.45670080          0.20516320
  1  0  1  6  1  1
         54.52355000         -0.00399300         -0.00729077
         18.29783000          0.07409663         -0.02926027
          7.86734800          0.25420000          0.06564150
          3.34053400         -0.29216570          0.40006520
          1.39375600         -0.73187030          0.49502360
          0.55132600         -0.20407840          0.17582400
  1  0  1  3  1  1
          2.15194700          0.05379843         -0.21654960
          0.81106300          0.27599710          0.12404880
          0.12101700         -1.12969200          0.97240640
  1  0  1  1  1  1
          0.04303700          1.00000000          1.00000000
  1  2  2  3  1
         25.59306000          0.09004748
          6.80099000          0.39317030
          2.05164700          0.69768440
  1  2  2  1  1
          0.55567100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NICKEL      (22s,16p,4d) -> [5s,4p,2d]
# NICKEL      (1f)
NI 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      71396.35000000          0.00175300
      10720.84000000          0.01343122
       2442.12900000          0.06627041
        688.42650000          0.23025080
        220.61530000          0.47901860
         75.39373000          0.35234440
  1  0  1  6  1  1
       1492.53200000          0.00237071          0.00396755
        355.40130000          0.03160566          0.03109479
        114.95340000          0.12663350          0.13595170
         43.22043000         -0.02417037          0.34851360
         17.59710000         -0.61877750          0.46254980
          7.25776500         -0.45767700          0.20351860
  1  0  1  6  1  1
         59.35261000         -0.00416200         -0.00742145
         20.02181000          0.07425111         -0.02953410
          8.61456100          0.25413600          0.06731852
          3.66053100         -0.29034770          0.40166600
          1.52811100         -0.73021210          0.49266230
          0.60405700         -0.20760570          0.17568930
  1  0  1  3  1  1
          2.37927600          0.05157888         -0.18876630
          0.88583900          0.27076110          0.10151990
          0.12852900         -1.12477000          0.97909060
  1  0  1  1  1  1
          0.04519500          1.00000000          1.00000000
  1  2  2  3  1
         28.19147000          0.09098881
          7.52358400          0.39582080
          2.27122800          0.69471540
  1  2  2  1  1
          0.61160300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COPPER      (22s,16p,4d) -> [5s,4p,2d]
# COPPER      (1f)
CU 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      76794.38000000          0.00174816
      11530.70000000          0.01339602
       2626.57500000          0.06610885
        740.49030000          0.22982650
        237.35280000          0.47876750
         81.15818000          0.35307390
  1  0  1  6  1  1
       1610.81400000          0.00236405          0.00396331
        383.63670000          0.03153635          0.03110223
        124.17330000          0.12694520          0.13613500
         46.74678000         -0.02262840          0.34929140
         19.06569000         -0.61920800          0.46247800
          7.87156700         -0.45853930          0.20201020
  1  0  1  6  1  1
         64.45732000         -0.00433108         -0.00752373
         21.85212000          0.07412307         -0.02975687
          9.40534300          0.25421080          0.06849654
          3.99916800         -0.28748430          0.40271410
          1.67029700         -0.72914360          0.49084900
          0.65962700         -0.21139510          0.17592680
  1  0  1  3  1  1
          2.60008800          0.05027577         -0.17029110
          0.96309400          0.26500400          0.09310133
          0.13616100         -1.12015500          0.98143360
  1  0  1  1  1  1
          0.04733200          1.00000000          1.00000000
  1  2  2  3  1
         30.85341000          0.09199905
          8.26498500          0.39850210
          2.49533200          0.69178970
  1  2  2  1  1
          0.66765800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# ZINC        (22s,16p,4d) -> [5s,4p,2d]
# ZINC        (1f)
ZN 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      82400.94000000          0.00174333
      12372.55000000          0.01335966
       2818.35100000          0.06594365
        794.57170000          0.22941510
        254.72320000          0.47854530
         87.13880000          0.35377530
  1  0  1  6  1  1
       1732.56900000          0.00236146          0.00396313
        412.71490000          0.03150177          0.03113411
        133.67800000          0.12727740          0.13639310
         50.38585000         -0.02145928          0.35012660
         20.58358000         -0.61976520          0.46231790
          8.50594000         -0.45901800          0.20049950
  1  0  1  6  1  1
         69.36492000         -0.00444010         -0.00768926
         23.62082000          0.07505253         -0.02997982
         10.18471000          0.25331110          0.07082411
          4.33408200         -0.28818970          0.40461410
          1.81091800         -0.72670520          0.48823250
          0.71484100         -0.21334390          0.17519700
  1  0  1  3  1  1
          2.82384200          0.04898543         -0.15867630
          1.03954300          0.25927930          0.08379327
          0.14326400         -1.11571100          0.98405470
  1  0  1  1  1  1
          0.04929600          1.00000000          1.00000000
  1  2  2  3  1
         33.70764000          0.09262648
          9.06110600          0.40029800
          2.73838300          0.68966080
  1  2  2  1  1
          0.73029400          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# BASIS="6-31++G**"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#Elements                             References
#--------                             ----------
#H,Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#
#Na - Ar  : M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#
#           DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn:   V.A. Rassolov, J.A. Pople, M.A. Ratner, and T.L. Windus
#           J. Chem. Phys. 109, 1223 (1998)
#           Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (Diffuse s)
# HYDROGEN    (1p)
H  6-31++Gxx 6-31++G**
  4
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE 6-31++Gxx 6-31++G**
  3
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0074000           1.0000000           1.0000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0207000           1.0000000           1.0000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0315000           1.0000000           1.0000000
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0438000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
N  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0639000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0845000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31++Gxx 6-31++G**
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
AR 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# BASIS="6-311G**"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H - Ar:  R. Krishnan, J.S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 72,
#         650 (1980)
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
H  6-311Gxx 6-311G**
  4
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE 6-311Gxx 6-311G**
  4
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (1d)
LI 6-311Gxx 6-311G**
  5
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (1d)
BE 6-311Gxx 6-311G**
  5
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (1d)
B  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (1d)
C  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (1d)
N  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (1d)
O  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (1d)
F  6-311Gxx 6-311G**
  5
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (1d)
NE 6-311Gxx 6-311G**
  5
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (1d)
NA 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (1d)
MG 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (1d)
AL 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (1d)
SI 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (1d)
P  6-311Gxx 6-311G**
 11
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (1d)
S  6-311Gxx 6-311G**
 11
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
        43.155300000          0.00000000          0.62446500
        18.107900000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (1d)
CL 6-311Gxx 6-311G**
 10
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (1d)
AR 6-311Gxx 6-311G**
 10
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
K  6-311Gxx 6-311G**
 17
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.22900000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
CA 6-311Gxx 6-311G**
 17
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.26000000          1.00000000
# GALLIUM     (14s,12p,5d) -> [8s,7p,2d]
# GALLIUM     (1d)
GA 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     333800.00000000          0.00083805          0.00000000
      50100.00000000          0.00624660          0.00000000
      11510.00000000          0.03202800          0.00000000
       3292.00000000          0.12709000          0.00000000
       1089.00000000          0.39092000          0.00000000
        401.00000000          0.54643000          0.18078000
        159.30000000          0.00000000          0.62239000
         67.59000000          0.00000000          0.24953000
  1  0  0  1  1
         24.89000000          1.00000000
  1  0  0  1  1
         10.68000000          1.00000000
  1  0  0  1  1
          3.38600000          1.00000000
  1  0  0  1  1
          1.33100000          1.00000000
  1  0  0  1  1
          0.18530000          1.00000000
  1  0  0  1  1
          0.06621000          1.00000000
  1  1  1  3  1
       2181.00000000          0.02256500
        515.40000000          0.18363000
        164.80000000          0.85984000
  1  1  1  5  2
         61.40000000          0.34345000          0.00000000
         24.98000000          0.50561000          0.00000000
         10.44000000          0.26224000          0.06413000
          5.58900000          0.00000000          0.37884000
          2.51700000          0.00000000          0.61669000
  1  1  1  1  1
          1.05300000          1.00000000
  1  1  1  1  1
          0.29150000          1.00000000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03990000          1.00000000
  1  2  2  4  1
         67.14000000          0.03095700
         18.94000000          0.17480000
          6.42600000          0.44346000
          2.19000000          0.56702000
  1  2  2  1  1
          0.67250000          1.00000000
  1  2  2  1  1
          0.16900000          1.00000000
# GERMANIUM   (14s,12p,5d) -> [8s,7p,2d]
# GERMANIUM   (1d)
GE 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     357500.00000000          0.00083898          0.00000000
      53670.00000000          0.00626350          0.00000000
      12300.00000000          0.03203600          0.00000000
       3512.00000000          0.12751000          0.00000000
       1161.00000000          0.39165000          0.00000000
        428.00000000          0.54528000          0.18160000
        170.00000000          0.00000000          0.62248000
         72.06000000          0.00000000          0.24872000
  1  0  0  1  1
         26.69000000          1.00000000
  1  0  0  1  1
         11.50000000          1.00000000
  1  0  0  1  1
          3.74200000          1.00000000
  1  0  0  1  1
          1.49900000          1.00000000
  1  0  0  1  1
          0.22920000          1.00000000
  1  0  0  1  1
          0.08675000          1.00000000
  1  1  1  3  1
       2345.00000000          0.02251400
        554.20000000          0.18335000
        177.30000000          0.86003000
  1  1  1  5  2
         66.13000000          0.34306000          0.00000000
         26.90000000          0.50652000          0.00000000
         11.26000000          0.26141000          0.06724600
          6.11600000          0.00000000          0.37238000
          2.81900000          0.00000000          0.61763000
  1  1  1  1  1
          1.21100000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16210000          1.00000000
  1  1  1  1  1
          0.06084000          1.00000000
  1  2  2  4  1
         74.84000000          0.03039000
         21.23000000          0.17319000
          7.29700000          0.44090000
          2.54900000          0.56532000
  1  2  2  1  1
          0.81650000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
# ARSENIC     (14s,12p,5d) -> [8s,7p,2d]
# ARSENIC     (1d)
AS 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     381200.00000000          0.00083327          0.00000000
      57240.00000000          0.00621980          0.00000000
      13110.00000000          0.03203000          0.00000000
       3743.00000000          0.12729000          0.00000000
       1238.00000000          0.39132000          0.00000000
        456.30000000          0.54581000          0.18097000
        181.40000000          0.00000000          0.62180000
         77.07000000          0.00000000          0.24988000
  1  0  0  1  1
         28.57000000          1.00000000
  1  0  0  1  1
         12.36000000          1.00000000
  1  0  0  1  1
          4.11700000          1.00000000
  1  0  0  1  1
          1.67800000          1.00000000
  1  0  0  1  1
          0.27610000          1.00000000
  1  0  0  1  1
          0.11050000          1.00000000
  1  1  1  3  1
       2528.00000000          0.02227100
        597.30000000          0.18199000
        190.70000000          0.86133000
  1  1  1  5  2
         70.96000000          0.34338000          0.00000000
         28.89000000          0.50598000          0.00000000
         12.13000000          0.26128000          0.06853600
          6.53300000          0.00000000          0.38282000
          3.02800000          0.00000000          0.60599000
  1  1  1  1  1
          1.34400000          1.00000000
  1  1  1  1  1
          0.58230000          1.00000000
  1  1  1  1  1
          0.25580000          1.00000000
  1  1  1  1  1
          0.08651000          1.00000000
  1  2  2  4  1
         86.05000000          0.02798900
         24.49000000          0.16502000
          8.44200000          0.43736000
          2.98100000          0.57255000
  1  2  2  1  1
          0.97900000          1.00000000
  1  2  2  1  1
          0.26400000          1.00000000
# SELENIUM    (14s,12p,5d) -> [8s,7p,2d]
# SELENIUM    (1d)
SE 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     405400.00000000          0.00083100          0.00000000
      60850.00000000          0.00623310          0.00000000
      13910.00000000          0.03207100          0.00000000
       3989.00000000          0.12636000          0.00000000
       1324.00000000          0.38899000          0.00000000
        487.00000000          0.54888000          0.17963000
        193.20000000          0.00000000          0.62227000
         82.19000000          0.00000000          0.25067000
  1  0  0  1  1
         30.52000000          1.00000000
  1  0  0  1  1
         13.25000000          1.00000000
  1  0  0  1  1
          4.51000000          1.00000000
  1  0  0  1  1
          1.86700000          1.00000000
  1  0  0  1  1
          0.31900000          1.00000000
  1  0  0  1  1
          0.11200000          1.00000000
  1  1  1  3  1
       2706.00000000          0.02214600
        638.60000000          0.18180000
        203.80000000          0.86155000
  1  1  1  5  2
         75.96000000          0.34243000          0.00000000
         31.02000000          0.50541000          0.00000000
         13.05000000          0.26237000          0.07016300
          6.98600000          0.00000000          0.38419000
          3.23400000          0.00000000          0.60368000
  1  1  1  1  1
          1.47500000          1.00000000
  1  1  1  1  1
          0.72750000          1.00000000
  1  1  1  1  1
          0.28690000          1.00000000
  1  1  1  1  1
          0.09679000          1.00000000
  1  2  2  4  1
         99.01000000          0.02559600
         28.41000000          0.15459000
          9.86300000          0.42878000
          3.51400000          0.58620000
  1  2  2  1  1
          1.17100000          1.00000000
  1  2  2  1  1
          0.30500000          1.00000000
# BROMINE     (14s,12p,5d) -> [8s,7p,2d]
# BROMINE     (1d)
BR 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     439700.00000000          0.00081300          0.00000000
      66030.00000000          0.00628500          0.00000000
      15140.00000000          0.03192000          0.00000000
       4317.00000000          0.12880000          0.00000000
       1414.00000000          0.39460000          0.00000000
        523.90000000          0.54130000          0.18310000
        207.70000000          0.00000000          0.61760000
         86.54000000          0.00000000          0.25380000
  1  0  0  1  1
         30.52000000          1.00000000
  1  0  0  1  1
         12.98000000          1.00000000
  1  0  0  1  1
          4.41200000          1.00000000
  1  0  0  1  1
          1.86200000          1.00000000
  1  0  0  1  1
          0.39320000          1.00000000
  1  0  0  1  1
          0.14000000          1.00000000
  1  1  1  3  1
       2957.00000000          0.02226000
        700.30000000          0.18020000
        224.60000000          0.86240000
  1  1  1  5  2
         82.59000000          0.34400000          0.00000000
         33.19000000          0.50710000          0.00000000
         14.20000000          0.25900000          0.07965000
          7.43800000          0.00000000          0.37340000
          3.52600000          0.00000000          0.60490000
  1  1  1  1  1
          1.59500000          1.00000000
  1  1  1  1  1
          0.84620000          1.00000000
  1  1  1  1  1
          0.31860000          1.00000000
  1  1  1  1  1
          0.10960000          1.00000000
  1  2  2  4  1
        134.80000000          0.01831000
         36.39000000          0.13500000
         12.16000000          0.42610000
          4.34100000          0.60430000
  1  2  2  1  1
          1.53500000          1.00000000
  1  2  2  1  1
          0.45100000          1.00000000
# KRYPTON     (14s,12p,5d) -> [8s,7p,2d]
# KRYPTON     (1d)
KR 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     456200.00000000          0.00081110          0.00000000
      68460.00000000          0.00625520          0.00000000
      15650.00000000          0.03202200          0.00000000
       4500.00000000          0.12546000          0.00000000
       1497.00000000          0.38666000          0.00000000
        550.50000000          0.55188000          0.17711000
        218.20000000          0.00000000          0.62248000
         92.97000000          0.00000000          0.25279000
  1  0  0  1  1
         34.59000000          1.00000000
  1  0  0  1  1
         15.12000000          1.00000000
  1  0  0  1  1
          5.34600000          1.00000000
  1  0  0  1  1
          2.27300000          1.00000000
  1  0  0  1  1
          0.48410000          1.00000000
  1  0  0  1  1
          0.18490000          1.00000000
  1  1  1  3  1
       3074.00000000          0.02199800
        725.70000000          0.18102000
        231.50000000          0.86223000
  1  1  1  5  2
         86.45000000          0.34155000          0.00000000
         35.55000000          0.50255000          0.00000000
         15.14000000          0.26453000          0.07167000
          8.03100000          0.00000000          0.39708000
          3.79900000          0.00000000          0.58762000
  1  1  1  1  1
          1.84900000          1.00000000
  1  1  1  1  1
          0.86760000          1.00000000
  1  1  1  1  1
          0.33290000          1.00000000
  1  1  1  1  1
          0.11990000          1.00000000
  1  2  2  4  1
        122.50000000          0.02337700
         35.37000000          0.14610000
         12.39000000          0.42230000
          4.49600000          0.59452000
  1  2  2  1  1
          1.54600000          1.00000000
  1  2  2  1  1
          0.39500000          1.00000000
# IODINE      (15s,12p,6d) -> [10s,9p,4d]
# IODINE      (1d)
I  6-311Gxx 6-311G**
 24
  1  0  0  5  1
     444750.00000000          0.00089000
      66127.00000000          0.00694000
      14815.00000000          0.03609000
       4144.90000000          0.13568000
       1361.20000000          0.33878000
  1  0  0  2  1
        508.44000000          0.43659000
        209.59000000          0.18375000
  1  0  0  1  1
         81.95900000          1.00000000
  1  0  0  1  1
         36.80500000          1.00000000
  1  0  0  1  1
         13.49500000          1.00000000
  1  0  0  1  1
          6.88590000          1.00000000
  1  0  0  1  1
          2.55200000          1.00000000
  1  0  0  1  1
          1.20880000          1.00000000
  1  0  0  1  1
          0.27340000          1.00000000
  1  0  0  1  1
          0.10090000          1.00000000
  1  1  1  4  1
       2953.60000000          0.01221000
        712.61000000          0.08587000
        236.71000000          0.29493000
         92.63100000          0.47849000
  1  1  1  1  1
         39.73200000          1.00000000
  1  1  1  1  1
         17.27300000          1.00000000
  1  1  1  1  1
          7.95700000          1.00000000
  1  1  1  1  1
          3.15290000          1.00000000
  1  1  1  1  1
          1.33280000          1.00000000
  1  1  1  1  1
          0.49470000          1.00000000
  1  1  1  1  1
          0.21600000          1.00000000
  1  1  1  1  1
          0.08293000          1.00000000
  1  2  2  3  1
        261.95000000          0.03144000
         76.73400000          0.19028000
         27.55100000          0.47247000
  1  2  2  1  1
         10.60600000          1.00000000
  1  2  2  1  1
          3.42170000          1.00000000
  1  2  2  1  1
          1.13700000          1.00000000
  1  2  2  1  1
          0.30200000          1.00000000
# BASIS="6-311++G**"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H - Ar:  R. Krishnan, J.S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 72,
#         650 (1980)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
# HYDROGEN    (Diffuse s)
H  6-311++Gxx 6-311++G**
  5
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE 6-311++Gxx 6-311++G**
  4
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (1d)
# LITHIUM     (Diffuse sp)
LI 6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (1d)
# BERYLLIUM   (Diffuse sp)
BE 6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (1d)
# BORON       (Diffuse sp)
B  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (1d)
# CARBON      (Diffuse sp)
C  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (1d)
# NITROGEN    (Diffuse sp)
N  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (1d)
# OXYGEN      (Diffuse sp)
O  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (1d)
# FLUORINE    (Diffuse sp)
F  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (1d)
NE 6-311++Gxx 6-311++G**
  5
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
# BASIS="6-311++G(2d,2p)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (2p)
# HYDROGEN    (Diffuse s)
H  6-311++G2d2p    6-311++G(2d,2p)
  6
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (2p)
HE 6-311++G2d2p    6-311++G(2d,2p)
  5
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (2d)
# LITHIUM     (Diffuse sp)
LI 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (2d)
# BERYLLIUM   (Diffuse sp)
BE 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.12750000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (2d)
# BORON       (Diffuse sp)
B  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.80200000          1.00000000
  1  2  2  1  1
          0.20050000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (2d)
# CARBON      (Diffuse sp)
C  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          1.25200000          1.00000000
  1  2  2  1  1
          0.31300000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (2d)
# NITROGEN    (Diffuse sp)
N  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          1.82600000          1.00000000
  1  2  2  1  1
          0.45650000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (2d)
# OXYGEN      (Diffuse sp)
O  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          2.58400000          1.00000000
  1  2  2  1  1
          0.64600000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (2d)
# FLUORINE    (Diffuse sp)
F  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          2.39600000          1.00000000
  1  2  2  1  1
          0.87500000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (2d)
# NEON        (Diffuse sp)
NE 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          4.60800000          1.00000000
  1  2  2  1  1
          1.15200000          1.00000000
  1  0  1  1  1  1
          0.13000000          1.00000000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (1d)
# SODIUM      (Diffuse sp)
NA 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.08750000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (1d)
# MAGNESIUM   (Diffuse sp)
MG 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.08750000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (1d)
# ALUMINUM    (Diffuse sp)
AL 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.16250000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (1d)
# SILICON     (Diffuse sp)
SI 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
  1  2  2  1  1
          0.22500000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (1d)
# PHOSPHORUS  (Diffuse sp)
P  6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.27500000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (1d)
# SULFUR      (Diffuse sp)
S  6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
         43.15530000          0.00000000          0.62446500
         18.10790000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (1d)
# CHLORINE    (Diffuse sp)
CL 6-311++G2d2p    6-311++G(2d,2p)
 12
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          1.50000000          1.00000000
  1  2  2  1  1
          0.37500000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (1d)
# ARGON       (Diffuse sp)
AR 6-311++G2d2p    6-311++G(2d,2p)
 12
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          1.70000000          1.00000000
  1  2  2  1  1
          0.42500000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
# POTASSIUM   (Diffuse sp)
K  6-311++G2d2p    6-311++G(2d,2p)
 19
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.45800000          1.00000000
  1  2  2  1  1
          0.11450000          1.00000000
  1  0  1  1  1  1
          0.00470000          1.00000000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
# CALCIUM     (Diffuse sp)
CA 6-311++G2d2p    6-311++G(2d,2p)
 19
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  0  1  1  1  1
          0.00710000          1.00000000          1.00000000
# BASIS="6-311G(2df,2pd)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (2p,1d)
H  6-311G2df2dp    6-311G(2df,2pd)
  6
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (2p,1d)
HE 6-311G2df2dp    6-311G(2df,2pd)
  6
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (2d,1f)
LI 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (2d,1f)
BE 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.12750000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (2d,1f)
B  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.80200000          1.00000000
  1  2  2  1  1
          0.20050000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (2d,1f)
C  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          1.25200000          1.00000000
  1  2  2  1  1
          0.31300000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (2d,1f)
N  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          1.82600000          1.00000000
  1  2  2  1  1
          0.45650000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (2d,1f)
O  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          2.58400000          1.00000000
  1  2  2  1  1
          0.64600000          1.00000000
  1  3  3  1  1
          1.40000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (2d,1f)
F  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          2.39600000          1.00000000
  1  2  2  1  1
          0.87500000          1.00000000
  1  3  3  1  1
          1.85000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (2d,1f)
NE 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          4.60800000          1.00000000
  1  2  2  1  1
          1.15200000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
K  6-311G2df2dp    6-311G(2df,2pd)
 19
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.45800000          1.00000000
  1  2  2  1  1
          0.11450000          1.00000000
  1  3  3  1  1
          1.11000000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
CA 6-311G2df2dp    6-311G(2df,2pd)
 19
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          1.33000000          1.00000000
# BASIS="6-311++G(3df,3pd)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (3p,1d)
# HYDROGEN    (Diffuse s)
H  6-311++G3df3pd    6-311++G(3df,3pd)
  8
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          3.00000000          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  1  1  1  1
          0.18750000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (3p,1d)
HE 6-311++G3df3pd    6-311++G(3df,3pd)
  7
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          3.00000000          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  1  1  1  1
          0.18750000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (3d,1f)
# LITHIUM     (Diffuse sp)
LI 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05000000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (3d,1f)
# BERYLLIUM   (Diffuse sp)
BE 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          1.02000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
  1  2  2  1  1
          0.06375000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (3d,1f)
# BORON       (Diffuse sp)
B  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          1.60400000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
  1  2  2  1  1
          0.10025000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (3d,1f)
# CARBON      (Diffuse sp)
C  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          2.50400000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
  1  2  2  1  1
          0.15650000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (3d,1f)
# NITROGEN    (Diffuse sp)
N  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          3.65200000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
  1  2  2  1  1
          0.22825000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (3d,1f)
# OXYGEN      (Diffuse sp)
O  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          5.16000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
  1  2  2  1  1
          0.32250000          1.00000000
  1  3  3  1  1
          1.40000000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (3d,1f)
# FLUORINE    (Diffuse sp)
F  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.43750000          1.00000000
  1  3  3  1  1
          1.85000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (3d,1f)
# NEON        (Diffuse sp)
NE 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          9.21600000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
  1  2  2  1  1
          0.57600000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  0  1  1  1  1
          0.13000000          1.00000000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (3d,1f)
# SODIUM      (Diffuse sp)
NA 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          0.04375000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (3d,1f)
# MAGNESIUM   (Diffuse sp)
MG 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          0.04375000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (3d,1f)
# ALUMINUM    (Diffuse sp)
AL 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.08125000          1.00000000
  1  3  3  1  1
          0.25000000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (3d,1f)
# SILICON     (Diffuse sp)
SI 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.11250000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (3d,1f)
# PHOSPHORUS  (Diffuse sp)
P  6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.13750000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (3d,1f)
# SULFUR      (Diffuse sp)
S  6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
         43.15530000          0.00000000          0.62446500
         18.10790000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.16250000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (3d,1f)
# CHLORINE    (Diffuse sp)
CL 6-311++G3df3pd    6-311++G(3df,3pd)
 14
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.18750000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (3d,1f)
# ARGON       (Diffuse sp)
AR 6-311++G3df3pd    6-311++G(3df,3pd)
 14
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          3.40000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  2  2  1  1
          0.21250000          1.00000000
  1  3  3  1  1
          0.85000000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
#  pc-0  EMSL  Basis Set Exchange Library  6/6/08 12:12 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
# K Ca Ga Ge As Se Br Kr: Frank Jensen, Polarization Consistent Basis Sets. VII. The Elements K, Ca, Ga, Ge, As, Se, Br and Kr, J. Chem. Phys. 136, 094110 (2012).
#
# HYDROGEN
H  pc-0
  2
  1  0  0  2  1
          4.34480000          0.07929900
          0.66049000          0.42422000
  1  0  0  1  1
          0.13669000          1.00000000
# HELIUM
He pc-0
  2
  1  0  0  2  1
         13.21000000          0.04350600
          1.94340000          0.21166000
  1  0  0  1  1
          0.35443000          1.00000000
# LITHIUM
Li pc-0
  3
  1  0  0  4  2
         97.58500000          0.02235800          0.00000000
         14.75500000          0.14499000          0.00518750
          3.22330000          0.34594000          0.16698000
          0.78789000          0.00000000          0.72566000
  1  0  0  1  1
          0.05100900          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
# BERYLLIUM
Be pc-0
  3
  1  0  0  4  2
        187.54000000          0.01037300          0.00000000
         28.34500000          0.07200700         -0.00205070
          6.26140000          0.13085000          0.11312000
          1.58370000          0.00000000          0.30800000
  1  0  0  1  1
          0.10858000          1.00000000
  1  1  1  1  1
          0.43000000          1.00000000
# BORON
B  pc-0
  4
  1  0  0  4  2
        303.73000000          0.02012100          0.00000000
         45.89400000          0.14410000         -0.00738180
         10.20500000          0.21961000          0.26153000
          2.63480000          0.00000000          0.59363000
  1  0  0  1  1
          0.19380000          1.00000000
  1  1  1  2  1
          2.79040000          0.10986000
          0.54195000          0.46846000
  1  1  1  1  1
          0.11876000          1.00000000
# CARBON
C  pc-0
  4
  1  0  0  4  2
        446.51000000          0.01978800          0.00000000
         67.46200000          0.14534000         -0.00999100
         15.06700000          0.18529000          0.28519000
          3.93880000          0.00000000          0.56687000
  1  0  0  1  1
          0.29991000          1.00000000
  1  1  1  2  1
          4.36770000          0.11671000
          0.86982000          0.47558000
  1  1  1  1  1
          0.18893000          1.00000000
# NITROGEN
N  pc-0
  4
  1  0  0  4  2
        615.85000000          0.01958800          0.00000000
         93.04400000          0.14695000         -0.01205900
         20.84800000          0.15560000          0.30199000
          5.49590000          0.00000000          0.54090000
  1  0  0  1  1
          0.42624000          1.00000000
  1  1  1  2  1
          6.26800000          0.12134000
          1.26900000          0.48013000
  1  1  1  1  1
          0.27390000          1.00000000
# OXYGEN
O  pc-0
  4
  1  0  0  4  2
        812.12000000          0.01945000          0.00000000
        122.69000000          0.14774000         -0.01318900
         27.56100000          0.13593000          0.31510000
          7.31730000          0.00000000          0.52964000
  1  0  0  1  1
          0.57924000          1.00000000
  1  1  1  2  1
          8.21780000          0.12902000
          1.67540000          0.48706000
  1  1  1  1  1
          0.35067000          1.00000000
# FLUORINE
F  pc-0
  4
  1  0  0  4  2
       1035.10000000          0.01935100          0.00000000
        156.38000000          0.14884000         -0.01433700
         35.19600000          0.11735000          0.32551000
          9.39210000          0.00000000          0.51681000
  1  0  0  1  1
          0.75342000          1.00000000
  1  1  1  2  1
         10.59900000          0.13273000
          2.17330000          0.48938000
  1  1  1  1  1
          0.44871000          1.00000000
# NEON
Ne pc-0
  4
  1  0  0  4  2
       1284.50000000          0.09641900          0.00000000
        194.05000000          0.75019000         -0.00767080
         43.74600000          0.49765000          0.16693000
         11.72000000          0.00000000          0.25151000
  1  0  0  1  1
          0.94746000          1.00000000
  1  1  1  2  1
         13.34800000          0.06746700
          2.75090000          0.24531000
  1  1  1  1  1
          0.56434000          1.00000000
# SODIUM
Na pc-0
  4
  1  0  0  7  3
       4553.50000000          0.00515830          0.00000000          0.00000000
        685.09000000          0.03860000         -0.00031854          0.00000000
        155.73000000          0.17385000         -0.00226480         -0.00007913
         43.37100000          0.45646000         -0.03392300         -0.00069906
         13.33900000          0.46291000         -0.07630900         -0.00320830
          2.31060000          0.00000000          0.33727000          0.03005600
          0.70669000          0.00000000          0.00000000          0.11224000
  1  0  0  1  1
          0.04594200          1.00000000
  1  1  1  4  1
         37.79300000          0.04649500
          8.41340000          0.24311000
          2.32100000          0.51738000
          0.60658000          0.42598000
  1  1  1  1  1
          0.09500000          1.00000000
# MAGNESIUM
Mg pc-0
  4
  1  0  0  7  3
       5520.80000000          0.00252540          0.00000000          0.00000000
        830.56000000          0.01893200         -0.00015190          0.00000000
        188.81000000          0.08556500         -0.00087484         -0.00116040
         52.63800000          0.22776000         -0.01460700         -0.00988450
         16.23300000          0.23565000         -0.03034900         -0.04341600
          2.92750000          0.00000000          0.10360000          0.31196000
          0.94786000          0.00000000          0.00000000          0.72645000
  1  0  0  1  1
          0.07636100          1.00000000
  1  1  1  4  1
         49.45300000          0.02173900
         11.11600000          0.11690000
          3.12730000          0.25993000
          0.85940000          0.21108000
  1  1  1  1  1
          0.16000000          1.00000000
# ALUMINUM
Al pc-0
  4
  1  0  0  7  3
       6587.10000000          0.00495700          0.00000000          0.00000000
        990.92000000          0.03722300         -0.00029525          0.00000000
        225.29000000          0.16875000         -0.00156740         -0.00034383
         62.86600000          0.45505000         -0.02743400         -0.00293810
         19.43200000          0.48010000         -0.05560000         -0.01304700
          3.62070000          0.00000000          0.15188000          0.08567900
          1.22880000          0.00000000          0.00000000          0.18025000
  1  0  0  1  1
          0.12068000          1.00000000
  1  1  1  5  2
         72.36500000          0.03295300          0.00000000
         16.54300000          0.18989000         -0.00030607
          4.82390000          0.47489000         -0.00812540
          1.43360000          0.48033000          0.00582160
          0.27689000          0.00000000          0.37831000
  1  1  1  1  1
          0.06985600          1.00000000
# SILICON
Si pc-0
  4
  1  0  0  7  3
       7743.00000000          0.00488250          0.00000000          0.00000000
       1164.70000000          0.03674100         -0.00029111          0.00000000
        264.82000000          0.16695000         -0.00141220         -0.00044437
         73.96800000          0.45657000         -0.02604600         -0.00380670
         22.91200000          0.49043000         -0.05093300         -0.01707800
          4.37410000          0.00000000          0.10810000          0.10569000
          1.53910000          0.00000000          0.00000000          0.20429000
  1  0  0  1  1
          0.16775000          1.00000000
  1  1  1  5  2
         96.08000000          0.02803500          0.00000000
         22.15000000          0.16819000         -0.00072797
          6.56300000          0.45197000         -0.00866440
          2.02500000          0.50132000         -0.00353440
          0.47780000          0.00000000          0.31085000
  1  1  1  1  1
          0.12824000          1.00000000
# PHOSPHOROUS
P  pc-0
  4
  1  0  0  7  3
       8990.80000000          0.00482060          0.00000000          0.00000000
       1352.40000000          0.03639200          0.00289000          0.00000000
        307.50000000          0.16563000          0.01263800         -0.00054512
         85.94100000          0.46217000          0.24790000         -0.00468380
         26.67100000          0.50582000          0.46165000         -0.02116000
          5.18810000          0.00000000         -0.70180000          0.12534000
          1.87780000          0.00000000          0.00000000          0.22427000
  1  0  0  1  1
          0.22010000          1.00000000
  1  1  1  5  2
        111.64000000          0.02866300          0.00000000
         25.78400000          0.17265000         -0.00068545
          7.67250000          0.46181000         -0.01129600
          2.39960000          0.49174000          0.00329620
          0.54943000          0.00000000          0.41613000
  1  1  1  1  1
          0.14748000          1.00000000
# SULFUR
S  pc-0
  4
  1  0  0  7  3
      10330.00000000          0.00476850          0.00000000          0.00000000
       1553.70000000          0.03620900          0.00289030          0.00000000
        353.30000000          0.16491000          0.01157500         -0.00062501
         98.80500000          0.47548000          0.23993000         -0.00538810
         30.71600000          0.53319000          0.42830000         -0.02452100
          6.06330000          0.00000000         -0.42063000          0.14132000
          2.24750000          0.00000000          0.00000000          0.23948000
  1  0  0  1  1
          0.27853000          1.00000000
  1  1  1  5  2
        129.76000000          0.02870600          0.00000000
         30.02500000          0.17420000         -0.00011785
          8.97330000          0.46709000         -0.01448300
          2.84400000          0.48571000          0.01593900
          0.63361000          0.00000000          0.48257000
  1  1  1  1  1
          0.16955000          1.00000000
# CHLORINE
Cl pc-0
  4
  1  0  0  7  3
      11759.00000000          0.00472480          0.00000000          0.00000000
       1768.60000000          0.03654600          0.00290530          0.00000000
        402.19000000          0.16597000          0.01066400         -0.00069197
        112.54000000          0.52530000          0.23406000         -0.00597600
         35.03900000          0.61955000          0.39915000         -0.02739400
          6.99560000          0.00000000         -0.17937000          0.15516000
          2.64550000          0.00000000          0.00000000          0.25028000
  1  0  0  1  1
          0.34157000          1.00000000
  1  1  1  5  2
        150.66000000          0.02829900          0.00000000
         34.93300000          0.17336000          0.00013598
         10.49200000          0.46812000         -0.01661100
          3.37260000          0.48321000          0.02235100
          0.75989000          0.00000000          0.51192000
  1  1  1  1  1
          0.20289000          1.00000000
# ARGON
Ar pc-0
  4
  1  0  0  7  3
      13277.00000000          0.02344000          0.00000000          0.00000000
       1996.90000000          0.15225000          0.00146890          0.00000000
        454.12000000          0.72536000          0.00492820         -0.00037469
        127.14000000          0.33180000          0.11458000         -0.00324620
         39.63700000         -0.63751000          0.18548000         -0.01496800
          7.98170000          0.00000000          0.02189400          0.08393600
          3.07060000          0.00000000          0.00000000          0.12891000
  1  0  0  1  1
          0.40908000          1.00000000
  1  1  1  5  2
        173.23000000          0.01395500          0.00000000
         40.23900000          0.08622600          0.00013131
         12.13900000          0.23423000         -0.00914820
          3.95270000          0.24062000          0.01328000
          0.90626000          0.00000000          0.26503000
  1  1  1  1  1
          0.24252000          1.00000000
# K (8s,7p) -> [5s,3p]
K pc-0
  4
  1  0  0  7  4
      0.11700D+05            0.66806D-02           -0.84480D-03            0.27396D-03            0.16212D-03
      0.17627D+04            0.49297D-01           -0.68033D-02            0.22356D-02            0.13221D-02
      0.40300D+03            0.21643D+00           -0.28680D-01            0.93160D-02            0.55206D-02
      0.11520D+03            0.50000D+00           -0.99591D-01            0.34039D-01            0.20179D-01
      0.37693D+02            0.43209D+00           -0.80208D-01            0.27069D-01            0.16240D-01
      0.51906D+01            0.21821D-01            0.50000D+00           -0.27541D+00           -0.17421D+00
      0.51212D+00           -0.34634D-02            0.44969D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.34289D-01            1.0000000
  1  1  1  6  2
      0.20292D+03            0.26919D-01           -0.71552D-02
      0.47229D+02            0.16901D+00           -0.45049D-01
      0.14320D+02            0.46749D+00           -0.14000D+00
      0.47180D+01            0.50000D+00           -0.11626D+00
      0.11465D+01            0.77563D-01            0.42769D+00
      0.33359D+00           -0.15304D-01            0.50000D+00
  1  1  1  1  1
      0.66700D-01            1.0000000
# Ca (8s,7p) -> [5s,3p]
Ca pc-0
  4
  1  0  0  7  4
      0.13100D+05            0.66249D-02           -0.84491D-03            0.28173D-03            0.16173D-03
      0.19736D+04            0.48908D-01           -0.67975D-02            0.22976D-02            0.13195D-02
      0.45122D+03            0.21524D+00           -0.28786D-01            0.96153D-02            0.55252D-02
      0.12902D+03            0.50000D+00           -0.10001D+00            0.35205D-01            0.20293D-01
      0.42226D+02            0.43720D+00           -0.82929D-01            0.28853D-01            0.16750D-01
      0.59019D+01            0.22828D-01            0.50000D+00           -0.28622D+00           -0.17702D+00
      0.62065D+00           -0.38011D-02            0.46934D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.48923D-01            1.0000000
  1  1  1  6  2
      0.23476D+03            0.25391D-01           -0.72251D-02
      0.54750D+02            0.16141D+00           -0.46231D-01
      0.16675D+02            0.45563D+00           -0.14603D+00
      0.55491D+01            0.50000D+00           -0.12928D+00
      0.14127D+01            0.83328D-01            0.42412D+00
      0.43559D+00           -0.15832D-01            0.50000D+00
  1  1  1  1  1
      0.87100D-01            1.0000000
# Ga (8s,7p,4d) -> [5s,4p,1d]
Ga pc-0
  5
  1  0  0  7  4
      0.32518D+05            0.64796D-02           -0.86979D-03            0.30313D-03            0.17542D-03
      0.48984D+04            0.47895D-01           -0.69755D-02            0.24867D-02            0.14405D-02
      0.11205D+04            0.21257D+00           -0.30065D-01            0.10459D-01            0.60576D-02
      0.32165D+03            0.50000D+00           -0.10477D+00            0.39426D-01            0.22957D-01
      0.10652D+03            0.45042D+00           -0.93282D-01            0.33267D-01            0.19463D-01
      0.16461D+02            0.26287D-01            0.50000D+00           -0.30729D+00           -0.19306D+00
      0.19606D+01           -0.43419D-02            0.45974D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.13897D+00            1.0000000
  1  1  1  6  3
      0.66913D+03            0.22011D-01           -0.70070D-02           -0.60655D-02
      0.15739D+03            0.14768D+00           -0.47280D-01           -0.42072D-01
      0.49046D+02            0.44246D+00           -0.16133D+00           -0.13980D+00
      0.17088D+02            0.50000D+00           -0.14368D+00           -0.13597D+00
      0.48489D+01            0.85190D-01            0.41775D+00            0.50000D+00
      0.15404D+01           -0.11890D-01            0.50000D+00            0.35834D+00
  1  1  1  1  1
      0.11947D+00            1.0000000
  1  2  2  4  1
      0.37511D+02            0.69317D-01
      0.10190D+02            0.29699D+00
      0.31145D+01            0.50000D+00
      0.83319D+00            0.41181D+00
# Ge (8s,7p,4d) -> [5s,4p,1d]
Ge pc-0
  5
  1  0  0  7  4
      0.34756D+05            0.64652D-02           -0.87051D-03            0.30600D-03            0.17397D-03
      0.52355D+04            0.47793D-01           -0.69796D-02            0.25095D-02            0.14287D-02
      0.11976D+04            0.21227D+00           -0.30121D-01            0.10570D-01            0.60144D-02
      0.34385D+03            0.50000D+00           -0.10501D+00            0.39864D-01            0.22822D-01
      0.11393D+03            0.45186D+00           -0.94135D-01            0.33925D-01            0.19492D-01
      0.17697D+02            0.26657D-01            0.50000D+00           -0.31100D+00           -0.19266D+00
      0.21448D+01           -0.45014D-02            0.46990D-01            0.50000D+00            0.50000D+00
   1  0  0  1  1
      0.17441D+00            1.0000000
   1  1  1  6  3
      0.72452D+03            0.21519D-01           -0.68930D-02           -0.59909D-02
      0.17051D+03            0.14503D+00           -0.46759D-01           -0.41854D-01
      0.53205D+02            0.43776D+00           -0.16055D+00           -0.13975D+00
      0.18584D+02            0.50000D+00           -0.14650D+00           -0.13987D+00
      0.53391D+01            0.87780D-01            0.40654D+00            0.50000D+00
      0.17314D+01           -0.12215D-01            0.50000D+00            0.36023D+00
   1  1  1  1  1
      0.16012D+00            1.0000000
   1  2  2  4  1
      0.43059D+02            0.65306D-01
      0.11804D+02            0.28779D+00
      0.36775D+01            0.50000D+00
      0.10291D+01            0.40102D+00
# As (8s,7p,4d) -> [5s,4p,1d]
As pc-0
  5
  1  0  0  7  4
      0.37076D+05            0.64504D-02           -0.87102D-03            0.30870D-03            0.17282D-03
      0.55849D+04            0.47689D-01           -0.69822D-02            0.25309D-02            0.14192D-02
      0.12775D+04            0.21196D+00           -0.30170D-01            0.10677D-01            0.59809D-02
      0.36685D+03            0.50000D+00           -0.10522D+00            0.40279D-01            0.22726D-01
      0.12160D+03            0.45330D+00           -0.94974D-01            0.34578D-01            0.19551D-01
      0.18979D+02            0.27025D-01            0.50000D+00           -0.31468D+00           -0.19261D+00
      0.23416D+01           -0.46585D-02            0.47958D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.21089D+00            1.0000000
  1  1  1  6  3
      0.78136D+03            0.21115D-01           -0.68265D-02           -0.59138D-02
      0.18397D+03            0.14286D+00           -0.46501D-01           -0.41566D-01
      0.57480D+02            0.43386D+00           -0.16061D+00           -0.13940D+00
      0.20130D+02            0.50000D+00           -0.14916D+00           -0.14268D+00
      0.58418D+01            0.90099D-01            0.39850D+00            0.50000D+00
      0.19352D+01           -0.12582D-01            0.50000D+00            0.35672D+00
  1  1  1  1  1
      0.20202D+00            1.0000000
  1  2  2  4  1
      0.48794D+02            0.62126D-01
      0.13477D+02            0.28036D+00
      0.42626D+01            0.50000D+00
      0.12350D+01            0.39254D+00
# Se (8s,7p,4d) -> [5s,4p,1d]
Se pc-0
  5
  1  0  0  7  4
      0.39475D+05            0.64361D-02           -0.87145D-03            0.31130D-03            0.17182D-03
      0.59461D+04            0.47590D-01           -0.69843D-02            0.25513D-02            0.14111D-02
      0.13602D+04            0.21165D+00           -0.30215D-01            0.10780D-01            0.59528D-02
      0.39064D+03            0.50000D+00           -0.10542D+00            0.40677D-01            0.22647D-01
      0.12953D+03            0.45473D+00           -0.95798D-01            0.35226D-01            0.19626D-01
      0.20309D+02            0.27392D-01            0.50000D+00           -0.31831D+00           -0.19275D+00
      0.25506D+01           -0.48156D-02            0.48904D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.24979D+00            1.0000000
  1  1  1  6  3
      0.83900D+03            0.20814D-01           -0.68145D-02           -0.58001D-02
      0.19762D+03            0.14130D+00           -0.46557D-01           -0.40994D-01
      0.61821D+02            0.43103D+00           -0.16168D+00           -0.13788D+00
      0.21706D+02            0.50000D+00           -0.15159D+00           -0.14360D+00
      0.63458D+01            0.91969D-01            0.39440D+00            0.50000D+00
      0.21475D+01           -0.12998D-01            0.50000D+00            0.33994D+00
  1  1  1  1  1
      0.24524D+00            1.0000000
  1  2  2  4  1
      0.54720D+02            0.59557D-01
      0.15209D+02            0.27431D+00
      0.48700D+01            0.50000D+00
      0.14509D+01            0.38567D+00
# Br (8s,7p,4d) -> [5s,4p,1d]
Br pc-0
  5
  1  0  0  7  4
      0.41956D+05            0.64215D-02           -0.87170D-03            0.31368D-03            0.17100D-03
      0.63198D+04            0.47487D-01           -0.69847D-02            0.25700D-02            0.14043D-02
      0.14457D+04            0.21134D+00           -0.30252D-01            0.10875D-01            0.59304D-02
      0.41524D+03            0.50000D+00           -0.10560D+00            0.41048D-01            0.22591D-01
      0.13773D+03            0.45616D+00           -0.96604D-01            0.35855D-01            0.19718D-01
      0.21686D+02            0.27752D-01            0.50000D+00           -0.32181D+00           -0.19307D+00
      0.27710D+01           -0.49678D-02            0.49789D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.29002D+00            1.0000000
  1  1  1  6  3
      0.89656D+03            0.20639D-01           -0.68701D-02           -0.56951D-02
      0.21126D+03            0.14047D+00           -0.47007D-01           -0.40391D-01
      0.66163D+02            0.42956D+00           -0.16402D+00           -0.13628D+00
      0.23291D+02            0.50000D+00           -0.15377D+00           -0.14269D+00
      0.68373D+01            0.93239D-01            0.39517D+00            0.50000D+00
      0.23641D+01           -0.13486D-01            0.50000D+00            0.32013D+00
  1  1  1  1  1
      0.29044D+00            1.0000000
  1  2  2  4  1
      0.60862D+02            0.57410D-01
      0.17007D+02            0.26921D+00
      0.55023D+01            0.50000D+00
      0.16773D+01            0.37994D+00
# Kr (8s,7p,4d) -> [5s,4p,1d]
Kr pc-0
  5
  1  0  0  7  4
      0.44517D+05            0.64072D-02           -0.87186D-03            0.31589D-03            0.17032D-03
      0.67055D+04            0.47387D-01           -0.69845D-02            0.25872D-02            0.13987D-02
      0.15339D+04            0.21103D+00           -0.30286D-01            0.10963D-01            0.59124D-02
      0.44062D+03            0.50000D+00           -0.10576D+00            0.41394D-01            0.22551D-01
      0.14618D+03            0.45755D+00           -0.97387D-01            0.36463D-01            0.19820D-01
      0.23110D+02            0.28105D-01            0.50000D+00           -0.32515D+00           -0.19352D+00
      0.30025D+01           -0.51152D-02            0.50619D-01            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.33188D+00            1.0000000
  1  1  1  6  3
      0.95381D+03            0.20576D-01           -0.69883D-02           -0.56004D-02
      0.22482D+03            0.14031D+00           -0.47830D-01           -0.39776D-01
      0.70490D+02            0.42930D+00           -0.16755D+00           -0.13466D+00
      0.24881D+02            0.50000D+00           -0.15577D+00           -0.14021D+00
      0.73138D+01            0.93974D-01            0.40050D+00            0.50000D+00
      0.25832D+01           -0.14047D-01            0.50000D+00            0.29866D+00
  1  1  1  1  1
      0.33864D+00            1.0000000
  1  2  2  4  1
      0.67223D+02            0.55591D-01
      0.18872D+02            0.26487D+00
      0.61596D+01            0.50000D+00
      0.19141D+01            0.37507D+00
#
#  pc-1  EMSL  Basis Set Exchange Library  6/6/08 12:12 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
# K Ca Ga Ge As Se Br Kr: Frank Jensen, Polarization Consistent Basis Sets. VII. The Elements K, Ca, Ga, Ge, As, Se, Br and Kr, J. Chem. Phys. 136, 094110 (2012).
# Sc Ti V Cr Mn Fe Co Ni Cu Zn: Frank Jensen, Polarization Consistent Basis Sets. VIII. The Transition Metals Sc-Zn, J. Chem. Phys. 138, 014107 (2013).
#
# HYDROGEN
H  pc-1
  3
  1  0  0  3  1
         12.25200000          0.02282200
          1.86870000          0.15564000
          0.41821000          0.48898000
  1  0  0  1  1
          0.10610000          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# HELIUM
He pc-1
  3
  1  0  0  3  1
         36.86500000          0.01306200
          5.58020000          0.08349100
          1.19170000          0.23874000
  1  0  0  1  1
          0.26892000          1.00000000
  1  1  1  1  1
          1.45000000          1.00000000
# LITHIUM
Li pc-1
  4
  1  0  0  6  2
        266.43000000          0.00652680          0.00000000
         40.16000000          0.04806500          0.00001102
          9.10820000          0.20095000         -0.00268490
          2.45430000          0.47007000         -0.01871100
          0.69626000          0.43130000         -0.08894800
          0.08372600          0.00000000          0.51836000
  1  0  0  1  1
          0.03082700          1.00000000
  1  1  1  2  1
          1.62000000          0.04165510
          0.32000000          0.11044500
  1  1  1  1  1
          0.09000000          1.00000000
# BERYLLIUM
Be pc-1
  4
  1  0  0  6  2
        514.90000000          0.00300310          0.00000000
         77.55800000          0.02224300         -0.00009600
         17.60900000          0.09543400         -0.00121790
          4.80800000          0.23228000         -0.01369900
          1.40850000          0.22104000         -0.04215900
          0.19069000          0.00000000          0.26185000
  1  0  0  1  1
          0.06112500          1.00000000
  1  1  1  2  1
          3.42000000          0.04935190
          0.68000000          0.18982100
  1  1  1  1  1
          0.19000000          1.00000000
# BORON
B  pc-1
  5
  1  0  0  6  2
        843.98000000          0.00573610          0.00000000
        127.08000000          0.04262500         -0.00023303
         28.86200000          0.18576000         -0.00254790
          7.92970000          0.46258000         -0.03092800
          2.36370000          0.44646000         -0.08695600
          0.34670000          0.00000000          0.53062000
  1  0  0  1  1
          0.10595000          1.00000000
  1  1  1  3  1
          5.81280000          0.04308400
          1.20020000          0.22295000
          0.32686000          0.50977000
  1  1  1  1  1
          0.08626400          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
# CARBON
C  pc-1
  5
  1  0  0  6  2
       1252.60000000          0.00557360          0.00000000
        188.57000000          0.04149600         -0.00027440
         42.83900000          0.18263000         -0.00255830
         11.81800000          0.46129000         -0.03337500
          3.55670000          0.44931000         -0.08730500
          0.54258000          0.00000000          0.53415000
  1  0  0  1  1
          0.16058000          1.00000000
  1  1  1  3  1
          9.14260000          0.04449900
          1.92980000          0.23108000
          0.52522000          0.51227000
  1  1  1  1  1
          0.13608000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN
N  pc-1
  5
  1  0  0  6  2
       1742.20000000          0.00546030          0.00000000
        262.21000000          0.04070600         -0.00030104
         59.58500000          0.18038000         -0.00255110
         16.48900000          0.46009000         -0.03490000
          4.99450000          0.45173000         -0.08742900
          0.78673000          0.00000000          0.52660000
  1  0  0  1  1
          0.22837000          1.00000000
  1  1  1  3  1
         13.13200000          0.04551500
          2.81080000          0.23740000
          0.76351000          0.51392000
  1  1  1  1  1
          0.19560000          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
# OXYGEN
O  pc-1
  5
  1  0  0  6  2
       2306.70000000          0.00539400          0.00000000
        347.15000000          0.04024800         -0.00031692
         78.89000000          0.17921000         -0.00259440
         21.87600000          0.45978000         -0.03624100
          6.66460000          0.45234000         -0.08779000
          1.06690000          0.00000000          0.53320000
  1  0  0  1  1
          0.30700000          1.00000000
  1  1  1  3  1
         17.02200000          0.04891900
          3.68380000          0.24962000
          0.99234000          0.51347000
  1  1  1  1  1
          0.24487000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# FLUORINE
F  pc-1
  5
  1  0  0  6  2
       2954.60000000          0.00533370          0.00000000
        444.62000000          0.03982700         -0.00032962
        101.05000000          0.17802000         -0.00260830
         28.06800000          0.45917000         -0.03715000
          8.58370000          0.45352000         -0.08817800
          1.39860000          0.00000000          0.53135000
  1  0  0  1  1
          0.39969000          1.00000000
  1  1  1  3  1
         21.88300000          0.05024400
          4.77690000          0.25424000
          1.28230000          0.51220000
  1  1  1  1  1
          0.31127000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
# NEON
Ne pc-1
  5
  1  0  0  6  2
       3680.10000000          0.00264540          0.00000000
        553.75000000          0.01976300         -0.00017209
        125.87000000          0.08859000         -0.00130160
         35.01300000          0.22936000         -0.01898000
         10.73900000          0.22717000         -0.04400800
          1.76930000          0.00000000          0.26525000
  1  0  0  1  1
          0.50149000          1.00000000
  1  1  1  3  1
         27.50200000          0.02547700
          6.03970000          0.12855000
          1.61900000          0.25586000
  1  1  1  1  1
          0.38970000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# SODIUM
Na pc-1
  4
  1  0  0 10  3
      23207.00000000          0.00068100          0.00000000          0.00000000
       3481.60000000          0.00525120         -0.00002932          0.00000000
        792.72000000          0.02684500         -0.00003220         -0.00000132
        224.59000000          0.10188000         -0.00214850         -0.00001438
         73.08800000          0.27784000         -0.00931570         -0.00013687
         26.19000000          0.44489000         -0.06707100         -0.00048799
          9.86610000          0.28206000         -0.05678900         -0.00028773
          2.21550000          0.02068500          0.53608000         -0.01017800
          0.68590000          0.00000000          0.59788000         -0.11118000
          0.07033700          0.00000000          0.00000000          0.59314000
  1  0  0  1  1
          0.02607500          1.00000000
  1  1  1  6  1
        135.55000000          0.00617590
         31.56200000          0.04531500
          9.67740000          0.17332000
          3.36910000          0.36867000
          1.17030000          0.43998000
          0.37651000          0.22613000
  1  1  1  1  1
          0.07500000          1.00000000
# MAGNESIUM
Mg pc-1
  4
  1  0  0 10  3
      28706.00000000          0.00032513          0.00000000          0.00000000
       4306.60000000          0.00250760         -0.00001306          0.00000000
        980.54000000          0.01283700         -0.00001798          0.00000116
        277.76000000          0.04896400         -0.00100360          0.00001351
         90.38600000          0.13517000         -0.00468190          0.00013542
         32.37400000          0.22193000         -0.03305100          0.00075360
         12.17700000          0.14657000         -0.03271800          0.00150980
          2.81660000          0.01198000          0.26039000         -0.01906800
          0.92173000          0.00000000          0.30808000         -0.07524100
          0.12709000          0.00000000          0.00000000          0.27161000
  1  0  0  1  1
          0.04608000          1.00000000
  1  1  1  6  1
        177.60000000          0.00282590
         41.44200000          0.02110300
         12.81800000          0.08266600
          4.51740000          0.18285000
          1.61280000          0.22357000
          0.54531000          0.10869000
  1  1  1  1  1
          0.13500000          1.00000000
# ALUMINUM
Al pc-1
  5
  1  0  0 10  3
      34702.00000000          0.00062778          0.00000000          0.00000000
       5205.90000000          0.00484320         -0.00002388          0.00000000
       1185.20000000          0.02481700         -0.00003937          0.00000451
        335.70000000          0.09502800         -0.00191680          0.00005323
        109.23000000          0.26474000         -0.00943620          0.00053333
         39.12000000          0.44274000         -0.06573900          0.00287540
         14.70900000          0.30134000         -0.07223200          0.00567340
          3.48960000          0.02681700          0.50924000         -0.05813300
          1.19360000          0.00000000          0.62972000         -0.18753000
          0.19585000          0.00000000          0.00000000          0.58570000
  1  0  0  1  1
          0.07143900          1.00000000
  1  1  1  7  2
        254.36000000          0.00429030          0.00000000
         59.51400000          0.03305500          0.00010756
         18.70800000          0.13486000         -0.00081981
          6.73620000          0.32836000         -0.00142160
          2.50450000          0.44798000         -0.01493000
          0.90820000          0.27040000          0.04377900
          0.20909000          0.00000000          0.49039000
  1  1  1  1  1
          0.05699000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# SILICON
Si pc-1
  5
  1  0  0 10  3
      41263.00000000          0.00060948          0.00000000          0.00000000
       6189.60000000          0.00470400         -0.00002246          0.00000000
       1408.70000000          0.02413600         -0.00004176          0.00000603
        398.77000000          0.09276200         -0.00185700          0.00007428
        129.69000000          0.26047000         -0.00951130          0.00074023
         46.42500000          0.44181000         -0.06580000          0.00401070
         17.45500000          0.30755000         -0.07754600          0.00801370
          4.22220000          0.02919700          0.50303000         -0.07409100
          1.49330000          0.00000000          0.63824000         -0.21382000
          0.27174000          0.00000000          0.00000000          0.61263000
  1  0  0  1  1
          0.09850200          1.00000000
  1  1  1  7  2
        310.73000000          0.00411980          0.00000000
         72.82300000          0.03198100          0.00012637
         22.98500000          0.13224000         -0.00102520
          8.32130000          0.32779000         -0.00213370
          3.13530000          0.45107000         -0.01877400
          1.16930000          0.26345000          0.05752800
          0.29281000          0.00000000          0.53571000
  1  1  1  1  1
          0.08270400          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHOROUS
P  pc-1
  5
  1  0  0 10  3
      48073.00000000          0.00059919          0.00000000          0.00000000
       7211.40000000          0.00462410         -0.00002131          0.00000000
       1641.70000000          0.02372400         -0.00004422          0.00000713
        464.92000000          0.09130300         -0.00182210          0.00008450
        151.28000000          0.25750000         -0.00963660          0.00085919
         54.18900000          0.44080000         -0.06607200          0.00464780
         20.39700000          0.31175000         -0.08182400          0.00958110
          5.02410000          0.03111800          0.49850000         -0.08406600
          1.82460000          0.00000000          0.64492000         -0.23124000
          0.35871000          0.00000000          0.00000000          0.62350000
  1  0  0  1  1
          0.12887000          1.00000000
  1  1  1  7  2
        366.24000000          0.00409770          0.00000000
         85.93100000          0.03195600          0.00012506
         27.17200000          0.13326000         -0.00121660
          9.86850000          0.33228000         -0.00318130
          3.75330000          0.45335000         -0.02147500
          1.43020000          0.25058000          0.06999100
          0.38653000          0.00000000          0.56081000
  1  1  1  1  1
          0.11146000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# SULFUR
S  pc-1
  5
  1  0  0 10  3
      55510.00000000          0.00058899          0.00000000          0.00000000
       8326.70000000          0.00454600         -0.00002048          0.00000000
       1895.60000000          0.02333500         -0.00004543          0.00000835
        536.77000000          0.08996500         -0.00179370          0.00009831
        174.67000000          0.25486000         -0.00972520          0.00100400
         62.57800000          0.43998000         -0.06639900          0.00544090
         23.57300000          0.31549000         -0.08550200          0.01140000
          5.89080000          0.03282600          0.49588000         -0.09513400
          2.18520000          0.00000000          0.64988000         -0.24735000
          0.45282000          0.00000000          0.00000000          0.63973000
  1  0  0  1  1
          0.16202000          1.00000000
  1  1  1  7  2
        395.45000000          0.00462660          0.00000000
         92.83400000          0.03589800          0.00010934
         29.26600000          0.14854000         -0.00163580
         10.59500000          0.35878000         -0.00506320
          4.02720000          0.45417000         -0.02396000
          1.54840000          0.20545000          0.10388000
          0.46134000          0.00000000          0.58063000
  1  1  1  1  1
          0.13131000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE
Cl pc-1
  5
  1  0  0 10  3
      63474.00000000          0.00058028          0.00000000          0.00000000
       9521.30000000          0.00447920         -0.00001982          0.00000000
       2167.40000000          0.02300000         -0.00004720          0.00000906
        613.74000000          0.08881500         -0.00177130          0.00010695
        199.72000000          0.25258000         -0.00980680          0.00109810
         71.56400000          0.43921000         -0.06671900          0.00598980
         26.97900000          0.31868000         -0.08871100          0.01276200
          6.82600000          0.03434800          0.49396000         -0.10307000
          2.57670000          0.00000000          0.65392000         -0.25941000
          0.55752000          0.00000000          0.00000000          0.64899000
  1  0  0  1  1
          0.19825000          1.00000000
  1  1  1  7  2
        413.12000000          0.00542510          0.00000000
         97.05400000          0.04164400         -0.00000174
         30.48200000          0.16990000         -0.00214410
         10.96200000          0.39275000         -0.00912980
          4.12760000          0.45045000         -0.01990600
          1.53380000          0.15308000          0.15582000
          0.51439000          0.00000000          0.58772000
  1  1  1  1  1
          0.15026000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# ARGON
Ar pc-1
  5
  1  0  0 10  3
      71956.00000000          0.00028643          0.00000000          0.00000000
      10793.00000000          0.00221120         -0.00000961          0.00000000
       2457.00000000          0.01135800         -0.00002414          0.00000479
        695.72000000          0.04391600         -0.00087570          0.00005758
        226.40000000          0.12531000         -0.00493760          0.00058972
         81.13800000          0.21927000         -0.03351200          0.00323990
         30.61200000          0.16071000         -0.04576400          0.00698140
          7.82910000          0.01784900          0.24633000         -0.05491800
          2.99870000          0.00000000          0.32863000         -0.13472000
          0.67242000          0.00000000          0.00000000          0.32734000
  1  0  0  1  1
          0.23719000          1.00000000
  1  1  1  7  2
        446.27000000          0.00296130          0.00000000
        104.94000000          0.02259100         -0.00006082
         32.93100000          0.09152400         -0.00126610
         11.80900000          0.20642000         -0.00645890
          4.43040000          0.22195000         -0.00651050
          1.57510000          0.06276500          0.10436000
          0.56412000          0.00000000          0.29184000
  1  1  1  1  1
          0.17015000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# POTASSIUM
K pc-1
  6
  1  0  0  11  4
      0.36920D+05            0.17096D-02           -0.31803D-03            0.10768D-03           -0.35203D-04
      0.55431D+04            0.13126D-01           -0.24304D-02            0.82424D-03           -0.26979D-03
      0.12617D+04            0.65206D-01           -0.12558D-01            0.42625D-02           -0.13931D-02
      0.35644D+03            0.22936D+00           -0.46554D-01            0.15957D-01           -0.52322D-02
      0.11498D+03            0.50000D+00           -0.12973D+00            0.45300D-01           -0.14834D-01
      0.39799D+02            0.45639D+00           -0.16667D+00            0.62079D-01           -0.20590D-01
      0.93908D+01            0.55338D-01            0.30274D+00           -0.14874D+00            0.50971D-01
      0.37003D+01           -0.17976D-01            0.50000D+00           -0.35347D+00            0.12504D+00
      0.90184D+00            0.66003D-02            0.59484D-01            0.35925D+00           -0.15224D+00
      0.35945D+00           -0.32499D-02           -0.16159D-01            0.50000D+00           -0.35519D+00
      0.51305D-01            0.97714D-03            0.40164D-02            0.35955D-01            0.50000D+00
  1  0  0  1  1
      0.21816D-01            1.0000000
  1  1  1  8  2
      0.54895D+03            0.56544D-02           -0.13592D-02
      0.12915D+03            0.43836D-01           -0.10602D-01
      0.40756D+02            0.18189D+00           -0.45732D-01
      0.14757D+02            0.43060D+00           -0.11381D+00
      0.56369D+01            0.50000D+00           -0.13700D+00
      0.21257D+01            0.16847D+00            0.10418D+00
      0.77149D+00           -0.26789D-02            0.50000D+00
      0.24800D+00            0.20758D-02            0.33907D+00
  1  1  1  1  1
      0.49600D-01            1.0000000
  1  2  2  3  1
      0.52550D+01            0.79368D-01
      0.12390D+01            0.29549D+00
      0.30600D+00            0.50000D+00
  1  2  2  1  1
      0.61100D-01            1.0000000
# CALCIUM
Ca pc-1
  6
  1  0  0  11  4
      0.41453D+05            0.16916D-02           -0.31255D-03            0.10382D-03           -0.43481D-04
      0.62237D+04            0.12990D-01           -0.23910D-02            0.79499D-03           -0.33312D-03
      0.14166D+04            0.64592D-01           -0.12347D-01            0.41131D-02           -0.17229D-02
      0.40021D+03            0.22782D+00           -0.45970D-01            0.15446D-01           -0.64820D-02
      0.12915D+03            0.50000D+00           -0.12839D+00            0.44066D-01           -0.18517D-01
      0.44746D+02            0.46257D+00           -0.16840D+00            0.61503D-01           -0.26095D-01
      0.10731D+02            0.58920D-01            0.28768D+00           -0.13873D+00            0.60860D-01
      0.43008D+01           -0.19683D-01            0.50000D+00           -0.35027D+00            0.16210D+00
      0.11146D+01            0.78320D-02            0.66735D-01            0.30259D+00           -0.17623D+00
      0.46686D+00           -0.40583D-02           -0.18181D-01            0.50000D+00           -0.44276D+00
      0.82168D-01            0.12566D-02            0.45534D-02            0.40126D-01            0.50000D+00
  1  0  0  1  1
      0.33961D-01            1.0000000
  1  1  1  8  2
      0.65917D+03            0.49858D-02           -0.12673D-02
      0.15519D+03            0.39099D-01           -0.99803D-02
      0.49188D+02            0.16535D+00           -0.43937D-01
      0.17938D+02            0.40630D+00           -0.11319D+00
      0.69445D+01            0.50000D+00           -0.14772D+00
      0.27124D+01            0.19332D+00            0.76959D-01
      0.99393D+00            0.24805D-02            0.50000D+00
      0.33393D+00            0.12938D-02            0.33874D+00
  1  1  1  1  1
      0.66800D-01            1.0000000
  1  2  2  3  1
      0.76500D+01            0.75428D-01
      0.18710D+01            0.29372D+00
      0.50000D+00            0.50000D+00
  1  2  2  1  1
      0.11300D+00            1.0000000
# GALLIUM
Ga pc-1
  6
  1  0  0  11  4
      0.10548D+06            0.16178D-02           -0.30215D-03            0.10794D-03           -0.40980D-04
      0.15835D+05            0.12432D-01           -0.23168D-02            0.82946D-03           -0.31503D-03
      0.36040D+04            0.62072D-01           -0.11982D-01            0.42923D-02           -0.16302D-02
      0.10185D+04            0.22174D+00           -0.45314D-01            0.16436D-01           -0.62527D-02
      0.32949D+03            0.50000D+00           -0.12916D+00            0.47889D-01           -0.18264D-01
      0.11511D+03            0.48694D+00           -0.18076D+00            0.72403D-01           -0.27895D-01
      0.29616D+02            0.71664D-01            0.25756D+00           -0.14351D+00            0.57508D-01
      0.12566D+02           -0.23399D-01            0.50000D+00           -0.37658D+00            0.15889D+00
      0.36318D+01            0.85699D-02            0.69458D-01            0.29802D+00           -0.15659D+00
      0.14582D+01           -0.38731D-02           -0.14730D-01            0.50000D+00           -0.39823D+00
      0.24005D+00            0.10498D-02            0.32342D-02            0.33911D-01            0.50000D+00
  1  0  0  1  1
      0.87574D-01            1.0000000
  1  1  1  9  3
      0.19863D+04            0.38309D-02           -0.11648D-02            0.25721D-03
      0.46937D+03            0.30968D-01           -0.94390D-02            0.21257D-02
      0.15056D+03            0.13909D+00           -0.44400D-01            0.98237D-02
      0.55982D+02            0.37331D+00           -0.12540D+00            0.28718D-01
      0.22468D+02            0.50000D+00           -0.18156D+00            0.39594D-01
      0.92988D+01            0.22004D+00            0.68340D-01           -0.15744D-01
      0.35786D+01            0.91056D-02            0.50000D+00           -0.14981D+00
      0.12800D+01            0.46977D-03            0.37823D+00           -0.73330D-01
      0.22979D+00           -0.15633D-03            0.24227D-01            0.50000D+00
  1  1  1  1  1
      0.59929D-01            1.0000000
  1  2  2  6  1
      0.10114D+03            0.15123D-01
      0.29372D+02            0.98750D-01
      0.10425D+02            0.30725D+00
      0.39539D+01            0.50000D+00
      0.14248D+01            0.49274D+00
      0.45276D+00            0.24985D+00
  1  2  2  1  1
      0.15100D+00            1.0000000
# GERMANIUM
Ge pc-1
  6
  1  0  0  11  4
      0.11318D+06            0.16091D-02           -0.29882D-03            0.10443D-03           -0.43683D-04
      0.16990D+05            0.12367D-01           -0.22925D-02            0.80265D-03           -0.33582D-03
      0.38666D+04            0.61781D-01           -0.11853D-01            0.41550D-02           -0.17387D-02
      0.10927D+04            0.22099D+00           -0.44917D-01            0.15931D-01           -0.66763D-02
      0.35351D+03            0.50000D+00           -0.12819D+00            0.46530D-01           -0.19560D-01
      0.12355D+03            0.49023D+00           -0.18114D+00            0.70913D-01           -0.30106D-01
      0.32032D+02            0.73736D-01            0.24932D+00           -0.13548D+00            0.59872D-01
      0.13662D+02           -0.24239D-01            0.50000D+00           -0.36958D+00            0.17275D+00
      0.40395D+01            0.91311D-02            0.73179D-01            0.26613D+00           -0.15630D+00
      0.16454D+01           -0.42087D-02           -0.15329D-01            0.50000D+00           -0.43899D+00
      0.29490D+00            0.12013D-02            0.35190D-02            0.37270D-01            0.50000D+00
  1  0  0  1  1
      0.11088D+00            1.0000000
  1  1  1  9  3
      0.22473D+04            0.34886D-02           -0.11025D-02            0.29482D-03
      0.53121D+03            0.28370D-01           -0.89682D-02            0.24268D-02
      0.17073D+03            0.12903D+00           -0.42733D-01            0.11465D-01
      0.63671D+02            0.35559D+00           -0.12345D+00            0.33874D-01
      0.25711D+02            0.50000D+00           -0.19017D+00            0.51062D-01
      0.10785D+02            0.24614D+00            0.40089D-01           -0.13173D-01
      0.41421D+01            0.15642D-01            0.50000D+00           -0.17687D+00
      0.15122D+01           -0.31220D-03            0.41330D+00           -0.11862D+00
      0.32709D+00           -0.10815D-05            0.33213D-01            0.50000D+00
  1  1  1  1  1
      0.90090D-01            1.0000000
  1  2  2  6  1
      0.11703D+03            0.13803D-01
      0.34115D+02            0.92468D-01
      0.12224D+02            0.29562D+00
      0.47119D+01            0.49968D+00
      0.17471D+01            0.50000D+00
      0.58105D+00            0.24152D+00
  1  2  2  1  1
      0.19400D+00            1.0000000
# ARSENIC
As pc-1
  6
  1  0  0  11  4
      0.12114D+06            0.16014D-02           -0.29576D-03            0.10140D-03           -0.45365D-04
      0.18185D+05            0.12309D-01           -0.22700D-02            0.77942D-03           -0.34873D-03
      0.41386D+04            0.61511D-01           -0.11733D-01            0.40355D-02           -0.18064D-02
      0.11696D+04            0.22028D+00           -0.44542D-01            0.15490D-01           -0.69417D-02
      0.37844D+03            0.50000D+00           -0.12726D+00            0.45346D-01           -0.20398D-01
      0.13232D+03            0.49342D+00           -0.18150D+00            0.69643D-01           -0.31622D-01
      0.34561D+02            0.75795D-01            0.24134D+00           -0.12826D+00            0.60641D-01
      0.14813D+02           -0.25068D-01            0.50000D+00           -0.36367D+00            0.18292D+00
      0.44789D+01            0.96693D-02            0.76811D-01            0.23799D+00           -0.15228D+00
      0.18463D+01           -0.45072D-02           -0.15719D-01            0.50000D+00           -0.46852D+00
      0.35075D+00            0.13260D-02            0.36924D-02            0.39829D-01            0.50000D+00
  1  0  0  1  1
      0.13453D+00            1.0000000
  1  1  1  9  3
      0.24413D+04            0.33888D-02           -0.10888D-02            0.28848D-03
      0.57722D+03            0.27615D-01           -0.88725D-02            0.23801D-02
      0.18566D+03            0.12621D+00           -0.42488D-01            0.11297D-01
      0.69319D+02            0.35086D+00           -0.12377D+00            0.33693D-01
      0.28057D+02            0.50000D+00           -0.19370D+00            0.51591D-01
      0.11817D+02            0.25289D+00            0.33388D-01           -0.11275D-01
      0.45589D+01            0.17476D-01            0.50000D+00           -0.17822D+00
      0.16934D+01           -0.50283D-03            0.41901D+00           -0.11877D+00
      0.38186D+00            0.41556D-04            0.34079D-01            0.50000D+00
  1  1  1  1  1
      0.10833D+00            1.0000000
  1  2  2  6  1
      0.13292D+03            0.12767D-01
      0.38865D+02            0.87207D-01
      0.14032D+02            0.28466D+00
      0.54727D+01            0.49522D+00
      0.20732D+01            0.50000D+00
      0.71314D+00            0.23109D+00
  1  2  2  1  1
      0.23800D+00            1.0000000
# SELENIUM
Se pc-1
  6
  1  0  0  11  4
      0.12944D+06            0.15937D-02           -0.29265D-03            0.98607D-04           -0.47031D-04
      0.19430D+05            0.12250D-01           -0.22471D-02            0.75808D-03           -0.36154D-03
      0.44219D+04            0.61243D-01           -0.11612D-01            0.39258D-02           -0.18735D-02
      0.12497D+04            0.21958D+00           -0.44160D-01            0.15087D-01           -0.72067D-02
      0.40439D+03            0.50000D+00           -0.12631D+00            0.44261D-01           -0.21234D-01
      0.14145D+03            0.49666D+00           -0.18182D+00            0.68508D-01           -0.33168D-01
      0.37223D+02            0.77924D-01            0.23316D+00           -0.12137D+00            0.61218D-01
      0.16032D+02           -0.25914D-01            0.50000D+00           -0.35847D+00            0.19324D+00
      0.49561D+01            0.10209D-01            0.80581D-01            0.21196D+00           -0.14708D+00
      0.20633D+01           -0.47962D-02           -0.15999D-01            0.50000D+00           -0.49923D+00
      0.41256D+00            0.14430D-02            0.38185D-02            0.42145D-01            0.50000D+00
  1  0  0  1  1
      0.16026D+00            1.0000000
  1  1  1  9  3
      0.26320D+04            0.33222D-02           -0.10824D-02            0.29261D-03
      0.62241D+03            0.27120D-01           -0.88346D-02            0.24255D-02
      0.20029D+03            0.12441D+00           -0.42469D-01            0.11521D-01
      0.74850D+02            0.34793D+00           -0.12447D+00            0.34732D-01
      0.30351D+02            0.50000D+00           -0.19669D+00            0.53334D-01
      0.12824D+02            0.25695D+00            0.29496D-01           -0.99363D-02
      0.49760D+01            0.18645D-01            0.50000D+00           -0.18706D+00
      0.18810D+01           -0.60320D-03            0.42091D+00           -0.11696D+00
      0.44229D+00            0.62668D-04            0.34351D-01            0.50000D+00
  1  1  1  1  1
      0.12697D+00            1.0000000
  1  2  2  6  1
      0.15025D+03            0.11783D-01
      0.44052D+02            0.81943D-01
      0.16015D+02            0.27300D+00
      0.63117D+01            0.48846D+00
      0.24356D+01            0.50000D+00
      0.86076D+00            0.22497D+00
  1  2  2  1  1
      0.28700D+00            1.0000000
# BROMINE
Br pc-1
  6
  1  0  0  11  4
      0.13806D+06            0.15859D-02           -0.28953D-03            0.95979D-04            0.45910D-04
      0.20725D+05            0.12191D-01           -0.22241D-02            0.73795D-03            0.35292D-03
      0.47167D+04            0.60973D-01           -0.11489D-01            0.38222D-02            0.18295D-02
      0.13330D+04            0.21887D+00           -0.43773D-01            0.14706D-01            0.70445D-02
      0.43138D+03            0.50000D+00           -0.12533D+00            0.43237D-01            0.20810D-01
      0.15096D+03            0.49993D+00           -0.18211D+00            0.67445D-01            0.32754D-01
      0.40030D+02            0.80125D-01            0.22476D+00           -0.11464D+00           -0.58022D-01
      0.17322D+02           -0.26764D-01            0.50000D+00           -0.35372D+00           -0.19217D+00
      0.54781D+01            0.10730D-01            0.84451D-01            0.18760D+00            0.13284D+00
      0.22959D+01           -0.50475D-02           -0.16063D-01            0.50000D+00            0.50000D+00
      0.47763D+00            0.15430D-02            0.38715D-02            0.44180D-01           -0.47242D+00
  1  0  0  1  1
      0.18726D+00            1.0000000
  1  1  1  9  3
      0.28276D+04            0.32658D-02           -0.10782D-02            0.29854D-03
      0.66875D+03            0.26697D-01           -0.88116D-02            0.24799D-02
      0.21529D+03            0.12289D+00           -0.42509D-01            0.11815D-01
      0.80514D+02            0.34552D+00           -0.12527D+00            0.35861D-01
      0.32700D+02            0.50000D+00           -0.19955D+00            0.55466D-01
      0.13855D+02            0.26020D+00            0.26353D-01           -0.93491D-02
      0.54093D+01            0.19634D-01            0.50000D+00           -0.19501D+00
      0.20806D+01           -0.67839D-03            0.42180D+00           -0.11858D+00
      0.51201D+00            0.77758D-04            0.34863D-01            0.50000D+00
  1  1  1  1  1
      0.14783D+00            1.0000000
  1  2  2  6  1
      0.16774D+03            0.11071D-01
      0.49296D+02            0.78111D-01
      0.18022D+02            0.26461D+00
      0.71605D+01            0.48410D+00
      0.28040D+01            0.50000D+00
      0.10123D+01            0.21909D+00
  1  2  2  1  1
      0.33700D+00            1.0000000
# KRYPTON
Kr pc-1
  6
  1  0  0  11  4
      0.14705D+06            0.15678D-02           -0.28639D-03            0.93542D-04            0.44796D-04
      0.22074D+05            0.12052D-01           -0.22010D-02            0.71931D-03            0.34438D-03
      0.50236D+04            0.60304D-01           -0.11366D-01            0.37264D-02            0.17859D-02
      0.14198D+04            0.21674D+00           -0.43385D-01            0.14354D-01            0.68836D-02
      0.45947D+03            0.49673D+00           -0.12434D+00            0.42291D-01            0.20386D-01
      0.16084D+03            0.50000D+00           -0.18239D+00            0.66493D-01            0.32337D-01
      0.42985D+02            0.81869D-01            0.21623D+00           -0.10817D+00           -0.54844D-01
      0.18685D+02           -0.27443D-01            0.50000D+00           -0.34947D+00           -0.19093D+00
      0.60443D+01            0.11157D-01            0.88418D-01            0.16517D+00            0.11916D+00
      0.25432D+01           -0.52310D-02           -0.15945D-01            0.50000D+00            0.50000D+00
      0.54663D+00            0.16170D-02            0.38663D-02            0.45963D-01           -0.44781D+00
  1  0  0  1  1
      0.21533D+00            1.0000000
  1  1  1  9  3
      0.30216D+04            0.32285D-02           -0.10774D-02            0.30538D-03
      0.71473D+03            0.26422D-01           -0.88155D-02            0.25401D-02
      0.23016D+03            0.12193D+00           -0.42644D-01            0.12136D-01
      0.86130D+02            0.34412D+00           -0.12618D+00            0.37005D-01
      0.35027D+02            0.50000D+00           -0.20191D+00            0.57526D-01
      0.14876D+02            0.26183D+00            0.24874D-01           -0.93722D-02
      0.58455D+01            0.20175D-01            0.50000D+00           -0.20253D+00
      0.22856D+01           -0.69400D-03            0.42008D+00           -0.11970D+00
      0.58570D+00            0.77660D-04            0.35080D-01            0.50000D+00
  1  1  1  1  1
      0.17095D+00            1.0000000
  1  2  2  6  1
      0.18659D+03            0.10387D-01
      0.54949D+02            0.74298D-01
      0.20191D+02            0.25587D+00
      0.80806D+01            0.47844D+00
      0.32052D+01            0.50000D+00
      0.11778D+01            0.21564D+00
  1  2  2  1  1
      0.39300D+00            1.00000000
# SCANDIUM (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Sc pc-1
  7
  1  0  0  11  4
      0.46097D+05            0.16801D-02           -0.31045D-03            0.10427D-03           -0.45804D-04
      0.69207D+04            0.12903D-01           -0.23762D-02            0.79883D-03           -0.35112D-03
      0.15752D+04            0.64202D-01           -0.12270D-01            0.41331D-02           -0.18159D-02
      0.44504D+03            0.22687D+00           -0.45802D-01            0.15565D-01           -0.68524D-02
      0.14366D+03            0.50000D+00           -0.12824D+00            0.44537D-01           -0.19632D-01
      0.49826D+02            0.46630D+00           -0.17009D+00            0.62956D-01           -0.28037D-01
      0.12081D+02            0.60942D-01            0.28137D+00           -0.13838D+00            0.63819D-01
      0.48928D+01           -0.20424D-01            0.50000D+00           -0.35501D+00            0.17247D+00
      0.13008D+01            0.80989D-02            0.68068D-01            0.29703D+00           -0.18094D+00
      0.54357D+00           -0.41264D-02           -0.17790D-01            0.50000D+00           -0.46274D+00
      0.96961D-01            0.12409D-02            0.43168D-02            0.39536D-01            0.50000D+00
  1  0  0  1  1
      0.38586D-01            1.0000000
  1  1  1  8  2
      0.74067D+03            0.49118D-02           -0.12764D-02
      0.17447D+03            0.38632D-01           -0.10089D-01
      0.55373D+02            0.16431D+00           -0.44688D-01
      0.20234D+02            0.40636D+00           -0.11620D+00
      0.78652D+01            0.50000D+00           -0.15096D+00
      0.30838D+01            0.19046D+00            0.83789D-01
      0.11488D+01            0.17802D-02            0.50000D+00
      0.39011D+00            0.14402D-02            0.32895D+00
  1  1  1  1  1
      0.78000D-01            1.0000000
  1  2  2  5  1
      0.28824D+02            0.15986D-01
      0.80588D+01            0.92287D-01
      0.26663D+01            0.27811D+00
      0.94173D+00            0.45725D+00
      0.31064D+00            0.50000D+00
  1  2  2  1  1
      0.93444D-01            1.0000000
  1  3  3  1  1
      0.931000D+00           1.0000000
# TITANIUM (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Ti pc-1
  7
  1  0  0  11  4
      0.50936D+05            0.16712D-02           -0.30937D-03            0.10566D-03           -0.43149D-04
      0.76471D+04            0.12836D-01           -0.23686D-02            0.80991D-03           -0.33089D-03
      0.17406D+04            0.63898D-01           -0.12233D-01            0.41902D-02           -0.17115D-02
      0.49177D+03            0.22615D+00           -0.45751D-01            0.15819D-01           -0.64730D-02
      0.15879D+03            0.50000D+00           -0.12839D+00            0.45371D-01           -0.18597D-01
      0.55129D+02            0.46917D+00           -0.17166D+00            0.64789D-01           -0.26820D-01
      0.13483D+02            0.62437D-01            0.27780D+00           -0.14031D+00            0.60178D-01
      0.55039D+01           -0.20885D-01            0.50000D+00           -0.36133D+00            0.16367D+00
      0.14846D+01            0.81630D-02            0.68150D-01            0.30232D+00           -0.17289D+00
      0.61682D+00           -0.40607D-02           -0.17164D-01            0.50000D+00           -0.42914D+00
      0.10679D+00            0.11820D-02            0.40304D-02            0.37362D-01
  1  0  0  1  1
      0.41697D-01            1.0000000
  1  1  1  8  2
      0.82565D+03            0.48606D-02           -0.12854D-02
      0.19457D+03            0.38324D-01           -0.10193D-01
      0.61820D+02            0.16380D+00           -0.45384D-01
      0.22628D+02            0.40710D+00           -0.11890D+00
      0.88254D+01            0.50000D+00           -0.15349D+00
      0.34692D+01            0.18735D+00            0.90834D-01
      0.13084D+01            0.10665D-02            0.50000D+00
      0.44821D+00            0.15748D-02            0.32095D+00
  1  1  1  1  1
      0.90000D-01            1.0000000
  1  2  2  5  1
      0.36191D+02            0.15178D-01
      0.10203D+02            0.91318D-01
      0.34312D+01            0.28210D+00
      0.12439D+01            0.47267D+00
      0.42753D+00            0.50000D+00
  1  2  2  1  1
      0.13088D+00            1.0000000
  1  3  3  1  1
      1.025000D+00           1.0000000
# VANADIUM (12s,9p,6d,1f) -> [5s,3p,2d,1f]
V pc-1
  7
  1  0  0  11  4
      0.56021D+05            0.16631D-02           -0.30835D-03            0.10658D-03           -0.43198D-04
      0.84104D+04            0.12774D-01           -0.23614D-02            0.81729D-03           -0.33141D-03
      0.19143D+04            0.63621D-01           -0.12198D-01            0.42283D-02           -0.17142D-02
      0.54087D+03            0.22548D+00           -0.45700D-01            0.15999D-01           -0.64978D-02
      0.17469D+03            0.50000D+00           -0.12853D+00            0.45988D-01           -0.18711D-01
      0.60705D+02            0.47179D+00           -0.17308D+00            0.66269D-01           -0.27232D-01
      0.14963D+02            0.63791D-01            0.27467D+00           -0.14162D+00            0.60326D-01
      0.61493D+01           -0.21278D-01            0.50000D+00           -0.36567D+00            0.16444D+00
      0.16787D+01            0.82046D-02            0.68191D-01            0.30531D+00           -0.17286D+00
      0.69217D+00           -0.40035D-02           -0.16641D-01            0.50000D+00           -0.42545D+00
      0.11834D+00            0.11382D-02            0.38216D-02            0.36270D-01            0.50000D+00
  1  0  0  1  1
      0.45042D-01            1.0000000
  1  1  1  8  2
      0.91263D+03            0.48403D-02           -0.12972D-02
      0.21515D+03            0.38235D-01           -0.10314D-01
      0.68419D+02            0.16406D+00           -0.46113D-01
      0.25078D+02            0.40897D+00           -0.12147D+00
      0.98054D+01            0.50000D+00           -0.15528D+00
      0.38576D+01            0.18332D+00            0.99152D-01
      0.14678D+01            0.22075D-03            0.50000D+00
      0.50494D+00            0.17067D-02            0.31456D+00
  1  1  1  1  1
      0.10100D+00            1.0000000
  1  2  2  5  1
      0.42114D+02            0.15285D-01
      0.11937D+02            0.93427D-01
      0.40535D+01            0.28907D+00
      0.14829D+01            0.48212D+00
      0.51467D+00            0.50000D+00
  1  2  2  1  1
      0.15805D+00            1.0000000
  1  3  3  1  1
      1.127000D+00           1.0000000
# CHROMIUM (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Cr pc-1
  7
  1  0  0  11  4
      0.61342D+05            0.16558D-02           -0.30748D-03            0.10737D-03           -0.43371D-04
      0.92093D+04            0.12719D-01           -0.23551D-02            0.82365D-03           -0.33286D-03
      0.20961D+04            0.63371D-01           -0.12168D-01            0.42611D-02           -0.17216D-02
      0.59227D+03            0.22488D+00           -0.45657D-01            0.16156D-01           -0.65394D-02
      0.19134D+03            0.50000D+00           -0.12867D+00            0.46532D-01           -0.18869D-01
      0.66546D+02            0.47416D+00           -0.17437D+00            0.67598D-01           -0.27688D-01
      0.16518D+02            0.64994D-01            0.27205D+00           -0.14286D+00            0.60681D-01
      0.68267D+01           -0.21602D-01            0.50000D+00           -0.36925D+00            0.16543D+00
      0.18813D+01            0.82213D-02            0.68119D-01            0.30824D+00           -0.17326D+00
      0.76988D+00           -0.39429D-02           -0.16178D-01            0.50000D+00           -0.42327D+00
      0.13007D+00            0.10981D-02            0.36455D-02            0.35372D-01            0.50000D+00
  1  0  0  1  1
      0.48340D-01            1.0000000
  1  1  1  8  2
      0.10037D+04            0.48250D-02           -0.13074D-02
      0.23670D+03            0.38176D-01           -0.10420D-01
      0.75332D+02            0.16437D+00           -0.46757D-01
      0.27647D+02            0.41083D+00           -0.12375D+00
      0.10833D+02            0.50000D+00           -0.15671D+00
      0.42639D+01            0.17965D+00            0.10700D+00
      0.16324D+01           -0.50012D-03            0.50000D+00
      0.56312D+00            0.18135D-02            0.30920D+00
  1  1  1  1  1
      0.11300D+00            1.0000000
  1  2  2  5  1
      0.47803D+02            0.15631D-01
      0.13607D+02            0.96382D-01
      0.46543D+01            0.29741D+00
      0.17104D+01            0.49093D+00
      0.59548D+00            0.50000D+00
  1  2  2  1  1
      0.18222D+00            1.0000000
  1  3  3  1  1
      1.240000D+00           1.0000000
# MANGANESE (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Mn pc-1
  7
  1  0  0  11  4
      0.66883D+05            0.16496D-02           -0.30694D-03            0.10832D-03           -0.42848D-04
      0.10041D+05            0.12673D-01           -0.23515D-02            0.83125D-03           -0.32896D-03
      0.22854D+04            0.63161D-01           -0.12151D-01            0.43002D-02           -0.17015D-02
      0.64577D+03            0.22438D+00           -0.45653D-01            0.16334D-01           -0.64744D-02
      0.20867D+03            0.50000D+00           -0.12891D+00            0.47126D-01           -0.18716D-01
      0.72632D+02            0.47613D+00           -0.17555D+00            0.68935D-01           -0.27651D-01
      0.18137D+02            0.65974D-01            0.27037D+00           -0.14464D+00            0.60165D-01
      0.75308D+01           -0.21827D-01            0.50000D+00           -0.37274D+00            0.16353D+00
      0.20877D+01            0.81889D-02            0.67731D-01            0.31332D+00           -0.17208D+00
      0.84772D+00           -0.38622D-02           -0.15724D-01            0.50000D+00           -0.41451D+00
      0.14062D+00            0.10537D-02            0.34788D-02            0.34371D-01            0.50000D+00
  1  0  0  1  1
      0.51188D-01            1.0000000
  1  1  1  8  2
      0.10996D+04            0.48064D-02           -0.13142D-02
      0.25940D+03            0.38093D-01           -0.10500D-01
      0.82614D+02            0.16457D+00           -0.47279D-01
      0.30354D+02            0.41239D+00           -0.12570D+00
      0.11916D+02            0.50000D+00           -0.15785D+00
      0.46921D+01            0.17653D+00            0.11397D+00
      0.18031D+01           -0.10643D-02            0.50000D+00
      0.62276D+00            0.18879D-02            0.30505D+00
  1  1  1  1  1
      0.12500D+00            1.0000000
  1  2  2  5  1
      0.54249D+02            0.15643D-01
      0.15506D+02            0.97445D-01
      0.53408D+01            0.30131D+00
      0.19744D+01            0.49562D+00
      0.69159D+00            0.50000D+00
  1  2  2  1  1
      0.21227D+00            1.0000000
  1  3  3  1  1
      1.364000D+00           1.0000000
# IRON (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Fe pc-1
  7
  1  0  0  11  4
      0.72674D+05            0.16437D-02           -0.30640D-03            0.10907D-03           -0.41589D-04
      0.10910D+05            0.12628D-01           -0.23476D-02            0.83726D-03           -0.31939D-03
      0.24832D+04            0.62961D-01           -0.12134D-01            0.43315D-02           -0.16520D-02
      0.70169D+03            0.22391D+00           -0.45643D-01            0.16480D-01           -0.62966D-02
      0.22679D+03            0.50000D+00           -0.12912D+00            0.47631D-01           -0.18235D-01
      0.78995D+02            0.47803D+00           -0.17667D+00            0.70110D-01           -0.27113D-01
      0.19831D+02            0.66916D-01            0.26883D+00           -0.14609D+00            0.58629D-01
      0.82696D+01           -0.22057D-01            0.50000D+00           -0.37577D+00            0.15885D+00
      0.23063D+01            0.81784D-02            0.67463D-01            0.31704D+00           -0.16754D+00
      0.93170D+00           -0.37941D-02           -0.15317D-01            0.50000D+00           -0.39911D+00
      0.15024D+00            0.10133D-02            0.33196D-02            0.33172D-01            0.50000D+00
  1  0  0  1  1
      0.54170D-01            1.0000000
  1  1  1  8  2
      0.12020D+04            0.47750D-02           -0.13166D-02
      0.28364D+03            0.37903D-01           -0.10540D-01
      0.90406D+02            0.16429D+00           -0.47628D-01
      0.33260D+02            0.41298D+00           -0.12720D+00
      0.13085D+02            0.50000D+00           -0.15904D+00
      0.51607D+01            0.17479D+00            0.11869D+00
      0.19893D+01           -0.13337D-02            0.50000D+00
      0.68911D+00            0.19180D-02            0.30103D+00
  1  1  1  1  1
      0.13800D+00            1.0000000
  1  2  2  5  1
      0.59117D+02            0.16422D-01
      0.16934D+02            0.10218D+00
      0.58526D+01            0.31138D+00
      0.21589D+01            0.50000D+00
      0.75023D+00            0.49302D+00
  1  2  2  1  1
      0.22643D+00            1.0000000
  1  3  3  1  1
      1.500000D+00           1.0000000
# COBALT (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Co pc-1
  7
  1  0  0  11  4
      0.78699D+05            0.16384D-02           -0.30577D-03            0.10972D-03           -0.40551D-04
      0.11815D+05            0.12588D-01           -0.23431D-02            0.84247D-03           -0.31152D-03
      0.26890D+04            0.62780D-01           -0.12113D-01            0.43583D-02           -0.16112D-02
      0.75987D+03            0.22347D+00           -0.45614D-01            0.16607D-01           -0.61508D-02
      0.24565D+03            0.50000D+00           -0.12925D+00            0.48073D-01           -0.17840D-01
      0.85621D+02            0.47972D+00           -0.17761D+00            0.71172D-01           -0.26684D-01
      0.21612D+02            0.67745D-01            0.26708D+00           -0.14723D+00            0.57311D-01
      0.90441D+01           -0.22202D-01            0.50000D+00           -0.37836D+00            0.15489D+00
      0.25329D+01            0.81277D-02            0.67171D-01            0.32049D+00           -0.16355D+00
      0.10173D+01           -0.37108D-02           -0.14949D-01            0.50000D+00           -0.38609D+00
      0.15937D+00            0.96929D-03            0.31734D-02            0.32125D-01            0.50000D+00
  1  0  0  1  1
      0.56766D-01            1.0000000
  1  1  1  8  2
      0.13093D+04            0.47440D-02           -0.13174D-02
      0.30905D+03            0.37714D-01           -0.10566D-01
      0.98576D+02            0.16398D+00           -0.47907D-01
      0.36310D+02            0.41343D+00           -0.12848D+00
      0.14314D+02            0.50000D+00           -0.16009D+00
      0.56545D+01            0.17339D+00            0.12274D+00
      0.21834D+01           -0.15052D-02            0.50000D+00
      0.75723D+00            0.19266D-02            0.29839D+00
  1  1  1  1  1
      0.15100D+00            1.0000000
  1  2  2  5  1
      0.65359D+02            0.16567D-01
      0.18770D+02            0.10363D+00
      0.65162D+01            0.31428D+00
      0.24082D+01            0.50000D+00
      0.83633D+00            0.48889D+00
  1  2  2  1  1
      0.25129D+00            1.0000000
  1  3  3  1  1
      1.650000D+00           1.0000000
# NICKEL (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Ni pc-1
  7
  1  0  0  11  4
      0.84924D+05            0.16342D-02           -0.30583D-03            0.11055D-03           -0.39628D-04
      0.12749D+05            0.12557D-01           -0.23437D-02            0.84906D-03           -0.30449D-03
      0.29017D+04            0.62636D-01           -0.12118D-01            0.43924D-02           -0.15749D-02
      0.82002D+03            0.22313D+00           -0.45670D-01            0.16758D-01           -0.60196D-02
      0.26515D+03            0.50000D+00           -0.12963D+00            0.48580D-01           -0.17485D-01
      0.92480D+02            0.48110D+00           -0.17864D+00            0.72246D-01           -0.26271D-01
      0.23432D+02            0.68416D-01            0.26693D+00           -0.14921D+00            0.56353D-01
      0.98372D+01           -0.22360D-01            0.50000D+00           -0.38082D+00            0.15112D+00
      0.27655D+01            0.80967D-02            0.66637D-01            0.32539D+00           -0.16061D+00
      0.11044D+01           -0.36445D-02           -0.14562D-01            0.50000D+00           -0.37418D+00
      0.16880D+00            0.93297D-03            0.30326D-02            0.31142D-01            0.50000D+00
  1  0  0  1  1
      0.59341D-01            1.0000000
  1  1  1  8  2
      0.14204D+04            0.47199D-02           -0.13190D-02
      0.33535D+03            0.37579D-01           -0.10600D-01
      0.10702D+03            0.16387D+00           -0.48207D-01
      0.39460D+02            0.41416D+00           -0.12977D+00
      0.15581D+02            0.50000D+00           -0.16094D+00
      0.61606D+01            0.17172D+00            0.12707D+00
      0.23825D+01           -0.17461D-02            0.50000D+00
      0.82706D+00            0.19509D-02            0.29581D+00
  1  1  1  1  1
      0.16500D+00            1.0000000
  1  2  2  5  1
      0.71754D+02            0.16731D-01
      0.20656D+02            0.10506D+00
      0.71983D+01            0.31711D+00
      0.26637D+01            0.50000D+00
      0.92414D+00            0.48492D+00
  1  2  2  1  1
      0.27627D+00            1.0000000
  1  3  3  1  1
      1.815000D+00           1.0000000
# COPPER (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Cu pc-1
  7
  1  0  0  11 4
      0.91409D+05            0.16300D-02           -0.30554D-03            0.11114D-03           -0.39027D-04
      0.13723D+05            0.12525D-01           -0.23416D-02            0.85377D-03           -0.29994D-03
      0.31233D+04            0.62490D-01           -0.12110D-01            0.44167D-02           -0.15514D-02
      0.88266D+03            0.22278D+00           -0.45677D-01            0.16872D-01           -0.59371D-02
      0.28546D+03            0.50000D+00           -0.12984D+00            0.48976D-01           -0.17269D-01
      0.99624D+02            0.48248D+00           -0.17951D+00            0.73167D-01           -0.26065D-01
      0.25346D+02            0.69085D-01            0.26606D+00           -0.15052D+00            0.55702D-01
      0.10671D+02           -0.22486D-01            0.50000D+00           -0.38278D+00            0.14871D+00
      0.30093D+01            0.80622D-02            0.66289D-01            0.32868D+00           -0.15845D+00
      0.11957D+01           -0.35853D-02           -0.14265D-01            0.50000D+00           -0.36637D+00
      0.17913D+00            0.90153D-03            0.29219D-02            0.30391D-01            0.50000D+00
  1  0  0  1  1
      0.62125D-01            1.0000000
  1  1  1  8  2
      0.15362D+04            0.46971D-02           -0.13200D-02
      0.36275D+03            0.37447D-01           -0.10626D-01
      0.11583D+03            0.16374D+00           -0.48461D-01
      0.42750D+02            0.41477D+00           -0.13090D+00
      0.16905D+02            0.50000D+00           -0.16170D+00
      0.66911D+01            0.17032D+00            0.13087D+00
      0.25902D+01           -0.19212D-02            0.50000D+00
      0.89956D+00            0.19650D-02            0.29368D+00
  1  1  1  1  1
      0.18000D+00            1.0000000
  1  2  2  5  1
      0.78275D+02            0.16924D-01
      0.22581D+02            0.10654D+00
      0.78947D+01            0.31999D+00
      0.29232D+01            0.50000D+00
      0.10128D+01            0.48091D+00
  1  2  2  1  1
      0.30110D+00            1.0000000
  1  3  3  1  1
      1.997000D+00           1.0000000
# ZINC (12s,9p,6d,1f) -> [5s,3p,2d,1f]
Zn pc-1
  7
  1  0  0  11  4
      0.98135D+05            0.16259D-02           -0.30532D-03            0.11176D-03           -0.38485D-04
      0.14732D+05            0.12494D-01           -0.23401D-02            0.85878D-03           -0.29585D-03
      0.33530D+04            0.62354D-01           -0.12105D-01            0.44428D-02           -0.15302D-02
      0.94758D+03            0.22246D+00           -0.45695D-01            0.16992D-01           -0.58632D-02
      0.30650D+03            0.50000D+00           -0.13008D+00            0.49386D-01           -0.17076D-01
      0.10703D+03            0.48373D+00           -0.18033D+00            0.74083D-01           -0.25880D-01
      0.27325D+02            0.69671D-01            0.26558D+00           -0.15204D+00            0.55185D-01
      0.11533D+02           -0.22586D-01            0.50000D+00           -0.38467D+00            0.14643D+00
      0.32584D+01            0.80172D-02            0.65841D-01            0.33273D+00           -0.15675D+00
      0.12881D+01           -0.35255D-02           -0.13986D-01            0.50000D+00           -0.35909D+00
      0.18909D+00            0.87137D-03            0.28200D-02            0.29673D-01            0.50000D+00
  1  0  0  1  1
      0.64711D-01            1.0000000
  1  1  1  8  2
      0.16561D+04            0.46784D-02           -0.13210D-02
      0.39114D+03            0.37340D-01           -0.10651D-01
      0.12496D+03            0.16366D+00           -0.48692D-01
      0.46161D+02            0.41541D+00           -0.13192D+00
      0.18279D+02            0.50000D+00           -0.16230D+00
      0.72405D+01            0.16895D+00            0.13446D+00
      0.28042D+01           -0.20832D-02            0.50000D+00
      0.97365D+00            0.19749D-02            0.29197D+00
  1  1  1  1  1
      0.19500D+00            1.0000000
  1  2  2  5  1
      0.85370D+02            0.16998D-01
      0.24679D+02            0.10737D+00
      0.86558D+01            0.32179D+00
      0.32094D+01            0.50000D+00
      0.11121D+01            0.47833D+00
  1  2  2  1  1
      0.32984D+00            1.0000000
  1  3  3  1  1
      2.196000D+00           1.0000000
#
# pc-2  EMSL  Basis Set Exchange Library  1/23/17 10:00 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
# K Ca Ga Ge As Se Br Kr: Frank Jensen, Polarization Consistent Basis Sets. VII. The Elements K, Ca, Ga, Ge, As, Se, Br and Kr, J. Chem. Phys. 136, 094110 (2012).
# Sc Ti V Cr Mn Fe Co Ni Cu Zn: Frank Jensen, Polarization Consistent Basis Sets. VIII. The Transition Metals Sc-Zn, J. Chem. Phys. 138, 014107 (2013).
#
# HYDROGEN
H  pc-2
  6
  1  0  0  4  1
         75.42300000          0.00240650
         11.35000000          0.01848700
          2.59930000          0.08974200
          0.73513000          0.28111000
  1  0  0  1  1
          0.23167000          1.00000000
  1  0  0  1  1
          0.07414700          1.00000000
  1  1  1  1  1
          1.60000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
# HELIUM
He pc-2
  6
  1  0  0  4  1
        221.77000000          0.00144090
         33.37500000          0.01089400
          7.61140000          0.05018900
          2.10890000          0.14290000
  1  0  0  1  1
          0.62878000          1.00000000
  1  0  0  1  1
          0.18469000          1.00000000
  1  1  1  1  1
          2.40000000          1.00000000
  1  1  1  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
# LITHIUM
Li pc-2
  6
  1  0  0  8  2
       1502.50000000          0.00076137          0.00000000
        225.51000000          0.00587120          0.00002104
         51.37500000          0.02974300         -0.00012177
         14.54700000          0.10959000         -0.00010088
          4.66450000          0.28000000         -0.00844260
          1.60080000          0.44163000         -0.02439400
          0.55262000          0.29922000         -0.09071800
          0.10366000          0.00000000          0.30659000
  1  0  0  1  1
          0.04744200          1.00000000
  1  0  0  1  1
          0.01979000          1.00000000
  1  1  1  3  1
          5.30000000          0.00554503
          1.15000000          0.05509120
          0.29000000          0.08756150
  1  1  1  1  1
          0.09000000          1.00000000
  1  2  2  1  1
          0.26000000          1.00000000
# BERYLLIUM
Be pc-2
  6
  1  0  0  8  2
       3067.30000000          0.00032683          0.00000000
        460.24000000          0.00252340          0.00000139
        104.80000000          0.01286700         -0.00003643
         29.65700000          0.04860700         -0.00033196
          9.53650000          0.13111000         -0.00366180
          3.31060000          0.22124000         -0.01754000
          1.18040000          0.16345000         -0.04090500
          0.26871000          0.00000000          0.11357000
  1  0  0  1  1
          0.11774000          1.00000000
  1  0  0  1  1
          0.04468500          1.00000000
  1  1  1  3  1
          8.24000000          0.01114710
          1.79000000          0.08054940
          0.45000000          0.25574400
  1  1  1  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.39000000          1.00000000
# BORON
B  pc-2
  9
  1  0  0  8  2
       5220.40000000          0.00059530          0.00000000
        783.19000000          0.00459910          0.00000166
        178.31000000          0.02353000         -0.00006852
         50.46900000          0.09001500         -0.00068751
         16.28500000          0.24988000         -0.00736900
          5.68850000          0.44237000         -0.03709800
          2.04950000          0.34536000         -0.08698600
          0.51473000          0.00000000          0.21361000
  1  0  0  1  1
          0.21556000          1.00000000
  1  0  0  1  1
          0.07745700          1.00000000
  1  1  1  4  1
         21.81000000          0.00588410
          4.89300000          0.04179800
          1.39760000          0.15567000
          0.47747000          0.35997000
  1  1  1  1  1
          0.16419000          1.00000000
  1  1  1  1  1
          0.05400400          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.87000000          1.00000000
# CARBON
C  pc-2
  9
  1  0  0  8  2
       7857.10000000          0.00056825          0.00000000
       1178.70000000          0.00439150         -0.00000059
        268.32000000          0.02250400         -0.00006275
         75.94800000          0.08665300         -0.00075773
         24.55900000          0.24405000         -0.00733080
          8.62120000          0.44148000         -0.03893200
          3.12780000          0.35332000         -0.08890800
          0.82202000          0.00000000          0.21689000
  1  0  0  1  1
          0.33017000          1.00000000
  1  0  0  1  1
          0.11463000          1.00000000
  1  1  1  4  1
         33.77500000          0.00602940
          7.67660000          0.04322800
          2.23570000          0.16301000
          0.76447000          0.36504000
  1  1  1  1  1
          0.26232000          1.00000000
  1  1  1  1  1
          0.08463800          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
# NITROGEN
N  pc-2
  9
  1  0  0  8  2
      11101.00000000          0.00054570          0.00000000
       1665.30000000          0.00421810         -0.00000150
        379.08000000          0.02164500         -0.00005875
        107.30000000          0.08377600         -0.00077453
         34.74700000          0.23881000         -0.00721610
         12.24900000          0.43994000         -0.03933800
          4.47430000          0.36364000         -0.09061100
          1.24040000          0.00000000          0.19882000
  1  0  0  1  1
          0.48743000          1.00000000
  1  0  0  1  1
          0.16484000          1.00000000
  1  1  1  4  1
         47.93400000          0.00617060
         10.99900000          0.04426000
          3.24720000          0.16825000
          1.11140000          0.36848000
  1  1  1  1  1
          0.37988000          1.00000000
  1  1  1  1  1
          0.12068000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  3  3  1  1
          1.02000000          1.00000000
# OXYGEN
O  pc-2
  9
  1  0  0  8  2
      14782.00000000          0.00053519          0.00000000
       2217.30000000          0.00413750         -0.00000193
        504.74000000          0.02124500         -0.00005796
        142.87000000          0.08245300         -0.00079494
         46.30000000          0.23671000         -0.00731250
         16.33700000          0.44039000         -0.04057400
          5.98280000          0.36465000         -0.09159400
          1.67180000          0.00000000          0.20940000
  1  0  0  1  1
          0.64662000          1.00000000
  1  0  0  1  1
          0.21669000          1.00000000
  1  1  1  4  1
         60.42400000          0.00689490
         13.93500000          0.04900500
          4.15310000          0.18255000
          1.41580000          0.37633000
  1  1  1  1  1
          0.47549000          1.00000000
  1  1  1  1  1
          0.14529000          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          1.10000000          1.00000000
# FLUORINE
F  pc-2
  9
  1  0  0  8  2
      19127.00000000          0.00052250          0.00000000
       2868.90000000          0.00404000         -0.00000226
        653.04000000          0.02075900         -0.00005664
        184.85000000          0.08080000         -0.00079782
         59.94900000          0.23362000         -0.00727130
         21.19000000          0.43965000         -0.04083100
          7.78460000          0.37041000         -0.09293100
          2.23050000          0.00000000          0.20228000
  1  0  0  1  1
          0.85409000          1.00000000
  1  0  0  1  1
          0.28336000          1.00000000
  1  1  1  4  1
         77.63900000          0.00703130
         17.96500000          0.05013700
          5.40050000          0.18553000
          1.84230000          0.37546000
  1  1  1  1  1
          0.61532000          1.00000000
  1  1  1  1  1
          0.18489000          1.00000000
  1  2  2  1  1
          2.80000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
# NEON
Ne pc-2
  9
  1  0  0  8  2
      23880.00000000          0.00025835          0.00000000
       3581.70000000          0.00199770         -0.00000765
        815.27000000          0.01026900         -0.00013638
        230.77000000          0.04003600         -0.00206690
         74.88400000          0.11619000         -0.01814000
         26.51800000          0.21959000         -0.10379000
          9.76920000          0.18608000         -0.23283000
          2.83050000          0.00000000          0.50798000
  1  0  0  1  1
          1.07400000          1.00000000
  1  0  0  1  1
          0.35400000          1.00000000
  1  1  1  4  1
         97.10600000          0.00356680
         22.54300000          0.02546700
          6.81730000          0.09401600
          2.32630000          0.18796000
  1  1  1  1  1
          0.77425000          1.00000000
  1  1  1  1  1
          0.23026000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  3  3  1  1
          1.30000000          1.00000000
# SODIUM
Na pc-2
  7
  1  0  0 11  3
      64474.00000000          0.00019020          0.00000000          0.00000000
       9667.50000000          0.00147490          0.00000000          0.00000000
       2200.80000000          0.00767780         -0.00001388          0.00000450
        623.26000000          0.03133300         -0.00014242          0.00005447
        203.12000000          0.10269000         -0.00181590          0.00061058
         72.94400000          0.25598000         -0.01209300          0.00417240
         28.02600000          0.41517000         -0.05682300          0.01823100
         11.05500000          0.30473000         -0.10110000          0.02901700
          3.54900000          0.04114600          0.22498000         -0.05293200
          1.40820000          0.00000000          0.51711000          0.16965000
          0.51148000          0.00000000          0.00000000          0.88478000
  1  0  0  1  1
          0.06953400          1.00000000
  1  0  0  1  1
          0.02512000          1.00000000
  1  1  1  7  1
        230.53000000          0.00254200
         54.20100000          0.01976800
         17.40200000          0.08348000
          6.31520000          0.23282000
          2.40840000          0.38216000
          0.90249000          0.37985000
          0.31450000          0.16287000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03900000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
# MAGNESIUM
Mg pc-2
  7
  1  0  0 11  3
      81017.00000000          0.00008905          0.00000000          0.00000000
      12143.00000000          0.00069088         -0.00000052          0.00000000
       2763.80000000          0.00359990         -0.00000408         -0.00001191
        782.58000000          0.01472100         -0.00008248         -0.00014781
        255.03000000          0.04857200         -0.00070727         -0.00168720
         91.62300000          0.12279000         -0.00549130         -0.01186400
         35.24500000          0.20506000         -0.02385900         -0.05598300
         13.96000000          0.15913000         -0.04982700         -0.11311000
          4.74220000          0.02509900          0.08349700          0.18789000
          1.92840000          0.00000000          0.19563000          0.71752000
          0.72424000          0.00000000          0.00000000          0.53956000
  1  0  0  1  1
          0.12353000          1.00000000
  1  0  0  1  1
          0.04303200          1.00000000
  1  1  1  7  1
        309.05000000          0.00111300
         72.89400000          0.00875690
         23.49400000          0.03825400
          8.56190000          0.11095000
          3.30680000          0.19174000
          1.26940000          0.19457000
          0.46106000          0.07820400
  1  1  1  1  1
          0.17700000          1.00000000
  1  1  1  1  1
          0.05700000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# ALUMINUM
Al pc-2
  9
  1  0  0 11  3
      99741.00000000          0.00016809          0.00000000          0.00000000
      14949.00000000          0.00130410         -0.00000048          0.00000000
       3402.50000000          0.00679790         -0.00000205         -0.00000556
        963.53000000          0.02784000         -0.00005573         -0.00006905
        314.05000000          0.09235800         -0.00041853         -0.00079085
        112.88000000          0.23633000         -0.00348130         -0.00564140
         43.47400000          0.40484000         -0.01486400         -0.02728800
         17.29200000          0.32992000         -0.03401200         -0.05953800
          6.16220000          0.05852100          0.04389600          0.07239300
          2.52260000          0.00000000          0.11958000          0.41226000
          0.96874000          0.00000000          0.00000000          0.39165000
  1  0  0  1  1
          0.19251000          1.00000000
  1  0  0  1  1
          0.06781300          1.00000000
  1  1  1  8  2
        579.71000000          0.00105610          0.00000000
        137.54000000          0.00863350          0.00002967
         44.06700000          0.04322700         -0.00010593
         16.14800000          0.14168000         -0.00017370
          6.48880000          0.30352000         -0.00443150
          2.66320000          0.40389000         -0.00441340
          1.07920000          0.28642000         -0.00107230
          0.39771000          0.00000000          0.17650000
  1  1  1  1  1
          0.13475000          1.00000000
  1  1  1  1  1
          0.04218500          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.33000000          1.00000000
  1  3  3  1  1
          0.48000000          1.00000000
# SILICON
Si pc-2
  9
  1  0  0 11  3
     120040.00000000          0.00016075          0.00000000          0.00000000
      17991.00000000          0.00124720         -0.00000068          0.00000000
       4094.80000000          0.00650400         -0.00000211         -0.00000399
       1159.60000000          0.02666500         -0.00006916         -0.00005020
        378.00000000          0.08881600         -0.00048080         -0.00057553
        135.93000000          0.22932000         -0.00416940         -0.00415240
         52.41100000          0.40025000         -0.01767400         -0.02043700
         20.92700000          0.33828000         -0.04289100         -0.04699800
          7.71300000          0.06551200          0.04536800          0.04398600
          3.16040000          0.00000000          0.13904000          0.33957000
          1.23480000          0.00000000          0.00000000          0.35038000
  1  0  0  1  1
          0.26775000          1.00000000
  1  0  0  1  1
          0.09406700          1.00000000
  1  1  1  8  2
        677.13000000          0.00109250          0.00000000
        160.67000000          0.00896010          0.00000790
         51.58500000          0.04474400         -0.00013613
         18.94800000          0.14748000         -0.00090378
          7.61630000          0.31480000         -0.00558630
          3.13170000          0.41339000         -0.01014100
          1.27030000          0.26440000          0.01866100
          0.43332000          0.00000000          0.28890000
  1  1  1  1  1
          0.16088000          1.00000000
  1  1  1  1  1
          0.05488300          1.00000000
  1  2  2  1  1
          1.68000000          1.00000000
  1  2  2  1  1
          0.38000000          1.00000000
  1  3  3  1  1
          0.54000000          1.00000000
# PHOSPHOROUS
P  pc-2
  9
  1  0  0 11  3
     145680.00000000          0.00015016          0.00000000          0.00000000
      21836.00000000          0.00116500         -0.00000105          0.00000000
       4969.90000000          0.00607980         -0.00000168         -0.00000249
       1407.30000000          0.02496800         -0.00008760         -0.00003095
        458.78000000          0.08363700         -0.00052745         -0.00035776
        165.08000000          0.21863000         -0.00495750         -0.00261230
         63.74400000          0.39234000         -0.02053500         -0.01320400
         25.59800000          0.35038000         -0.05503000         -0.03284800
          9.93070000          0.07728700          0.04158300          0.01818200
          3.96860000          0.00000000          0.17029000          0.25722000
          1.55650000          0.00000000          0.00000000          0.30682000
  1  0  0  1  1
          0.35404000          1.00000000
  1  0  0  1  1
          0.12394000          1.00000000
  1  1  1  8  2
        826.23000000          0.00102250          0.00000000
        196.02000000          0.00844720          0.00000411
         62.95100000          0.04266400         -0.00015057
         23.22200000          0.14239000         -0.00111410
          9.38850000          0.31059000         -0.00649420
          3.89970000          0.41672000         -0.01246900
          1.60480000          0.26618000          0.02345800
          0.56053000          0.00000000          0.32270000
  1  1  1  1  1
          0.21175000          1.00000000
  1  1  1  1  1
          0.07348600          1.00000000
  1  2  2  1  1
          1.89000000          1.00000000
  1  2  2  1  1
          0.43000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
# SULFUR
S  pc-2
  9
  1  0  0 11  3
     172030.00000000          0.00014353          0.00000000          0.00000000
      25783.00000000          0.00111370         -0.00000119          0.00000000
       5868.20000000          0.00581430         -0.00000123         -0.00000220
       1661.70000000          0.02390300         -0.00009048         -0.00002837
        541.75000000          0.08035400         -0.00050105         -0.00032591
        195.01000000          0.21175000         -0.00495100         -0.00241310
         75.39600000          0.38664000         -0.02025200         -0.01235200
         30.40700000          0.35747000         -0.05738800         -0.03211900
         12.12100000          0.08613100          0.03484700          0.01161100
          4.77770000          0.00000000          0.16833000          0.25542000
          1.89060000          0.00000000          0.00000000          0.31384000
  1  0  0  1  1
          0.44686000          1.00000000
  1  0  0  1  1
          0.15621000          1.00000000
  1  1  1  8  2
        968.12000000          0.00100480          0.00000000
        229.70000000          0.00833130         -0.00000807
         73.83300000          0.04226000         -0.00016943
         27.31200000          0.14206000         -0.00152430
         11.07400000          0.31256000         -0.00719930
          4.63070000          0.41933000         -0.01611300
          1.92990000          0.25924000          0.03423400
          0.68783000          0.00000000          0.35518000
  1  1  1  1  1
          0.25663000          1.00000000
  1  1  1  1  1
          0.08725100          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  3  3  1  1
          0.66000000          1.00000000
# CHLORINE
Cl pc-2
  9
  1  0  0 11  3
     201150.00000000          0.00013753          0.00000000          0.00000000
      30146.00000000          0.00106710         -0.00000134          0.00000000
       6861.00000000          0.00557370         -0.00000095         -0.00000197
       1942.80000000          0.02293500         -0.00009465         -0.00002487
        633.42000000          0.07735400         -0.00048337         -0.00028967
        228.10000000          0.20534000         -0.00500090         -0.00215130
         88.28800000          0.38093000         -0.02023000         -0.01119500
         35.75000000          0.36361000         -0.06020900         -0.03018000
         14.57100000          0.09518200          0.02919500          0.00594560
          5.65800000          0.00000000          0.16993000          0.24702000
          2.25540000          0.00000000          0.00000000          0.31412000
  1  0  0  1  1
          0.54947000          1.00000000
  1  0  0  1  1
          0.19126000          1.00000000
  1  1  1  8  2
       1129.90000000          0.00097621          0.00000000
        268.06000000          0.00812600         -0.00001160
         86.22200000          0.04143300         -0.00018289
         31.97900000          0.14035000         -0.00171700
         13.00800000          0.31207000         -0.00789740
          5.47660000          0.42099000         -0.01823700
          2.30900000          0.25664000          0.04003500
          0.84601000          0.00000000          0.36717000
  1  1  1  1  1
          0.31659000          1.00000000
  1  1  1  1  1
          0.10716000          1.00000000
  1  2  2  1  1
          2.31000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  3  3  1  1
          0.72000000          1.00000000
# ARGON
Ar pc-2
  9
  1  0  0 11  3
     232510.00000000          0.00006626          0.00000000          0.00000000
      34844.00000000          0.00051412         -0.00000706          0.00000000
       7930.30000000          0.00268610         -0.00000242         -0.00000094
       2245.70000000          0.01106200         -0.00047564         -0.00001183
        732.22000000          0.03740800         -0.00227710         -0.00013817
        263.77000000          0.09992800         -0.02452700         -0.00103240
        102.19000000          0.18788000         -0.09819400         -0.00543290
         41.52500000          0.18427000         -0.30459000         -0.01508500
         17.20200000          0.05178200          0.11940000          0.00111200
          6.59670000          0.00000000          0.83173000          0.12461000
          2.64770000          0.00000000          0.00000000          0.16083000
  1  0  0  1  1
          0.66193000          1.00000000
  1  0  0  1  1
          0.22901000          1.00000000
  1  1  1  8  2
       1297.70000000          0.00047997          0.00000000
        307.86000000          0.00400670         -0.00000664
         99.09600000          0.02049700         -0.00009881
         36.83700000          0.06981900         -0.00093571
         15.02700000          0.15625000         -0.00431330
          6.36620000          0.21099000         -0.00986480
          2.71100000          0.12665000          0.02233400
          1.01820000          0.00000000          0.18833000
  1  1  1  1  1
          0.38274000          1.00000000
  1  1  1  1  1
          0.12946000          1.00000000
  1  2  2  1  1
          2.52000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  3  3  1  1
          0.78000000          1.00000000
# POTASSIUM
K pc-2
  9
  1  0  0  14  4
      0.49031D+06            0.76873D-04           -0.14557D-04            0.45420D-05            0.21833D-05
      0.73452D+05            0.59725D-03           -0.11322D-03            0.35396D-04            0.17029D-04
      0.16715D+05            0.31309D-02           -0.59406D-03            0.18523D-03            0.89005D-04
      0.47333D+04            0.13065D-01           -0.24963D-02            0.78178D-03            0.37632D-03
      0.15432D+04            0.45878D-01           -0.89015D-02            0.27789D-02            0.13349D-02
      0.55614D+03            0.13523D+00           -0.27450D-01            0.86600D-02            0.41736D-02
      0.21583D+03            0.31543D+00           -0.70947D-01            0.22444D-01            0.10789D-01
      0.88671D+02            0.50000D+00           -0.14113D+00            0.46255D-01            0.22405D-01
      0.37545D+02            0.39731D+00           -0.16641D+00            0.56351D-01            0.27190D-01
      0.14821D+02            0.75162D-01            0.81108D-01           -0.29235D-01           -0.13836D-01
      0.66038D+01           -0.77805D-02            0.50000D+00           -0.26267D+00           -0.13431D+00
      0.28439D+01            0.26869D-02            0.38155D+00           -0.26850D+00           -0.14280D+00
      0.83912D+00           -0.82649D-03            0.27774D-01            0.50000D+00            0.32871D+00
      0.31699D+00            0.33236D-03           -0.52890D-02            0.45268D+00            0.50000D+00
  1  0  0  1  1
      0.46463D-01            1.0000000
  1  0  0  1  1
      0.18969D-01            1.0000000
  1  1  1  9  2
      0.15652D+04            0.10191D-02           -0.25097D-03
      0.37132D+03            0.85666D-02           -0.21181D-02
      0.11948D+03            0.44395D-01           -0.11110D-01
      0.44573D+02            0.15358D+00           -0.39456D-01
      0.18273D+02            0.35430D+00           -0.95531D-01
      0.78009D+01            0.50000D+00           -0.14269D+00
      0.33555D+01            0.32838D+00           -0.46495D-01
      0.13020D+01            0.49690D-01            0.32716D+00
      0.51452D+00           -0.42662D-02            0.50000D+00
  1  1  1  1  1
      0.18643D+00            1.0000000
  1  1  1  1  1
      0.40400D-01            1.0000000
  1  2  2  3  1
      0.67900D+01            0.70953D-01
      0.16960D+01            0.26515D+00
      0.49800D+00            0.50000D+00
  1  2  2  1  1
      0.12600D+00            1.0000000
  1  2  2  1  1
      0.28200D-01            1.0000000
# CALCIUM
Ca pc-2
  9
  1  0  0  14  4
      0.56399D+06            0.74252D-04           -0.14232D-04            0.47129D-05            0.21583D-05
      0.84494D+05            0.57688D-03           -0.11061D-03            0.36691D-04            0.16793D-04
      0.19229D+05            0.30242D-02           -0.58089D-03            0.19227D-03            0.88077D-04
      0.54456D+04            0.12626D-01           -0.24388D-02            0.81021D-03            0.37076D-03
      0.17758D+04            0.44381D-01           -0.87143D-02            0.28885D-02            0.13239D-02
      0.64024D+03            0.13131D+00           -0.26887D-01            0.89958D-02            0.41181D-02
      0.24867D+03            0.30898D+00           -0.70061D-01            0.23542D-01            0.10815D-01
      0.10230D+03            0.50000D+00           -0.14075D+00            0.48896D-01            0.22455D-01
      0.43456D+02            0.41353D+00           -0.17370D+00            0.62623D-01            0.29113D-01
      0.17670D+02            0.86789D-01            0.57714D-01           -0.21863D-01           -0.10548D-01
      0.77954D+01           -0.65743D-02            0.50000D+00           -0.27512D+00           -0.13286D+00
      0.33564D+01            0.25018D-02            0.40876D+00           -0.31005D+00           -0.16314D+00
      0.10267D+01           -0.84272D-03            0.33666D-01            0.50000D+00            0.33699D+00
      0.40855D+00            0.36306D-03           -0.65801D-02            0.49432D+00            0.50000D+00
  1  0  0  1  1
      0.73902D-01            1.0000000
  1  0  0  1  1
      0.29219D-01            1.0000000
  1  1  1  9  2
      0.18388D+04            0.94221D-03           -0.24151D-03
      0.43611D+03            0.79623D-02           -0.20465D-02
      0.14032D+03            0.41621D-01           -0.10843D-01
      0.52500D+02            0.14566D+00           -0.38899D-01
      0.21607D+02            0.34344D+00           -0.96539D-01
      0.92810D+01            0.50000D+00           -0.14857D+00
      0.40259D+01            0.34366D+00           -0.58795D-01
      0.16008D+01            0.57350D-01            0.31848D+00
      0.65429D+00           -0.45293D-02            0.50000D+00
  1  1  1  1  1
      0.24875D+00            1.0000000
  1  1  1  1  1
      0.54100D-01            1.0000000
  1  2  2  3  1
      0.11460D+02            0.55849D-01
      0.29940D+01            0.24111D+00
      0.92500D+00            0.50000D+00
  1  2  2  1  1
      0.26400D+00            1.0000000
  1  2  2  1  1
      0.67100D-01            1.0000000
# GALLIUM
Ga pc-2
  10
  1  0  0  14  4
      0.13009D+07            0.77086D-04           -0.15182D-04            0.52841D-05            0.26964D-05
      0.19489D+06            0.59874D-03           -0.11815D-03            0.41256D-04            0.21024D-04
      0.44358D+05            0.31385D-02           -0.61917D-03            0.21525D-03            0.10991D-03
      0.12563D+05            0.13090D-01           -0.26058D-02            0.91224D-03            0.46462D-03
      0.40972D+04            0.45969D-01           -0.92809D-02            0.32303D-02            0.16513D-02
      0.14776D+04            0.13556D+00           -0.28794D-01            0.10182D-01            0.51861D-02
      0.57424D+03            0.31708D+00           -0.74729D-01            0.26446D-01            0.13569D-01
      0.23641D+03            0.50000D+00           -0.15108D+00            0.56203D-01            0.28727D-01
      0.10064D+03            0.38886D+00           -0.17012D+00            0.65434D-01            0.34237D-01
      0.38259D+02            0.69320D-01            0.13293D+00           -0.59109D-01           -0.32561D-01
      0.18334D+02           -0.12647D-01            0.50000D+00           -0.33842D+00           -0.18378D+00
      0.85694D+01            0.47529D-02            0.30177D+00           -0.21478D+00           -0.13190D+00
      0.31148D+01           -0.15611D-02            0.20096D-01            0.50000D+00            0.38198D+00
      0.12378D+01            0.56025D-03           -0.25330D-02            0.43692D+00            0.50000D+00
  1  0  0  1  1
      0.22891D+00            1.0000000
  1  0  0  1  1
      0.80194D-01            1.0000000
  1  1  1  11  3
      0.59711D+04            0.66161D-03           -0.19011D-03            0.81083D-04
      0.14150D+04            0.57143D-02           -0.16489D-02            0.70714D-03
      0.45673D+03            0.30892D-01           -0.90247D-02            0.38547D-02
      0.17335D+03            0.11510D+00           -0.34535D-01            0.14872D-01
      0.72547D+02            0.30173D+00           -0.95440D-01            0.41036D-01
      0.32109D+02            0.50000D+00           -0.16902D+00            0.73943D-01
      0.14561D+02            0.41342D+00           -0.11006D+00            0.45098D-01
      0.64172D+01            0.10205D+00            0.24401D+00           -0.12305D+00
      0.28040D+01           -0.20771D-02            0.50000D+00           -0.27822D+00
      0.11542D+01            0.14797D-02            0.31152D+00           -0.14395D+00
      0.35267D+00           -0.52159D-03            0.30405D-01            0.50000D+00
  1  1  1  1  1
      0.12140D+00            1.0000000
  1  1  1  1  1
      0.38957D-01            1.0000000
  1  2  2  7  1
      0.23904D+03            0.30107D-02
      0.71251D+02            0.24297D-01
      0.26772D+02            0.10669D+00
      0.11019D+02            0.28480D+00
      0.47732D+01            0.46323D+00
      0.20188D+01            0.50000D+00
      0.80666D+00            0.37219D+00
  1  2  2  1  1
      0.29053D+00            1.0000000
  1  2  2  1  1
      0.10800D+00            1.0000000
  1  3  3  1  1
      0.360000D+00           1.0000000
#GERMANIUM
Ge pc-2
  10
  1  0  0  14  4
      0.14140D+07            0.75568D-04           -0.14960D-04            0.53295D-05            0.25892D-05
      0.21183D+06            0.58703D-03           -0.11640D-03            0.41602D-04            0.20181D-04
      0.48210D+05            0.30776D-02           -0.61037D-03            0.21719D-03            0.10560D-03
      0.13653D+05            0.12842D-01           -0.25680D-02            0.92017D-03            0.44610D-03
      0.44522D+04            0.45136D-01           -0.91590D-02            0.32629D-02            0.15883D-02
      0.16055D+04            0.13341D+00           -0.28431D-01            0.10289D-01            0.49882D-02
      0.62400D+03            0.31358D+00           -0.74124D-01            0.26847D-01            0.13120D-01
      0.25694D+03            0.50000D+00           -0.15066D+00            0.57340D-01            0.27894D-01
      0.10946D+03            0.39710D+00           -0.17427D+00            0.68586D-01            0.34219D-01
      0.42243D+02            0.74268D-01            0.11698D+00           -0.52429D-01           -0.27810D-01
      0.20265D+02           -0.12355D-01            0.50000D+00           -0.34240D+00           -0.17698D+00
      0.94545D+01            0.46541D-02            0.31982D+00           -0.23788D+00           -0.13997D+00
      0.34275D+01           -0.15601D-02            0.22949D-01            0.50000D+00            0.37096D+00
      0.13869D+01            0.58637D-03           -0.30704D-02            0.45876D+00            0.50000D+00
  1  0  0  1  1
      0.27977D+00            1.0000000
  1  0  0  1  1
      0.10058D+00            1.0000000
  1  1  1  11  3
      0.68160D+04            0.60587D-03           -0.17517D-03            0.99992D-04
      0.16149D+04            0.52515D-02           -0.15216D-02            0.86854D-03
      0.52153D+03            0.28523D-01           -0.83776D-02            0.47899D-02
      0.19841D+03            0.10755D+00           -0.32336D-01            0.18528D-01
      0.83176D+02            0.28906D+00           -0.91661D-01            0.52830D-01
      0.36907D+02            0.50000D+00           -0.16903D+00            0.98110D-01
      0.16821D+02            0.44437D+00           -0.13023D+00            0.74191D-01
      0.75533D+01            0.12756D+00            0.20384D+00           -0.14301D+00
      0.33645D+01           -0.55271D-04            0.50000D+00           -0.36471D+00
      0.14232D+01            0.16073D-02            0.35330D+00           -0.25920D+00
      0.50069D+00           -0.64088D-03            0.46906D-01            0.50000D+00
  1  1  1  1  1
      0.18003D+00            1.0000000
  1  1  1  1  1
      0.58705D-01            1.0000000
  1  2  2  7  1
      0.27975D+03            0.26010D-02
      0.83409D+02            0.21490D-01
      0.31377D+02            0.97315D-01
      0.13019D+02            0.26600D+00
      0.57150D+01            0.45028D+00
      0.24665D+01            0.50000D+00
      0.10159D+01            0.36739D+00
  1  2  2  1  1
      0.38206D+00            1.0000000
  1  2  2  1  1
      0.14100D+00            1.0000000
  1  3  3  1  1
      0.400000D+00           1.0000000
# ARSENIC
As pc-2
  10
  1  0  0  14  4
      0.15350D+07            0.74073D-04           -0.14734D-04            0.53618D-05            0.25012D-05
      0.22989D+06            0.57566D-03           -0.11465D-03            0.41857D-04            0.19493D-04
      0.52312D+05            0.30182D-02           -0.60153D-03            0.21864D-03            0.10208D-03
      0.14816D+05            0.12596D-01           -0.25292D-02            0.92569D-03            0.43079D-03
      0.48321D+04            0.44296D-01           -0.90305D-02            0.32862D-02            0.15362D-02
      0.17428D+04            0.13122D+00           -0.28043D-01            0.10365D-01            0.48234D-02
      0.67743D+03            0.30997D+00           -0.73450D-01            0.27170D-01            0.12755D-01
      0.27900D+03            0.50000D+00           -0.15013D+00            0.58332D-01            0.27236D-01
      0.11894D+03            0.40581D+00           -0.17840D+00            0.71688D-01            0.34394D-01
      0.46620D+02            0.79723D-01            0.10091D+00           -0.45360D-01           -0.23446D-01
      0.22338D+02           -0.11858D-01            0.50000D+00           -0.34571D+00           -0.17151D+00
      0.10392D+02            0.45049D-02            0.33801D+00           -0.26130D+00           -0.14852D+00
      0.37584D+01           -0.15422D-02            0.25913D-01            0.50000D+00            0.36369D+00
      0.15469D+01            0.60285D-03           -0.36372D-02            0.47938D+00            0.50000D+00
  1  0  0  1  1
      0.33257D+00            1.0000000
  1  0  0  1  1
      0.12133D+00            1.0000000
  1  1  1  11  3
      0.73038D+04            0.60213D-03           -0.17406D-03            0.84758D-04
      0.17307D+04            0.52182D-02           -0.15122D-02            0.73819D-03
      0.55920D+03            0.28357D-01           -0.83285D-02            0.40624D-02
      0.21278D+03            0.10718D+00           -0.32241D-01            0.15805D-01
      0.89235D+02            0.28869D+00           -0.91592D-01            0.45042D-01
      0.39641D+02            0.50000D+00           -0.16927D+00            0.84251D-01
      0.18098D+02            0.44462D+00           -0.13020D+00            0.62729D-01
      0.81465D+01            0.12773D+00            0.20434D+00           -0.12247D+00
      0.36352D+01            0.79843D-05            0.50000D+00           -0.32094D+00
      0.15493D+01            0.15802D-02            0.34378D+00           -0.20148D+00
      0.53099D+00           -0.64409D-03            0.41402D-01            0.50000D+00
  1  1  1  1  1
      0.20264D+00            1.0000000
  1  1  1  1  1
      0.69208D-01            1.0000000
  1  2  2  7  1
      0.31013D+03            0.24931D-02
      0.92538D+02            0.20790D-01
      0.34879D+02            0.95114D-01
      0.14540D+02            0.26232D+00
      0.64201D+01            0.44917D+00
      0.27986D+01            0.50000D+00
      0.11720D+01            0.35016D+00
  1  2  2  1  1
      0.45307D+00            1.0000000
  1  2  2  1  1
      0.16800D+00            1.0000000
  1  3  3  1  1
      0.440000D+00           1.0000000
# SELENIUM
Se pc-2
  10
  1  0  0  14  4
      0.16620D+07            0.72653D-04           -0.14516D-04            0.53745D-05            0.24210D-05
      0.24899D+06            0.56443D-03           -0.11288D-03            0.41929D-04            0.18854D-04
      0.56665D+05            0.29595D-02           -0.59248D-03            0.21912D-03            0.98785D-04
      0.16047D+05            0.12357D-01           -0.24909D-02            0.92757D-03            0.41679D-03
      0.52328D+04            0.43504D-01           -0.89069D-02            0.32979D-02            0.14888D-02
      0.18868D+04            0.12921D+00           -0.27683D-01            0.10410D-01            0.46772D-02
      0.73331D+03            0.30668D+00           -0.72830D-01            0.27408D-01            0.12427D-01
      0.30202D+03            0.50000D+00           -0.14964D+00            0.59129D-01            0.26659D-01
      0.12885D+03            0.41397D+00           -0.18215D+00            0.74437D-01            0.34513D-01
      0.51213D+02            0.85106D-01            0.86822D-01           -0.38932D-01           -0.19702D-01
      0.24469D+02           -0.11274D-01            0.50000D+00           -0.34847D+00           -0.16713D+00
      0.11352D+02            0.43541D-02            0.35410D+00           -0.28190D+00           -0.15530D+00
      0.40988D+01           -0.15252D-02            0.28713D-01            0.50000D+00            0.35795D+00
      0.17148D+01            0.61870D-03           -0.42192D-02            0.49604D+00            0.50000D+00
  1  0  0  1  1
      0.39038D+00            1.0000000
  1  0  0  1  1
      0.14362D+00            1.0000000
  1  1  1  11  3
      0.78541D+04            0.59412D-03           -0.17210D-03            0.76435D-04
      0.18610D+04            0.51541D-02           -0.14968D-02            0.66800D-03
      0.60130D+03            0.28045D-01           -0.82540D-02            0.36724D-02
      0.22889D+03            0.10628D+00           -0.32041D-01            0.14366D-01
      0.96050D+02            0.28734D+00           -0.91378D-01            0.40994D-01
      0.42724D+02            0.50000D+00           -0.16976D+00            0.77458D-01
      0.19547D+02            0.44769D+00           -0.13221D+00            0.57687D-01
      0.88345D+01            0.13059D+00            0.20117D+00           -0.11035D+00
      0.39597D+01            0.31098D-03            0.50000D+00           -0.30138D+00
      0.17059D+01            0.15814D-02            0.33962D+00           -0.17195D+00
      0.58864D+00           -0.64798D-03            0.39091D-01            0.50000D+00
  1  1  1  1  1
      0.22781D+00            1.0000000
  1  1  1  1  1
      0.78764D-01            1.0000000
  1  2  2  7  1
      0.35994D+03            0.21577D-02
      0.10741D+03            0.18353D-01
      0.40569D+02            0.86071D-01
      0.17068D+02            0.24257D+00
      0.76305D+01            0.43330D+00
      0.33857D+01            0.50000D+00
      0.14526D+01            0.35773D+00
  1  2  2  1  1
      0.57800D+00            1.0000000
  1  2  2  1  1
      0.21400D+00            1.0000000
  1  3  3  1  1
      0.480000D+00           1.0000000
# BROMINE
Br pc-2
  10
  1  0  0  14  4
      0.17930D+07            0.71496D-04           -0.14346D-04            0.52612D-05            0.23529D-05
      0.26859D+06            0.55550D-03           -0.11153D-03            0.41036D-04            0.18319D-04
      0.61122D+05            0.29131D-02           -0.58574D-03            0.21457D-03            0.96046D-04
      0.17307D+05            0.12169D-01           -0.24621D-02            0.90811D-03            0.40509D-03
      0.56432D+04            0.42868D-01           -0.88135D-02            0.32324D-02            0.14489D-02
      0.20350D+04            0.12753D+00           -0.27396D-01            0.10203D-01            0.45510D-02
      0.79115D+03            0.30383D+00           -0.72319D-01            0.26956D-01            0.12136D-01
      0.32604D+03            0.50000D+00           -0.14921D+00            0.58367D-01            0.26128D-01
      0.13928D+03            0.42180D+00           -0.18567D+00            0.75131D-01            0.34606D-01
      0.56172D+02            0.90718D-01            0.73321D-01           -0.31841D-01           -0.16267D-01
      0.26718D+02           -0.10459D-01            0.50000D+00           -0.34198D+00           -0.16305D+00
      0.12360D+02            0.41467D-02            0.37002D+00           -0.29508D+00           -0.16187D+00
      0.44611D+01           -0.14868D-02            0.31589D-01            0.48710D+00            0.35236D+00
      0.18941D+01            0.62209D-03           -0.48009D-02            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.45120D+00            1.0000000
  1  0  0  1  1
      0.16695D+00            1.0000000
  1  1  1  11  3
      0.85222D+04            0.57817D-03           -0.16793D-03            0.75145D-04
      0.20192D+04            0.50212D-02           -0.14617D-02            0.65736D-03
      0.65266D+03            0.27358D-01           -0.80726D-02            0.36190D-02
      0.24863D+03            0.10414D+00           -0.31459D-01            0.14217D-01
      0.10441D+03            0.28379D+00           -0.90439D-01            0.40897D-01
      0.46503D+02            0.50000D+00           -0.17011D+00            0.78302D-01
      0.21327D+02            0.45662D+00           -0.13777D+00            0.60769D-01
      0.96974D+01            0.13865D+00            0.19096D+00           -0.10689D+00
      0.43752D+01            0.11620D-02            0.50000D+00           -0.30804D+00
      0.19086D+01            0.15924D-02            0.34477D+00           -0.17612D+00
      0.67854D+00           -0.66766D-03            0.40822D-01            0.50000D+00
  1  1  1  1  1
      0.26568D+00            1.0000000
  1  1  1  1  1
      0.92596D-01            1.0000000
  1  2  2  7  1
      0.40032D+03            0.20244D-02
      0.11953D+03            0.17386D-01
      0.45236D+02            0.82477D-01
      0.19132D+02            0.23514D+00
      0.86060D+01            0.42786D+00
      0.38554D+01            0.50000D+00
      0.16775D+01            0.35240D+00
  1  2  2  1  1
      0.68030D+00            1.0000000
  1  2  2  1  1
      0.25200D+00            1.0000000
  1  3  3  1  1
      0.530000D+00           1.0000000
# KRYPTON
Kr pc-2
  10
  1  0  0  14  4
      0.19316D+07            0.70317D-04           -0.14170D-04            0.51214D-05            0.22913D-05
      0.28938D+06            0.54633D-03           -0.11013D-03            0.39932D-04            0.17832D-04
      0.65857D+05            0.28647D-02           -0.57853D-03            0.20886D-03            0.93527D-04
      0.18650D+05            0.11968D-01           -0.24306D-02            0.88344D-03            0.39423D-03
      0.60818D+04            0.42183D-01           -0.87089D-02            0.31478D-02            0.14115D-02
      0.21932D+04            0.12575D+00           -0.27084D-01            0.99388D-02            0.44349D-02
      0.85272D+03            0.30088D+00           -0.71773D-01            0.26362D-01            0.11875D-01
      0.35146D+03            0.50000D+00           -0.14879D+00            0.57326D-01            0.25675D-01
      0.15029D+03            0.42959D+00           -0.18905D+00            0.75360D-01            0.34738D-01
      0.61400D+02            0.96487D-01            0.60984D-01           -0.25404D-01           -0.13247D-01
      0.29044D+02           -0.95975D-02            0.50000D+00           -0.33433D+00           -0.15973D+00
      0.13399D+02            0.39448D-02            0.38479D+00           -0.30505D+00           -0.16782D+00
      0.48358D+01           -0.14481D-02            0.34364D-01            0.47351D+00            0.34840D+00
      0.20813D+01            0.62296D-03           -0.53829D-02            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.51538D+00            1.0000000
  1  0  0  1  1
      0.19103D+00            1.0000000
  1  1  1  11  3
      0.92214D+04            0.56343D-03           -0.16402D-03            0.74245D-04
      0.21847D+04            0.48987D-02           -0.14289D-02            0.64993D-03
      0.70627D+03            0.26738D-01           -0.79066D-02            0.35859D-02
      0.26918D+03            0.10223D+00           -0.30935D-01            0.14142D-01
      0.11310D+03            0.28061D+00           -0.89584D-01            0.41002D-01
      0.50433D+02            0.50000D+00           -0.17041D+00            0.79391D-01
      0.23182D+02            0.46488D+00           -0.14282D+00            0.64004D-01
      0.10601D+02            0.14642D+00            0.18152D+00           -0.10424D+00
      0.48113D+01            0.20792D-02            0.50000D+00           -0.31511D+00
      0.21221D+01            0.15873D-02            0.34916D+00           -0.18150D+00
      0.77418D+00           -0.68042D-03            0.42406D-01            0.50000D+00
  1  1  1  1  1
      0.30650D+00            1.0000000
  1  1  1  1  1
      0.10776D+00            1.0000000
  1  2  2  7  1
      0.45633D+03            0.17948D-02
      0.13635D+03            0.15618D-01
      0.51762D+02            0.75317D-01
      0.22080D+02            0.21877D+00
      0.10022D+02            0.41334D+00
      0.45476D+01            0.50000D+00
      0.20128D+01            0.36311D+00
  1  2  2  1  1
      0.83098D+00            1.0000000
  1  2  2  1  1
      0.30800D+00            1.0000000
  1  3  3  1  1
      0.590000D+00           1.0000000
# SCANDIUM (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Sc pc-2
  12
  1  0  0  14  4
      0.62773D+06            0.73549D-04           -0.14192D-04            0.47556D-05            0.21878D-05
      0.94052D+05            0.57146D-03           -0.11031D-03            0.37034D-04            0.17027D-04
      0.21398D+05            0.29975D-02           -0.57968D-03            0.19412D-03            0.89331D-04
      0.60576D+04            0.12522D-01           -0.24349D-02            0.81882D-03            0.37641D-03
      0.19747D+04            0.44053D-01           -0.87080D-02            0.29200D-02            0.13445D-02
      0.71175D+03            0.13053D+00           -0.26902D-01            0.91142D-02            0.41913D-02
      0.27642D+03            0.30786D+00           -0.70259D-01            0.23888D-01            0.11026D-01
      0.11374D+03            0.50000D+00           -0.14164D+00            0.49889D-01            0.23019D-01
      0.48371D+02            0.41619D+00           -0.17576D+00            0.64169D-01            0.29986D-01
      0.19731D+02            0.88713D-01            0.55680D-01           -0.21167D-01           -0.10304D-01
      0.87680D+01           -0.66932D-02            0.50000D+00           -0.28163D+00           -0.13687D+00
      0.38055D+01            0.25878D-02            0.40915D+00           -0.31324D+00           -0.16592D+00
      0.11908D+01           -0.87244D-03            0.34107D-01            0.50000D+00            0.33869D+00
      0.47421D+00            0.36884D-03           -0.63681D-02            0.49431D+00            0.50000D+00
  1  0  0  1  1
      0.86682D-01            1.0000000
  1  0  0  1  1
      0.33288D-01            1.0000000
  1  1  1  9  2
      0.20849D+04            0.91431D-03           -0.24044D-03
      0.49449D+03            0.77450D-02           -0.20440D-02
      0.15917D+03            0.40639D-01           -0.10866D-01
      0.59655D+02            0.14312D+00           -0.39278D-01
      0.24604D+02            0.34062D+00           -0.98426D-01
      0.10613D+02            0.50000D+00           -0.15310D+00
      0.46331D+01            0.34582D+00           -0.60835D-01
      0.18664D+01            0.58486D-01            0.32212D+00
      0.76764D+00           -0.42797D-02            0.50000D+00
  1  1  1  1  1
      0.29332D+00            1.0000000
  1  1  1  1  1
      0.64000D-01            1.0000000
  1  2  2  6  1
      0.65391D+02            0.39910D-02
      0.19287D+02            0.27645D-01
      0.71372D+01            0.10438D+00
      0.27868D+01            0.27396D+00
      0.11371D+01            0.43829D+00
      0.45070D+00            0.50000D+00
  1  2  2  1  1
      0.17109D+00            1.0000000
  1  2  2  1  1
      0.59811D-01            1.0000000
  1  3  3  1  1
      2.206000D+00           1.0000000
  1  3  3  1  1
      0.490000D+00           1.0000000
  1  4  4  1  1
      1.118000D+00           1.0000000
# TITANIUM (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Ti pc-2
  12
  1  0  0  14  4
      0.69008D+06            0.73457D-04           -0.14249D-04            0.48118D-05            0.22240D-05
      0.10338D+06            0.57071D-03           -0.11075D-03            0.37482D-04            0.17314D-04
      0.23528D+05            0.29919D-02           -0.58162D-03            0.19626D-03            0.90742D-04
      0.66631D+04            0.12492D-01           -0.24421D-02            0.82804D-03            0.38241D-03
      0.21729D+04            0.43933D-01           -0.87303D-02            0.29496D-02            0.13646D-02
      0.78350D+03            0.13018D+00           -0.26979D-01            0.92194D-02            0.42594D-02
      0.30439D+03            0.30737D+00           -0.70535D-01            0.24166D-01            0.11208D-01
      0.12527D+03            0.50000D+00           -0.14259D+00            0.50730D-01            0.23520D-01
      0.53296D+02            0.41692D+00           -0.17698D+00            0.65161D-01            0.30615D-01
      0.21701D+02            0.88934D-01            0.57112D-01           -0.21784D-01           -0.10688D-01
      0.97375D+01           -0.71250D-02            0.50000D+00           -0.28775D+00           -0.14079D+00
      0.42620D+01            0.27485D-02            0.40533D+00           -0.31138D+00           -0.16607D+00
      0.13594D+01           -0.92150D-03            0.33798D-01            0.50000D+00            0.34077D+00
      0.54108D+00            0.38132D-03           -0.60455D-02            0.49112D+00            0.50000D+00
  1  0  0  1  1
      0.98522D-01            1.0000000
  1  0  0  1  1
      0.37168D-01            1.0000000
  1  1  1  9  2
      0.23380D+04            0.89587D-03           -0.24016D-03
      0.55443D+03            0.76044D-02           -0.20475D-02
      0.17854D+03            0.40013D-01           -0.10909D-01
      0.67006D+02            0.14160D+00           -0.39683D-01
      0.27688D+02            0.33920D+00           -0.10010D+00
      0.11990D+02            0.50000D+00           -0.15668D+00
      0.52640D+01            0.34642D+00           -0.61655D-01
      0.21443D+01            0.58946D-01            0.32538D+00
      0.88504D+00           -0.40109D-02            0.50000D+00
  1  1  1  1  1
      0.33961D+00            1.0000000
  1  1  1  1  1
      0.74000D-01            1.0000000
  1  2  2  6  1
      0.87008D+02            0.31785D-02
      0.25764D+02            0.23345D-01
      0.94975D+01            0.95972D-01
      0.37279D+01            0.25973D+00
      0.15560D+01            0.43407D+00
      0.63471D+00            0.50000D+00
  1  2  2  1  1
      0.24526D+00            1.0000000
  1  2  2  1  1
      0.85776D-01            1.0000000
  1  3  3  1  1
      2.426000D+00           1.0000000
  1  3  3  1  1
      0.539000D+00           1.0000000
  1  4  4  1  1
      1.229000D+00           1.0000000
# VANADIUM (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
V pc-2
  12
  1  0  0  14  4
      0.75021D+06            0.73784D-04           -0.14374D-04            0.48708D-05            0.22842D-05
      0.11240D+06            0.57320D-03           -0.11173D-03            0.37958D-04            0.17789D-04
      0.25580D+05            0.30049D-02           -0.58661D-03            0.19861D-03            0.93170D-04
      0.72444D+04            0.12545D-01           -0.24639D-02            0.83875D-03            0.39299D-03
      0.23624D+04            0.44115D-01           -0.88044D-02            0.29843D-02            0.14009D-02
      0.85183D+03            0.13067D+00           -0.27228D-01            0.93452D-02            0.43803D-02
      0.33092D+03            0.30833D+00           -0.71151D-01            0.24461D-01            0.11513D-01
      0.13618D+03            0.50000D+00           -0.14395D+00            0.51526D-01            0.24237D-01
      0.57925D+02            0.41382D+00           -0.17683D+00            0.65394D-01            0.31197D-01
      0.23384D+02            0.86348D-01            0.64411D-01           -0.24858D-01           -0.12396D-01
      0.10643D+02           -0.80088D-02            0.50000D+00           -0.29395D+00           -0.14609D+00
      0.47068D+01            0.30187D-02            0.39488D+00           -0.30235D+00           -0.16396D+00
      0.15295D+01           -0.99833D-03            0.32392D-01            0.50000D+00            0.34497D+00
      0.60625D+00            0.40235D-03           -0.55268D-02            0.48354D+00            0.50000D+00
  1  0  0  1  1
      0.10969D+00            1.0000000
  1  0  0  1  1
      0.40507D-01            1.0000000
  1  1  1  9  2
      0.25920D+04            0.88700D-03           -0.24180D-03
      0.61466D+03            0.75383D-02           -0.20664D-02
      0.19802D+03            0.39740D-01           -0.11022D-01
      0.74393D+02            0.14116D+00           -0.40313D-01
      0.30783D+02            0.33942D+00           -0.10206D+00
      0.13372D+02            0.50000D+00           -0.16003D+00
      0.59001D+01            0.34454D+00           -0.60485D-01
      0.24235D+01            0.58175D-01            0.33089D+00
      0.10010D+01           -0.37322D-02            0.50000D+00
  1  1  1  1  1
      0.38440D+00            1.0000000
  1  1  1  1  1
      0.84000D-01            1.0000000
  1  2  2  6  1
      0.10108D+03            0.31327D-02
      0.29968D+02            0.23440D-01
      0.11079D+02            0.97713D-01
      0.43855D+01            0.26398D+00
      0.18440D+01            0.43965D+00
      0.75732D+00            0.50000D+00
  1  2  2  1  1
      0.29412D+00            1.0000000
  1  2  2  1  1
      0.10287D+00            1.0000000
  1  3  3  1  1
      2.669000D+00           1.0000000
  1  3  3  1  1
      0.593000D+00           1.0000000
  1  4  4  1  1
      1.352000D+00           1.0000000
# CHROMIUM (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Cr pc-2
  12
  1  0  0  14  4
      0.80766D+06            0.74527D-04           -0.14568D-04            0.49425D-05            0.23680D-05
      0.12095D+06            0.57936D-03           -0.11336D-03            0.38566D-04            0.18464D-04
      0.27517D+05            0.30382D-02           -0.59510D-03            0.20169D-03            0.96666D-04
      0.77916D+04            0.12683D-01           -0.25012D-02            0.85280D-03            0.40818D-03
      0.25405D+04            0.44592D-01           -0.89310D-02            0.30302D-02            0.14533D-02
      0.91599D+03            0.13192D+00           -0.27635D-01            0.95042D-02            0.45508D-02
      0.35583D+03            0.31053D+00           -0.72060D-01            0.24806D-01            0.11930D-01
      0.14641D+03            0.50000D+00           -0.14565D+00            0.52337D-01            0.25151D-01
      0.62248D+02            0.40766D+00           -0.17544D+00            0.65061D-01            0.31737D-01
      0.24761D+02            0.81755D-01            0.77420D-01           -0.30556D-01           -0.15563D-01
      0.11458D+02           -0.92412D-02            0.50000D+00           -0.30075D+00           -0.15289D+00
      0.51304D+01            0.33944D-02            0.37831D+00           -0.28738D+00           -0.15970D+00
      0.17019D+01           -0.11063D-02            0.30134D-01            0.50000D+00            0.35169D+00
      0.67172D+00            0.43306D-03           -0.48775D-02            0.47301D+00            0.50000D+00
  1  0  0  1  1
      0.12084D+00            1.0000000
  1  0  0  1  1
      0.43700D-01            1.0000000
  1  1  1  9  2
      0.28517D+04            0.88268D-03           -0.24424D-03
      0.67624D+03            0.75086D-02           -0.20917D-02
      0.21795D+03            0.39637D-01           -0.11162D-01
      0.81950D+02            0.14120D+00           -0.41020D-01
      0.33948D+02            0.34041D+00           -0.10408D+00
      0.14787D+02            0.50000D+00           -0.16311D+00
      0.65529D+01            0.34164D+00           -0.58440D-01
      0.27106D+01            0.56950D-01            0.33683D+00
      0.11196D+01           -0.34630D-02            0.50000D+00
  1  1  1  1  1
      0.42997D+00            1.0000000
  1  1  1  1  1
      0.93000D-01            1.0000000
  1  2  2  6  1
      0.11350D+03            0.32189D-02
      0.33691D+02            0.24294D-01
      0.12504D+02            0.10131D+00
      0.49861D+01            0.27190D+00
      0.21037D+01            0.44726D+00
      0.86548D+00            0.50000D+00
  1  2  2  1  1
      0.33585D+00            1.0000000
  1  2  2  1  1
      0.11682D+00            1.0000000
  1  3  3  1  1
      2.936000D+00           1.0000000
  1  3  3  1  1
      0.652000D+00           1.0000000
  1  4  4  1  1
      1.488000D+00           1.0000000
# MANGANESE (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Mn pc-2
  12
  1  0  0  14  4
      0.86191D+06            0.75730D-04           -0.14834D-04            0.50226D-05            0.24683D-05
      0.12913D+06            0.58820D-03           -0.11536D-03            0.39181D-04            0.19239D-04
      0.29393D+05            0.30830D-02           -0.60502D-03            0.20463D-03            0.10060D-03
      0.83249D+04            0.12864D-01           -0.25437D-02            0.86592D-03            0.42508D-03
      0.27148D+04            0.45200D-01           -0.90725D-02            0.30717D-02            0.15113D-02
      0.97889D+03            0.13351D+00           -0.28084D-01            0.96471D-02            0.47373D-02
      0.38027D+03            0.31327D+00           -0.73029D-01            0.25096D-01            0.12383D-01
      0.15646D+03            0.50000D+00           -0.14733D+00            0.52972D-01            0.26107D-01
      0.66496D+02            0.40034D+00           -0.17329D+00            0.64256D-01            0.32188D-01
      0.26012D+02            0.76761D-01            0.93652D-01           -0.37815D-01           -0.19772D-01
      0.12205D+02           -0.10432D-01            0.50000D+00           -0.30744D+00           -0.16044D+00
      0.55337D+01            0.37825D-02            0.35806D+00           -0.26764D+00           -0.15334D+00
      0.18729D+01           -0.12179D-02            0.27357D-01            0.50000D+00            0.36075D+00
      0.73615D+00            0.46295D-03           -0.41983D-02            0.45926D+00            0.50000D+00
  1  0  0  1  1
      0.13129D+00            1.0000000
  1  0  0  1  1
      0.46573D-01            1.0000000
  1  1  1  9  2
      0.31181D+04            0.88145D-03           -0.24702D-03
      0.73946D+03            0.75043D-02           -0.21197D-02
      0.23838D+03            0.39669D-01           -0.11318D-01
      0.89677D+02            0.14169D+00           -0.41778D-01
      0.37179D+02            0.34206D+00           -0.10610D+00
      0.16234D+02            0.50000D+00           -0.16584D+00
      0.72235D+01            0.33811D+00           -0.55706D-01
      0.30054D+01            0.55493D-01            0.34269D+00
      0.12407D+01           -0.32315D-02            0.50000D+00
  1  1  1  1  1
      0.47623D+00            1.0000000
  1  1  1  1  1
      0.10400D+00            1.0000000
  1  2  2  6  1
      0.12860D+03            0.31897D-02
      0.38203D+02            0.24383D-01
      0.14221D+02            0.10241D+00
      0.57084D+01            0.27473D+00
      0.24213D+01            0.45063D+00
      0.10011D+01            0.50000D+00
  1  2  2  1  1
      0.39050D+00            1.0000000
  1  2  2  1  1
      0.13618D+00            1.0000000
  1  3  3  1  1
      3.230000D+00           1.0000000
  1  3  3  1  1
      0.718000D+00           1.0000000
  1  4  4  1  1
      1.636000D+00           1.0000000
# IRON (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Fe pc-2
  12
  1  0  0  14  4
      0.92156D+06            0.76572D-04           -0.15017D-04            0.50843D-05            0.25597D-05
      0.13806D+06            0.59481D-03           -0.11684D-03            0.39683D-04            0.19960D-04
      0.31420D+05            0.31186D-02           -0.61271D-03            0.20720D-03            0.10436D-03
      0.88969D+04            0.13013D-01           -0.25778D-02            0.87764D-03            0.44129D-03
      0.29010D+04            0.45709D-01           -0.91870D-02            0.31101D-02            0.15678D-02
      0.10460D+04            0.13483D+00           -0.28449D-01            0.97768D-02            0.49173D-02
      0.40637D+03            0.31555D+00           -0.73807D-01            0.25371D-01            0.12829D-01
      0.16720D+03            0.50000D+00           -0.14868D+00            0.53560D-01            0.27035D-01
      0.71065D+02            0.39443D+00           -0.17136D+00            0.63667D-01            0.32715D-01
      0.27426D+02            0.72985D-01            0.10816D+00           -0.44674D-01           -0.23981D-01
      0.12985D+02           -0.11304D-01            0.50000D+00           -0.31381D+00           -0.16791D+00
      0.59480D+01            0.41045D-02            0.33969D+00           -0.25027D+00           -0.14774D+00
      0.20537D+01           -0.13157D-02            0.24909D-01            0.50000D+00            0.37030D+00
      0.80626D+00            0.48591D-03           -0.36066D-02            0.44820D+00            0.50000D+00
  1  0  0  1  1
      0.14100D+00            1.0000000
  1  0  0  1  1
      0.49381D-01            1.0000000
  1  1  1  9  2
      0.34165D+04            0.87163D-03           -0.24645D-03
      0.81019D+03            0.74283D-02           -0.21184D-02
      0.26129D+03            0.39322D-01           -0.11322D-01
      0.98391D+02            0.14088D+00           -0.41965D-01
      0.40839D+02            0.34152D+00           -0.10701D+00
      0.17870D+02            0.50000D+00           -0.16777D+00
      0.79769D+01            0.33771D+00           -0.55344D-01
      0.33391D+01            0.55454D-01            0.34349D+00
      0.13805D+01           -0.30556D-02            0.50000D+00
  1  1  1  1  1
      0.52998D+00            1.0000000
  1  1  1  1  1
      0.11500D+00            1.0000000
  1  2  2  6  1
      0.13752D+03            0.35029D-02
      0.40866D+02            0.26737D-01
      0.15248D+02            0.11096D+00
      0.61418D+01            0.29196D+00
      0.25978D+01            0.46428D+00
      0.10670D+01            0.50000D+00
  1  2  2  1  1
      0.41051D+00            1.0000000
  1  2  2  1  1
      0.14023D+00            1.0000000
  1  3  3  1  1
      3.553000D+00           1.0000000
  1  3  3  1  1
      0.789000D+00           1.0000000
  1  4  4  1  1
      1.800000D+00           1.0000000
# COBALT (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Co pc-2
  12
  1  0  0  14  4
      0.96756D+06            0.78814D-04           -0.15449D-04            0.52150D-05            0.27170D-05
      0.14492D+06            0.61231D-03           -0.12027D-03            0.40728D-04            0.21197D-04
      0.32982D+05            0.32094D-02           -0.63016D-03            0.21247D-03            0.11075D-03
      0.93406D+04            0.13385D-01           -0.26525D-02            0.90045D-03            0.46846D-03
      0.30458D+04            0.46967D-01           -0.94385D-02            0.31860D-02            0.16622D-02
      0.10984D+04            0.13808D+00           -0.29214D-01            0.10014D-01            0.52109D-02
      0.42693D+03            0.32080D+00           -0.75315D-01            0.25833D-01            0.13522D-01
      0.17585D+03            0.50000D+00           -0.15066D+00            0.54238D-01            0.28324D-01
      0.74851D+02            0.38302D+00           -0.16697D+00            0.62059D-01            0.33055D-01
      0.28371D+02            0.66704D-01            0.13247D+00           -0.56405D-01           -0.31353D-01
      0.13524D+02           -0.12043D-01            0.50000D+00           -0.32171D+00           -0.17837D+00
      0.62721D+01            0.44377D-02            0.31104D+00           -0.22270D+00           -0.13736D+00
      0.22277D+01           -0.14264D-02            0.21202D-01            0.50000D+00            0.38420D+00
      0.87368D+00            0.50811D-03           -0.28156D-02            0.43239D+00            0.50000D+00
  1  0  0  1  1
      0.15030D+00            1.0000000
  1  0  0  1  1
      0.51867D-01            1.0000000
  1  1  1  9  2
      0.37192D+04            0.86636D-03           -0.24710D-03
      0.88183D+03            0.73917D-02           -0.21280D-02
      0.28444D+03            0.39186D-01           -0.11384D-01
      0.10717D+03            0.14074D+00           -0.42349D-01
      0.44524D+02            0.34198D+00           -0.10822D+00
      0.19521D+02            0.50000D+00           -0.16969D+00
      0.87403D+01            0.33602D+00           -0.53963D-01
      0.36776D+01            0.54856D-01            0.34573D+00
      0.15215D+01           -0.28847D-02            0.50000D+00
  1  1  1  1  1
      0.58405D+00            1.0000000
  1  1  1  1  1
      0.12700D+00            1.0000000
  1  2  2  6  1
      0.15258D+03            0.35162D-02
      0.45365D+02            0.27079D-01
      0.16950D+02            0.11311D+00
      0.68539D+01            0.29625D+00
      0.29059D+01            0.46795D+00
      0.11952D+01            0.50000D+00
  1  2  2  1  1
      0.45954D+00            1.0000000
  1  2  2  1  1
      0.15661D+00            1.0000000
  1  3  3  1  1
      3.908000D+00           1.0000000
  1  3  3  1  1
      0.868000D+00           1.0000000
  1  4  4  1  1
      1.980000D+00           1.0000000
# NICKEL (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Ni pc-2
  12
  1  0  0  14  4
      0.10479D+07            0.78094D-04           -0.15315D-04            0.51816D-05            0.27340D-05
      0.15698D+06            0.60668D-03           -0.11922D-03            0.40470D-04            0.21330D-04
      0.35722D+05            0.31808D-02           -0.62481D-03            0.21115D-03            0.11147D-03
      0.10116D+05            0.13264D-01           -0.26298D-02            0.89493D-03            0.47147D-03
      0.32994D+04            0.46543D-01           -0.93563D-02            0.31654D-02            0.16727D-02
      0.11900D+04            0.13699D+00           -0.28990D-01            0.99628D-02            0.52496D-02
      0.46238D+03            0.31927D+00           -0.74944D-01            0.25766D-01            0.13661D-01
      0.19028D+03            0.50000D+00           -0.15064D+00            0.54401D-01            0.28765D-01
      0.80898D+02            0.38474D+00           -0.16762D+00            0.62491D-01            0.33729D-01
      0.30558D+02            0.67120D-01            0.13477D+00           -0.57781D-01           -0.32601D-01
      0.14586D+02           -0.12409D-01            0.50000D+00           -0.32536D+00           -0.18261D+00
      0.67810D+01            0.45951D-02            0.30505D+00           -0.21534D+00           -0.13490D+00
      0.24231D+01           -0.14745D-02            0.20277D-01            0.50000D+00            0.38887D+00
      0.94839D+00            0.51800D-03           -0.26096D-02            0.42709D+00            0.50000D+00
  1  0  0  1  1
      0.16016D+00            1.0000000
  1  0  0  1  1
      0.54522D-01            1.0000000
  1  1  1  9  2
      0.40303D+04            0.86284D-03           -0.24814D-03
      0.95576D+03            0.73640D-02           -0.21393D-02
      0.30841D+03            0.39076D-01           -0.11449D-01
      0.11627D+03            0.14069D+00           -0.42745D-01
      0.48335D+02            0.34262D+00           -0.10945D+00
      0.21225D+02            0.50000D+00           -0.17154D+00
      0.95284D+01            0.33408D+00           -0.52313D-01
      0.40263D+01            0.54103D-01            0.34845D+00
      0.16663D+01           -0.27318D-02            0.50000D+00
  1  1  1  1  1
      0.63946D+00            1.0000000
  1  1  1  1  1
      0.13900D+00            1.0000000
  1  2  2  6  1
      0.16700D+03            0.35821D-02
      0.49689D+02            0.27735D-01
      0.18599D+02            0.11600D+00
      0.75479D+01            0.30189D+00
      0.32046D+01            0.47235D+00
      0.13183D+01            0.50000D+00
  1  2  2  1  1
      0.50595D+00            1.0000000
  1  2  2  1  1
      0.17165D+00            1.0000000
  1  3  3  1  1
      4.299000D+00           1.0000000
  1  3  3  1  1
      0.955000D+00           1.0000000
  1  4  4  1  1
      2.178000D+00           1.0000000
# COPPER (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Cu pc-2
  12
  1  0  0  14  4
      0.11164D+07            0.78650D-04           -0.15411D-04            0.52154D-05            0.28094D-05
      0.16725D+06            0.61087D-03           -0.11996D-03            0.40732D-04            0.21914D-04
      0.38065D+05            0.32022D-02           -0.62846D-03            0.21243D-03            0.11450D-03
      0.10780D+05            0.13354D-01           -0.26462D-02            0.90076D-03            0.48439D-03
      0.35154D+04            0.46858D-01           -0.94128D-02            0.31854D-02            0.17187D-02
      0.12677D+04            0.13783D+00           -0.29174D-01            0.10030D-01            0.53946D-02
      0.49263D+03            0.32069D+00           -0.75324D-01            0.25914D-01            0.14031D-01
      0.20277D+03            0.50000D+00           -0.15127D+00            0.54704D-01            0.29522D-01
      0.86247D+02            0.38116D+00           -0.16608D+00            0.62048D-01            0.34225D-01
      0.32368D+02            0.65069D-01            0.14515D+00           -0.63144D-01           -0.36427D-01
      0.15459D+02           -0.12629D-01            0.50000D+00           -0.33030D+00           -0.18925D+00
      0.72184D+01            0.47307D-02            0.29072D+00           -0.19995D+00           -0.12880D+00
      0.26139D+01           -0.15241D-02            0.18369D-01            0.50000D+00            0.39761D+00
      0.10221D+01            0.52554D-03           -0.22409D-02            0.41776D+00            0.50000D+00
  1  0  0  1  1
      0.17048D+00            1.0000000
  1  0  0  1  1
      0.57247D-01            1.0000000
  1  1  1  9  2
      0.43498D+04            0.86105D-03           -0.24965D-03
      0.10314D+04            0.73546D-02           -0.21556D-02
      0.33286D+03            0.39067D-01           -0.11542D-01
      0.12554D+03            0.14092D+00           -0.43226D-01
      0.52221D+02            0.34367D+00           -0.11080D+00
      0.22965D+02            0.50000D+00           -0.17338D+00
      0.10335D+02            0.33169D+00           -0.50208D-01
      0.43823D+01            0.53155D-01            0.35188D+00
      0.18139D+01           -0.26014D-02            0.50000D+00
  1  1  1  1  1
      0.69599D+00            1.0000000
  1  1  1  1  1
      0.15100D+00            1.0000000
  1  2  2  6  1
      0.18135D+03            0.36674D-02
      0.53991D+02            0.28508D-01
      0.20245D+02            0.11913D+00
      0.82422D+01            0.30788D+00
      0.35016D+01            0.47688D+00
      0.14393D+01            0.50000D+00
  1  2  2  1  1
      0.55085D+00            1.0000000
  1  2  2  1  1
      0.18576D+00            1.0000000
  1  3  3  1  1
      4.729000D+00           1.0000000
  1  3  3  1  1
      1.051000D+00           1.0000000
  1  4  4  1  1
      2.396000D+00           1.0000000
# ZINC (16s,11p,8d,2f,1g) -> [6s,4p,3d,2f,1g]
Zn pc-2
  12
  1  0  0  14  4
      0.11901D+07            0.78957D-04           -0.15455D-04            0.52315D-05            0.28706D-05
      0.17830D+06            0.61326D-03           -0.12032D-03            0.40862D-04            0.22392D-04
      0.40577D+05            0.32150D-02           -0.63030D-03            0.21310D-03            0.11700D-03
      0.11491D+05            0.13405D-01           -0.26543D-02            0.90371D-03            0.49498D-03
      0.37475D+04            0.47032D-01           -0.94387D-02            0.31951D-02            0.17561D-02
      0.13515D+04            0.13828D+00           -0.29263D-01            0.10065D-01            0.55131D-02
      0.52524D+03            0.32149D+00           -0.75509D-01            0.25993D-01            0.14338D-01
      0.21622D+03            0.50000D+00           -0.15165D+00            0.54902D-01            0.30175D-01
      0.91996D+02            0.37895D+00           -0.16501D+00            0.61763D-01            0.34726D-01
      0.34364D+02            0.63734D-01            0.15296D+00           -0.67319D-01           -0.39583D-01
      0.16409D+02           -0.12787D-01            0.50000D+00           -0.33433D+00           -0.19514D+00
      0.76823D+01            0.48346D-02            0.27914D+00           -0.18676D+00           -0.12320D+00
      0.28091D+01           -0.15628D-02            0.16796D-01            0.50000D+00            0.40501D+00
      0.10969D+01            0.53066D-03           -0.19523D-02            0.40944D+00            0.50000D+00
  1  0  0  1  1
      0.18046D+00            1.0000000
  1  0  0  1  1
      0.59809D-01            1.0000000
  1  1  1  9  2
      0.46734D+04            0.86176D-03           -0.25182D-03
      0.11081D+04            0.73635D-02           -0.21767D-02
      0.35774D+03            0.39130D-01           -0.11655D-01
      0.13498D+03            0.14135D+00           -0.43758D-01
      0.56181D+02            0.34500D+00           -0.11224D+00
      0.24737D+02            0.50000D+00           -0.17516D+00
      0.11156D+02            0.32879D+00           -0.47670D-01
      0.47453D+01            0.51984D-01            0.35560D+00
      0.19641D+01           -0.24665D-02            0.50000D+00
  1  1  1  1  1
      0.75326D+00            1.0000000
  1  1  1  1  1
      0.16400D+00            1.0000000
  1  2  2  6  1
      0.19735D+03            0.37017D-02
      0.58790D+02            0.28918D-01
      0.22083D+02            0.12096D+00
      0.90194D+01            0.31146D+00
      0.38374D+01            0.47966D+00
      0.15784D+01            0.50000D+00
  1  2  2  1  1
      0.60396D+00            1.0000000
  1  2  2  1  1
      0.20327D+00            1.0000000
  1  3  3  1  1
      5.201000D+00           1.0000000
  1  3  3  1  1
      1.156000D+00           1.0000000
  1  4  4  1  1
      2.635000D+00           1.0000000
#
#  pc-3  EMSL  Basis Set Exchange Library  1/23/17 10:30 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
# K Ca Ga Ge As Se Br Kr: Frank Jensen, Polarization Consistent Basis Sets. VII. The Elements K, Ca, Ga, Ge, As, Se, Br and Kr, J. Chem. Phys. 136, 094110 (2012).
# Sc Ti V Cr Mn Fe Co Ni Cu Zn: Frank Jensen, Polarization Consistent Basis Sets. VIII. The Transition Metals Sc-Zn, J. Chem. Phys. 138, 014107 (2013).
#
# HYDROGEN
H  pc-3
 12
  1  0  0  5  1
        774.69000000          0.00131630
        116.16000000          0.01022600
         26.44900000          0.05362900
          7.50150000          0.22285000
          2.45680000          0.75374000
  1  0  0  1  1
          0.88774000          1.00000000
  1  0  0  1  1
          0.34085000          1.00000000
  1  0  0  1  1
          0.13477000          1.00000000
  1  0  0  1  1
          0.05226300          1.00000000
  1  1  1  1  1
          6.50000000          1.00000000
  1  1  1  1  1
          1.55000000          1.00000000
  1  1  1  1  1
          0.55000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          1.95000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          2.20000000          1.00000000
# HELIUM
He pc-3
 12
  1  0  0  5  1
       2167.40000000          0.00084153
        324.99000000          0.00652740
         73.99400000          0.03399500
         20.97500000          0.13811000
          6.84520000          0.44195000
  1  0  0  1  1
          2.43940000          1.00000000
  1  0  0  1  1
          0.90251000          1.00000000
  1  0  0  1  1
          0.33313000          1.00000000
  1  0  0  1  1
          0.12413000          1.00000000
  1  1  1  1  1
         10.70000000          1.00000000
  1  1  1  1  1
          2.55000000          1.00000000
  1  1  1  1  1
          0.90000000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.07000000          1.00000000
  1  3  3  1  1
          3.20000000          1.00000000
# LITHIUM
Li pc-3
 11
  1  0  0 10  2
      13018.00000000          0.00005145          0.00000000
       1950.10000000          0.00039716          0.00000153
        443.84000000          0.00210140         -0.00000310
        125.76000000          0.00864300          0.00005703
         41.09400000          0.03057700         -0.00003847
         14.88200000          0.08539700          0.00143160
          5.80750000          0.19415000          0.00164970
          2.38910000          0.28592000          0.02368500
          1.01840000          0.30530000          0.02024700
          0.44404000          0.00000000          0.10064000
  1  0  0  1  1
          0.19405000          1.00000000
  1  0  0  1  1
          0.08403900          1.00000000
  1  0  0  1  1
          0.03792100          1.00000000
  1  0  0  1  1
          0.01664000          1.00000000
  1  1  1  4  1
         15.40000000          0.00102953
          3.59000000          0.00833218
          1.09000000          0.02929890
          0.35000000          0.11954800
  1  1  1  1  1
          0.13000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
# BERYLLIUM
Be pc-3
 11
  1  0  0 10  2
      26673.00000000          0.00002197          0.00000000
       3996.30000000          0.00016954          0.00000493
        909.67000000          0.00089757         -0.00000913
        257.77000000          0.00369380          0.00019440
         84.23400000          0.01314100          0.00000956
         30.54500000          0.03717900          0.00570280
         12.02000000          0.08599900          0.01234400
          5.04950000          0.13048000          0.10403000
          2.17190000          0.13871000          0.18882000
          0.93410000          0.00000000          0.42111000
  1  0  0  1  1
          0.38918000          1.00000000
  1  0  0  1  1
          0.17402000          1.00000000
  1  0  0  1  1
          0.07602800          1.00000000
  1  0  0  1  1
          0.03226500          1.00000000
  1  1  1  4  1
         27.80000000          0.00146992
          6.46000000          0.01290300
          1.96000000          0.04633670
          0.63000000          0.18363000
  1  1  1  1  1
          0.24000000          1.00000000
  1  1  1  1  1
          0.09000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
# BORON
B  pc-3
 17
  1  0  0 10  2
      57415.00000000          0.00002984          0.00000000
       8601.50000000          0.00023044          0.00000428
       1957.80000000          0.00121950         -0.00000707
        554.61000000          0.00504630          0.00017669
        181.05000000          0.01812300          0.00013538
         65.49100000          0.05331800          0.00601230
         25.59900000          0.13277000          0.01984700
         10.53200000          0.23069000          0.14467000
          4.44650000          0.25545000          0.39360000
          1.88320000          0.00000000          0.80698000
  1  0  0  1  1
          0.69831000          1.00000000
  1  0  0  1  1
          0.34310000          1.00000000
  1  0  0  1  1
          0.14276000          1.00000000
  1  0  0  1  1
          0.05815700          1.00000000
  1  1  1  5  1
         90.11100000          0.00055817
         21.16500000          0.00455240
          6.56180000          0.02231300
          2.56460000          0.05947100
          1.05100000          0.16256000
  1  1  1  1  1
          0.45193000          1.00000000
  1  1  1  1  1
          0.19468000          1.00000000
  1  1  1  1  1
          0.08321200          1.00000000
  1  1  1  1  1
          0.03329700          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.52000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
# CARBON
C  pc-3
 17
  1  0  0 10  2
      87141.00000000          0.00002818          0.00000000
      13052.00000000          0.00021819          0.00000259
       2970.60000000          0.00115110         -0.00000309
        841.46000000          0.00478590          0.00012247
        274.59000000          0.01713400          0.00025494
         99.21500000          0.05112000          0.00512540
         38.69400000          0.12805000          0.02195500
         15.91100000          0.22773000          0.14112000
          6.76680000          0.24758000          0.41303000
          2.89840000          0.00000000          0.82714000
  1  0  0  1  1
          1.12460000          1.00000000
  1  0  0  1  1
          0.51446000          1.00000000
  1  0  0  1  1
          0.21176000          1.00000000
  1  0  0  1  1
          0.08501700          1.00000000
  1  1  1  5  1
        148.24000000          0.00050756
         34.91200000          0.00421260
         10.89400000          0.02133500
          4.19340000          0.06232900
          1.71340000          0.16642000
  1  1  1  1  1
          0.73566000          1.00000000
  1  1  1  1  1
          0.31637000          1.00000000
  1  1  1  1  1
          0.13242000          1.00000000
  1  1  1  1  1
          0.05190100          1.00000000
  1  2  2  1  1
          5.20000000          1.00000000
  1  2  2  1  1
          1.35000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.65000000          1.00000000
  1  4  4  1  1
          1.40000000          1.00000000
# NITROGEN
N  pc-3
 17
  1  0  0 10  2
     124550.00000000          0.00002667          0.00000000
      18656.00000000          0.00020684          0.00000141
       4245.10000000          0.00108930          0.00000000
       1202.10000000          0.00454630          0.00008144
        392.14000000          0.01623700          0.00032439
        141.58000000          0.04895700          0.00436210
         55.13600000          0.12317000          0.02283800
         22.64300000          0.22425000          0.13462000
          9.65660000          0.23876000          0.42501000
          4.16850000          0.00000000          0.82517000
  1  0  0  1  1
          1.66780000          1.00000000
  1  0  0  1  1
          0.74574000          1.00000000
  1  0  0  1  1
          0.30516000          1.00000000
  1  0  0  1  1
          0.12089000          1.00000000
  1  1  1  5  1
        218.29000000          0.00048281
         51.48800000          0.00404200
         16.13000000          0.02094600
          6.13070000          0.06475700
          2.50520000          0.17042000
  1  1  1  1  1
          1.07300000          1.00000000
  1  1  1  1  1
          0.45838000          1.00000000
  1  1  1  1  1
          0.18948000          1.00000000
  1  1  1  1  1
          0.07335900          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          1.65000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          1.80000000          1.00000000
  1  3  3  1  1
          0.77000000          1.00000000
  1  4  4  1  1
          1.50000000          1.00000000
# OXYGEN
O  pc-3
 17
  1  0  0 10  2
     164030.00000000          0.00002652          0.00000000
      24567.00000000          0.00020571          0.00000133
       5591.00000000          0.00108270          0.00000000
       1583.60000000          0.00451900          0.00008025
        516.67000000          0.01613500          0.00034512
        186.56000000          0.04871600          0.00444840
         72.69600000          0.12268000          0.02360100
         29.99200000          0.22189000          0.13861000
         12.89900000          0.23904000          0.42872000
          5.61350000          0.00000000          0.84873000
  1  0  0  1  1
          2.29860000          1.00000000
  1  0  0  1  1
          0.99980000          1.00000000
  1  0  0  1  1
          0.40746000          1.00000000
  1  0  0  1  1
          0.15922000          1.00000000
  1  1  1  5  1
        272.02000000          0.00054941
         64.24300000          0.00458340
         20.24900000          0.02357300
          7.64380000          0.07433800
          3.12320000          0.18755000
  1  1  1  1  1
          1.32510000          1.00000000
  1  1  1  1  1
          0.55551000          1.00000000
  1  1  1  1  1
          0.22229000          1.00000000
  1  1  1  1  1
          0.08401000          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          1.60000000          1.00000000
# FLUORINE
F  pc-3
 17
  1  0  0 10  2
     215660.00000000          0.00002538          0.00000000
      32299.00000000          0.00019693          0.00000102
       7350.40000000          0.00103600          0.00000000
       2081.80000000          0.00432940          0.00006810
        679.09000000          0.01546200          0.00034620
        245.10000000          0.04690300          0.00413970
         95.46200000          0.11881000          0.02307300
         39.42200000          0.21711000          0.13395000
         17.01800000          0.23699000          0.42246000
          7.45250000          0.00000000          0.85999000
  1  0  0  1  1
          3.13290000          1.00000000
  1  0  0  1  1
          1.33950000          1.00000000
  1  0  0  1  1
          0.54218000          1.00000000
  1  0  0  1  1
          0.20904000          1.00000000
  1  1  1  5  1
        351.22000000          0.00055263
         82.97800000          0.00462850
         26.26700000          0.02380200
          9.93070000          0.07626200
          4.06700000          0.18964000
  1  1  1  1  1
          1.72460000          1.00000000
  1  1  1  1  1
          0.71976000          1.00000000
  1  1  1  1  1
          0.28624000          1.00000000
  1  1  1  1  1
          0.10789000          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.05000000          1.00000000
  1  4  4  1  1
          1.70000000          1.00000000
# NEON
Ne pc-3
 17
  1  0  0 10  2
     270660.00000000          0.00001247          0.00000000
      40541.00000000          0.00009678          0.00000000
       9226.50000000          0.00050863          0.00000065
       2613.20000000          0.00212860          0.00002741
        852.39000000          0.00759220          0.00018661
        307.61000000          0.02311600          0.00194920
        119.76000000          0.05861400          0.01177300
         49.43700000          0.10807000          0.06614600
         21.36900000          0.11660000          0.21457000
          9.39210000          0.00000000          0.42987000
  1  0  0  1  1
          3.98320000          1.00000000
  1  0  0  1  1
          1.68870000          1.00000000
  1  0  0  1  1
          0.68030000          1.00000000
  1  0  0  1  1
          0.26024000          1.00000000
  1  1  1  5  1
        443.45000000          0.00274680
        104.82000000          0.02308100
         33.25500000          0.11930000
         12.54800000          0.38863000
          5.14210000          0.95790000
  1  1  1  1  1
          2.17830000          1.00000000
  1  1  1  1  1
          0.90645000          1.00000000
  1  1  1  1  1
          0.35994000          1.00000000
  1  1  1  1  1
          0.13515000          1.00000000
  1  2  2  1  1
         10.00000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.15000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  3  3  1  1
          2.80000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
# SODIUM
Na pc-3
 11
  1  0  0 14  3
     421840.00000000          0.00001821          0.00000000          0.00000000
      63188.00000000          0.00014153          0.00000000          0.00000000
      14381.00000000          0.00074380          0.00000000          0.00000000
       4073.70000000          0.00312730         -0.00000659          0.00000000
       1329.10000000          0.01124900         -0.00001064         -0.00000126
        479.99000000          0.03529200         -0.00026565         -0.00001103
        187.36000000          0.09539000         -0.00112860         -0.00007692
         77.77000000          0.21001000         -0.00804960         -0.00043274
         33.79900000          0.34417000         -0.02603700         -0.00169970
         15.12700000          0.32701000         -0.07062200         -0.00435420
          6.93200000          0.12122000         -0.01221700         -0.00178400
          2.76510000          0.00644090          0.26047000          0.02523700
          1.13970000          0.00000000          0.35925000          0.07668600
          0.45213000          0.00000000          0.00000000          0.11132000
  1  0  0  1  1
          0.08260300          1.00000000
  1  0  0  1  1
          0.04151000          1.00000000
  1  0  0  1  1
          0.01861800          1.00000000
  1  1  1  9  1
       1156.80000000          0.00015835
        274.42000000          0.00137160
         89.13900000          0.00740860
         33.25900000          0.03121400
         13.55700000          0.09092000
          5.96240000          0.20137000
          2.68240000          0.30732000
          1.19710000          0.33347000
          0.51789000          0.22947000
  1  1  1  1  1
          0.21331000          1.00000000
  1  1  1  1  1
          0.10000000          1.00000000
  1  1  1  1  1
          0.03700000          1.00000000
  1  2  2  1  1
          0.91000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          0.27000000          1.00000000
# MAGNESIUM
Mg pc-3
 11
  1  0  0 14  3
     564790.00000000          0.00000788          0.00000000          0.00000000
      84589.00000000          0.00006122          0.00000000          0.00000000
      19251.00000000          0.00032179          0.00000000          0.00000000
       5452.80000000          0.00135380         -0.00000299          0.00000000
       1779.10000000          0.00487800         -0.00000639          0.00000380
        642.58000000          0.01537600         -0.00013096          0.00003105
        250.92000000          0.04208100         -0.00060781          0.00022284
        104.19000000          0.09518700         -0.00421360          0.00120920
         45.27500000          0.16414000         -0.01490900          0.00476660
         20.31800000          0.17119000         -0.04186800          0.01026900
          9.33190000          0.07662600         -0.02166700          0.00471000
          3.69780000          0.00637870          0.14599000         -0.01339800
          1.57250000          0.00000000          0.20166000          0.23482000
          0.64949000          0.00000000          0.00000000          0.48791000
  1  0  0  1  1
          0.15901000          1.00000000
  1  0  0  1  1
          0.07166500          1.00000000
  1  0  0  1  1
          0.02994200          1.00000000
  1  1  1  9  1
       1516.90000000          0.00007161
        359.79000000          0.00062314
        116.76000000          0.00341360
         43.58000000          0.01453100
         17.92600000          0.04287000
          7.93560000          0.09778900
          3.60380000          0.15457000
          1.64410000          0.16828000
          0.74112000          0.11333000
  1  1  1  1  1
          0.31666000          1.00000000
  1  1  1  1  1
          0.14900000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          0.33000000          1.00000000
# ALUMINUM
Al pc-3
 15
  1  0  0 14  3
     721490.00000000          0.00001419          0.00000000          0.00000000
     108090.00000000          0.00011026          0.00000000          0.00000000
      24605.00000000          0.00057946          0.00000000          0.00000000
       6971.40000000          0.00243790         -0.00000493          0.00000000
       2274.90000000          0.00879450         -0.00000863         -0.00000016
        821.60000000          0.02782100         -0.00020373         -0.00000132
        320.78000000          0.07681600         -0.00091455         -0.00000982
        133.15000000          0.17710000         -0.00657840         -0.00006244
         57.81700000          0.31603000         -0.02395500         -0.00030825
         25.95400000          0.35108000         -0.07103100         -0.00125880
         11.89900000          0.17619000         -0.05045400         -0.00186120
          4.74990000          0.01826800          0.22311000          0.01120900
          2.06880000          0.00000000          0.34708000          0.08354100
          0.87779000          0.00000000          0.00000000          0.13466000
  1  0  0  1  1
          0.24951000          1.00000000
  1  0  0  1  1
          0.11462000          1.00000000
  1  0  0  1  1
          0.04819300          1.00000000
  1  1  1 10  2
       2019.70000000          0.00012156          0.00000000
        478.63000000          0.00106070          0.00005424
        155.02000000          0.00593650         -0.00003765
         57.90400000          0.02538200          0.00089364
         24.14000000          0.07618800         -0.00359030
         10.78900000          0.17997000         -0.00368970
          4.97300000          0.30275000         -0.05406900
          2.31610000          0.34478000         -0.03337300
          1.07910000          0.23763000          0.00454730
          0.49159000          0.00000000          0.87054000
  1  1  1  1  1
          0.20482000          1.00000000
  1  1  1  1  1
          0.07925600          1.00000000
  1  1  1  1  1
          0.02892800          1.00000000
  1  2  2  1  1
          5.60000000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.44000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  3  3  1  1
          0.96000000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  4  4  1  1
          0.58000000          1.00000000
# SILICON
Si pc-3
 15
  1  0  0 14  3
     877450.00000000          0.00001340          0.00000000          0.00000000
     131450.00000000          0.00010407          0.00000000          0.00000000
      29929.00000000          0.00054678          0.00000000          0.00000000
       8480.20000000          0.00230100         -0.00000422          0.00000000
       2767.20000000          0.00830540         -0.00000634         -0.00000118
        999.40000000          0.02632200         -0.00016910         -0.00001035
        390.14000000          0.07303300         -0.00073715         -0.00007432
        161.91000000          0.17010000         -0.00544610         -0.00043713
         70.30400000          0.30891000         -0.02001000         -0.00193740
         31.57900000          0.35473000         -0.06137300         -0.00585630
         14.48000000          0.18872000         -0.04900200         -0.00683610
          5.83830000          0.02195300          0.17627000          0.02787000
          2.59460000          0.00000000          0.30080000          0.12767000
          1.12500000          0.00000000          0.00000000          0.17422000
  1  0  0  1  1
          0.35356000          1.00000000
  1  0  0  1  1
          0.16160000          1.00000000
  1  0  0  1  1
          0.06726100          1.00000000
  1  1  1 10  2
       2303.10000000          0.00013105          0.00000000
        545.84000000          0.00114650          0.00000612
        177.05000000          0.00636520         -0.00000590
         66.37700000          0.02719700          0.00008645
         27.60100000          0.08192500         -0.00053049
         12.34300000          0.19147000         -0.00089038
          5.68940000          0.31583000         -0.00798250
          2.64060000          0.35183000         -0.00376310
          1.20940000          0.21292000          0.01078700
          0.52013000          0.00000000          0.18186000
  1  1  1  1  1
          0.23256000          1.00000000
  1  1  1  1  1
          0.09814100          1.00000000
  1  1  1  1  1
          0.03836000          1.00000000
  1  2  2  1  1
          6.66000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.38000000          1.00000000
  1  4  4  1  1
          0.65000000          1.00000000
# PHOSPHOROUS
P  pc-3
 15
  1  0  0 14  3
    1063700.00000000          0.00001251          0.00000000          0.00000000
     160000.00000000          0.00009667          0.00000000          0.00000000
      36513.00000000          0.00050682          0.00000000          0.00000000
      10359.00000000          0.00213100         -0.00000345          0.00000000
       3382.80000000          0.00769250         -0.00000534         -0.00000176
       1222.30000000          0.02442100         -0.00013814         -0.00001580
        477.30000000          0.06812200         -0.00060882         -0.00011353
        198.09000000          0.16069000         -0.00450640         -0.00067329
         85.99400000          0.29867000         -0.01707100         -0.00303140
         38.62700000          0.35878000         -0.05395400         -0.00922920
         17.68800000          0.20616000         -0.05149400         -0.01193600
          7.25510000          0.02738600          0.13758000          0.03572500
          3.26990000          0.00000000          0.27525000          0.15875000
          1.43130000          0.00000000          0.00000000          0.21236000
  1  0  0  1  1
          0.47047000          1.00000000
  1  0  0  1  1
          0.21289000          1.00000000
  1  0  0  1  1
          0.08774200          1.00000000
  1  1  1 10  2
       2762.20000000          0.00012618          0.00000000
        654.78000000          0.00110480          0.00000596
        212.58000000          0.00614830         -0.00000681
         79.89500000          0.02630700          0.00007451
         33.36600000          0.07986600         -0.00060664
         14.98600000          0.18840000         -0.00126040
          6.96800000          0.31362000         -0.00947190
          3.28180000          0.35326000         -0.00440140
          1.52470000          0.21366000          0.01246600
          0.66924000          0.00000000          0.21343000
  1  1  1  1  1
          0.29929000          1.00000000
  1  1  1  1  1
          0.12811000          1.00000000
  1  1  1  1  1
          0.05099200          1.00000000
  1  2  2  1  1
          7.71000000          1.00000000
  1  2  2  1  1
          2.03000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.22000000          1.00000000
  1  3  3  1  1
          1.34000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          0.72000000          1.00000000
# SULFUR
S  pc-3
 15
  1  0  0 14  3
    1250400.00000000          0.00001202          0.00000000          0.00000000
     188080.00000000          0.00009294          0.00000000          0.00000000
      42918.00000000          0.00048720          0.00000000          0.00000000
      12179.00000000          0.00204790         -0.00000304          0.00000000
       3978.70000000          0.00738970         -0.00000465         -0.00000231
       1438.10000000          0.02348100         -0.00012316         -0.00001956
        561.67000000          0.06568500         -0.00054723         -0.00014386
        233.11000000          0.15597000         -0.00407020         -0.00084419
        101.22000000          0.29322000         -0.01565200         -0.00386210
         45.49300000          0.36011000         -0.05030900         -0.01181300
         20.84700000          0.21506000         -0.05151700         -0.01611400
          8.64920000          0.03078200          0.11823000          0.04149200
          3.94560000          0.00000000          0.25628000          0.18517000
          1.74720000          0.00000000          0.00000000          0.23963000
  1  0  0  1  1
          0.59953000          1.00000000
  1  0  0  1  1
          0.27127000          1.00000000
  1  0  0  1  1
          0.11080000          1.00000000
  1  1  1 10  2
       3285.80000000          0.00012062          0.00000000
        778.93000000          0.00105870          0.00000424
        252.76000000          0.00591910         -0.00000743
         95.10000000          0.02540500          0.00002773
         39.82000000          0.07785900         -0.00065028
         17.92500000          0.18578000         -0.00189330
          8.36990000          0.31347000         -0.01019100
          3.96550000          0.35718000         -0.00762910
          1.85400000          0.21179000          0.02103200
          0.81971000          0.00000000          0.24347000
  1  1  1  1  1
          0.36117000          1.00000000
  1  1  1  1  1
          0.15097000          1.00000000
  1  1  1  1  1
          0.05962000          1.00000000
  1  2  2  1  1
          8.76000000          1.00000000
  1  2  2  1  1
          2.30000000          1.00000000
  1  2  2  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          1.53000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  4  4  1  1
          0.79000000          1.00000000
# CHLORINE
Cl pc-3
 15
  1  0  0 14  3
    1461100.00000000          0.00001153          0.00000000          0.00000000
     219590.00000000          0.00008923          0.00000000          0.00000000
      50085.00000000          0.00046811          0.00000000          0.00000000
      14206.00000000          0.00196920         -0.00000271          0.00000000
       4638.90000000          0.00711120         -0.00000432         -0.00000287
       1676.30000000          0.02262500         -0.00010907         -0.00002495
        654.51000000          0.06348800         -0.00048853         -0.00018272
        271.53000000          0.15173000         -0.00363270         -0.00108210
        117.87000000          0.28826000         -0.01414200         -0.00498460
         52.98400000          0.36113000         -0.04616700         -0.01541400
         24.29200000          0.22303000         -0.05010700         -0.02177400
         10.18400000          0.03403100          0.09999900          0.04888100
          4.69280000          0.00000000          0.23750000          0.21808000
          2.09740000          0.00000000          0.00000000          0.27412000
  1  0  0  1  1
          0.74867000          1.00000000
  1  0  0  1  1
          0.33613000          1.00000000
  1  0  0  1  1
          0.13573000          1.00000000
  1  1  1 10  2
       3845.70000000          0.00011653          0.00000000
        911.23000000          0.00102500          0.00000358
        295.64000000          0.00574810         -0.00000778
        111.40000000          0.02470000          0.00000677
         46.76700000          0.07626300         -0.00069394
         21.10600000          0.18343000         -0.00225630
          9.90580000          0.31219000         -0.01101800
          4.73470000          0.35836000         -0.00936630
          2.23640000          0.21176000          0.02517100
          1.00710000          0.00000000          0.25574000
  1  1  1  1  1
          0.44369000          1.00000000
  1  1  1  1  1
          0.18488000          1.00000000
  1  1  1  1  1
          0.07326800          1.00000000
  1  2  2  1  1
          9.81000000          1.00000000
  1  2  2  1  1
          2.58000000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  2  2  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          1.72000000          1.00000000
  1  3  3  1  1
          0.57000000          1.00000000
  1  4  4  1  1
          0.86000000          1.00000000
# ARGON
Ar pc-3
 15
  1  0  0 14  3
    1702200.00000000          0.00000551          0.00000000          0.00000000
     254910.00000000          0.00004283          0.00000000          0.00000000
      58011.00000000          0.00022523          0.00000000          0.00000000
      16431.00000000          0.00094887         -0.00000120          0.00000000
       5360.50000000          0.00343160         -0.00000200         -0.00000162
       1935.40000000          0.01093900         -0.00004943         -0.00001423
        755.09000000          0.03079100         -0.00022448         -0.00010427
        313.08000000          0.07398700         -0.00166520         -0.00062078
        135.88000000          0.14187000         -0.00657890         -0.00288130
         61.09200000          0.18089000         -0.02173400         -0.00902010
         28.02400000          0.11508000         -0.02485100         -0.01322600
         11.86000000          0.01857900          0.04358600          0.02632900
          5.51170000          0.00000000          0.11336000          0.12105000
          2.48220000          0.00000000          0.00000000          0.15170000
  1  0  0  1  1
          0.91761000          1.00000000
  1  0  0  1  1
          0.40703000          1.00000000
  1  0  0  1  1
          0.16238000          1.00000000
  1  1  1 10  2
       4415.50000000          0.00005728          0.00000000
       1046.30000000          0.00050427          0.00000148
        339.54000000          0.00283210         -0.00000423
        128.10000000          0.01218600         -0.00000694
         53.82300000          0.03792400         -0.00037331
         24.30700000          0.09176200         -0.00132140
         11.44000000          0.15656000         -0.00599320
          5.51320000          0.17875000         -0.00517140
          2.63310000          0.10447000          0.01411000
          1.21090000          0.00000000          0.13276000
  1  1  1  1  1
          0.53411000          1.00000000
  1  1  1  1  1
          0.22314000          1.00000000
  1  1  1  1  1
          0.08879200          1.00000000
  1  2  2  1  1
         10.86000000          1.00000000
  1  2  2  1  1
          2.86000000          1.00000000
  1  2  2  1  1
          0.84000000          1.00000000
  1  2  2  1  1
          0.31000000          1.00000000
  1  3  3  1  1
          1.91000000          1.00000000
  1  3  3  1  1
          0.63000000          1.00000000
  1  4  4  1  1
          0.93000000          1.00000000
# POTASSIUM
K pc-3
  13
  1  0  0  17  4
      0.20375D+07            0.13937D-04           -0.26709D-05            0.73357D-06            0.47565D-06
      0.30516D+06            0.10833D-03           -0.20797D-04            0.57006D-05            0.36958D-05
      0.69446D+05            0.56967D-03           -0.10915D-03            0.30007D-04            0.19458D-04
      0.19669D+05            0.24008D-02           -0.46210D-03            0.12656D-03            0.82050D-04
      0.64171D+04            0.86873D-02           -0.16722D-02            0.46045D-03            0.29861D-03
      0.23169D+04            0.27757D-01           -0.54266D-02            0.14868D-02            0.96393D-03
      0.90383D+03            0.78539D-01           -0.15659D-01            0.43333D-02            0.28116D-02
      0.37463D+03            0.19113D+00           -0.40718D-01            0.11232D-01            0.72877D-02
      0.16254D+03            0.37483D+00           -0.89695D-01            0.25362D-01            0.16490D-01
      0.73143D+02            0.50000D+00           -0.15484D+00            0.44231D-01            0.28807D-01
      0.33633D+02            0.34575D+00           -0.15303D+00            0.47799D-01            0.31383D-01
      0.14693D+02            0.64317D-01            0.93275D-01           -0.34983D-01           -0.23300D-01
      0.68519D+01           -0.46261D-02            0.50000D+00           -0.21458D+00           -0.14600D+00
      0.31130D+01            0.21093D-02            0.43049D+00           -0.29043D+00           -0.21031D+00
      0.12331D+01           -0.10650D-02            0.62772D-01            0.15465D+00            0.13017D+00
      0.59366D+00            0.61749D-03           -0.89269D-02            0.50000D+00            0.50000D+00
      0.25315D+00           -0.21718D-03            0.22975D-02            0.26264D+00            0.47675D+00
  1  0  0  1  1
      0.52505D-01            1.0000000
  1  0  0  1  1
      0.28667D-01            1.0000000
  1  0  0  1  1
      0.13996D-01            1.0000000
  1  1  1  11  2
      0.53498D+04            0.14109D-03           -0.35791D-04
      0.12676D+04            0.12460D-02           -0.31191D-03
      0.41113D+03            0.70398D-02           -0.17944D-02
      0.15534D+03            0.30381D-01           -0.76953D-02
      0.65684D+02            0.95324D-01           -0.24970D-01
      0.29799D+02            0.23597D+00           -0.62505D-01
      0.14136D+02            0.41435D+00           -0.11872D+00
      0.68802D+01            0.50000D+00           -0.14011D+00
      0.33254D+01            0.32581D+00           -0.60933D-01
      0.15655D+01            0.72058D-01            0.25777D+00
      0.71868D+00           -0.39845D-03            0.50000D+00
  1  1  1  1  1
      0.31751D+00            1.0000000
  1  1  1  1  1
      0.13289D+00            1.0000000
  1  1  1  1  1
      0.38000D-01            1.0000000
  1  2  2  3  1
      0.12570D+02            0.41832D-01
      0.34100D+01            0.19753D+00
      0.10520D+01            0.50000D+00
  1  2  2  1  1
      0.32100D+00            1.0000000
  1  2  2  1  1
      0.82800D-01            1.0000000
  1  2  2  1  1
      0.21200D-01            1.0000000
  1  3  3  1  1
      0.400000D+00           1.0000000
# CALCIUM
Ca pc-3
  13
  1  0  0  17  4
      0.23880D+07            0.13096D-04           -0.26269D-05            0.71253D-06            0.44310D-06
      0.35766D+06            0.10179D-03           -0.20446D-04            0.55335D-05            0.34426D-05
      0.81408D+05            0.53508D-03           -0.10733D-03            0.29143D-04            0.18120D-04
      0.23062D+05            0.22551D-02           -0.45403D-03            0.12277D-03            0.76397D-04
      0.75249D+04            0.81624D-02           -0.16447D-02            0.44734D-03            0.27809D-03
      0.27172D+04            0.26118D-01           -0.53362D-02            0.14432D-02            0.89844D-03
      0.10600D+04            0.74177D-01           -0.15459D-01            0.42259D-02            0.26275D-02
      0.43938D+03            0.18210D+00           -0.40358D-01            0.10987D-01            0.68486D-02
      0.19071D+03            0.36274D+00           -0.90038D-01            0.25148D-01            0.15662D-01
      0.85969D+02            0.50000D+00           -0.15816D+00            0.44541D-01            0.27923D-01
      0.39674D+02            0.36832D+00           -0.16839D+00            0.51875D-01            0.32529D-01
      0.17788D+02            0.79590D-01            0.61713D-01           -0.23919D-01           -0.14885D-01
      0.82730D+01           -0.36485D-02            0.50000D+00           -0.20796D+00           -0.13748D+00
      0.37864D+01            0.21449D-02            0.48037D+00           -0.31365D+00           -0.21782D+00
      0.15707D+01           -0.12210D-02            0.86373D-01            0.87319D-01            0.67258D-01
      0.79202D+00            0.75012D-03           -0.10643D-01            0.50000D+00            0.50000D+00
      0.35016D+00           -0.28452D-03            0.29663D-02            0.31216D+00            0.49117D+00
  1  0  0  1  1
      0.96206D-01            1.0000000
  1  0  0  1  1
      0.49698D-01            1.0000000
  1  0  0  1  1
      0.21840D-01            1.0000000
  1  1  1  11  2
      0.62417D+04            0.13190D-03           -0.35332D-04
      0.14786D+04            0.11667D-02           -0.30823D-03
      0.47955D+03            0.66117D-02           -0.17797D-02
      0.18148D+03            0.28556D-01           -0.76341D-02
      0.77017D+02            0.90262D-01           -0.24972D-01
      0.35045D+02            0.22623D+00           -0.63273D-01
      0.16721D+02            0.40369D+00           -0.12233D+00
      0.82145D+01            0.50000D+00           -0.14872D+00
      0.40200D+01            0.34119D+00           -0.75174D-01
      0.19362D+01            0.84115D-01            0.24257D+00
      0.91987D+00            0.79130D-03            0.50000D+00
  1  1  1  1  1
      0.42266D+00            1.0000000
  1  1  1  1  1
      0.18262D+00            1.0000000
  1  1  1  1  1
      0.52300D-01            1.0000000
  1  2  2  3  1
      0.20260D+02            0.33151D-01
      0.55900D+01            0.17577D+00
      0.17950D+01            0.50000D+00
  1  2  2  1  1
      0.59800D+00            1.0000000
  1  2  2  1  1
      0.17980D+00            1.0000000
  1  2  2  1  1
      0.51000D-01            1.0000000
  1  3  3  1  1
      0.500000D+00           1.0000000
# GALLIUM
Ga pc-3
  15
  1  0  0  17  4
      0.71894D+07            0.10482D-04           -0.19391D-05            0.60455D-06            0.34969D-06
      0.10768D+07            0.81504D-04           -0.15075D-04            0.46949D-05            0.27167D-05
      0.24504D+06            0.42848D-03           -0.79308D-04            0.24738D-04            0.14307D-04
      0.69419D+05            0.18075D-02           -0.33477D-03            0.10423D-03            0.60321D-04
      0.22645D+05            0.65561D-02           -0.12189D-02            0.38062D-03            0.22010D-03
      0.81746D+04            0.21097D-01           -0.39528D-02            0.12317D-02            0.71312D-03
      0.31884D+04            0.60705D-01           -0.11621D-01            0.36444D-02            0.21079D-02
      0.13215D+04            0.15368D+00           -0.30796D-01            0.96687D-02            0.56052D-02
      0.57481D+03            0.32343D+00           -0.71939D-01            0.23014D-01            0.13337D-01
      0.26075D+03            0.50000D+00           -0.13527D+00            0.44066D-01            0.25690D-01
      0.12213D+03            0.45386D+00           -0.17706D+00            0.61768D-01            0.36092D-01
      0.58439D+02            0.15770D+00           -0.32407D-01            0.10461D-01            0.64489D-02
      0.26599D+02            0.69506D-02            0.39087D+00           -0.18723D+00           -0.11516D+00
      0.12598D+02            0.39553D-03            0.50000D+00           -0.35766D+00           -0.22947D+00
      0.58757D+01           -0.32454D-03            0.13124D+00            0.13844D-01            0.95312D-02
      0.26792D+01            0.17452D-03           -0.14993D-02            0.50000D+00            0.44379D+00
      0.11596D+01           -0.71685D-04            0.12386D-02            0.34317D+00            0.50000D+00
  1  0  0  1  1
      0.33223D+00            1.0000000
  1  0  0  1  1
      0.15498D+00            1.0000000
  1  0  0  1  1
      0.61644D-01            1.0000000
  1  1  1  13  3
      0.17316D+05            0.11522D-03           -0.33313D-04           -0.26357D-04
      0.41001D+04            0.10212D-02           -0.29653D-03           -0.23412D-03
      0.13305D+04            0.58472D-02           -0.17007D-02           -0.13463D-02
      0.50616D+03            0.25431D-01           -0.74892D-02           -0.59213D-02
      0.21528D+03            0.84249D-01           -0.25261D-01           -0.20057D-01
      0.98046D+02            0.22065D+00           -0.68943D-01           -0.54813D-01
      0.46764D+02            0.41648D+00           -0.13782D+00           -0.11057D+00
      0.23101D+02            0.50000D+00           -0.17022D+00           -0.13644D+00
      0.11600D+02            0.31073D+00           -0.42146D-01           -0.27731D-01
      0.57896D+01            0.65685D-01            0.29894D+00            0.28555D+00
      0.27426D+01            0.11263D-02            0.50000D+00            0.50000D+00
      0.12569D+01            0.24455D-03            0.33455D+00            0.35095D+00
      0.53460D+00           -0.10739D-03            0.63648D-01           -0.38396D+00
  1  1  1  1  1
      0.20974D+00            1.0000000
  1  1  1  1  1
      0.80136D-01            1.0000000
  1  1  1  1  1
      0.28970D-01            1.0000000
  1  2  2  8  1
      0.49859D+03            0.70367D-03
      0.15048D+03            0.62530D-02
      0.58756D+02            0.31266D-01
      0.25681D+02            0.10971D+00
      0.11682D+02            0.26741D+00
      0.55423D+01            0.43469D+00
      0.25987D+01            0.50000D+00
      0.11808D+01            0.43031D+00
  1  2  2  1  1
      0.51026D+00            1.0000000
  1  2  2  1  1
      0.20170D+00            1.0000000
  1  2  2  1  1
      0.81000D-01            1.0000000
  1  3  3  1  1
      1.160000D+00           1.0000000
  1  3  3  1  1
      0.290000D+00           1.0000000
  1  4  4  1  1
      0.440000D+00           1.0000000
# GERMANIUM
Ge pc-3
  15
  1  0  0  17  4
      0.80983D+07            0.99760D-05           -0.17830D-05            0.58141D-06            0.31229D-06
      0.12119D+07            0.77657D-04           -0.13875D-04            0.45189D-05            0.24280D-05
      0.27566D+06            0.40844D-03           -0.73046D-04            0.23833D-04            0.12800D-04
      0.78062D+05            0.17245D-02           -0.30847D-03            0.10043D-03            0.53970D-04
      0.25441D+05            0.62690D-02           -0.11260D-02            0.36780D-03            0.19751D-03
      0.91688D+04            0.20248D-01           -0.36617D-02            0.11930D-02            0.64134D-03
      0.35698D+04            0.58516D-01           -0.10810D-01            0.35457D-02            0.19046D-02
      0.14779D+04            0.14900D+00           -0.28729D-01            0.94270D-02            0.50744D-02
      0.64285D+03            0.31662D+00           -0.67550D-01            0.22592D-01            0.12159D-01
      0.29196D+03            0.50000D+00           -0.12847D+00            0.43673D-01            0.23640D-01
      0.13712D+03            0.47377D+00           -0.17428D+00            0.63382D-01            0.34407D-01
      0.66021D+02            0.18164D+00           -0.49665D-01            0.17747D-01            0.99751D-02
      0.29676D+02            0.11131D-01            0.36068D+00           -0.17826D+00           -0.10185D+00
      0.14128D+02           -0.35783D-03            0.50000D+00           -0.36760D+00           -0.21939D+00
      0.66970D+01            0.19697D-05            0.14780D+00           -0.22695D-01           -0.15453D-01
      0.30410D+01            0.28529D-04            0.67002D-03            0.50000D+00            0.41414D+00
      0.13326D+01           -0.16643D-04            0.10144D-02            0.37395D+00            0.50000D+00
  1  0  0  1  1
      0.41513D+00            1.0000000
  1  0  0  1  1
      0.19796D+00            1.0000000
  1  0  0  1  1
      0.78803D-01            1.0000000
  1  1  1  13  3
      0.18319D+05            0.11711D-03           -0.33791D-04            0.24689D-04
      0.43388D+04            0.10372D-02           -0.30095D-03            0.22016D-03
      0.14084D+04            0.59347D-02           -0.17228D-02            0.12595D-02
      0.53595D+03            0.25818D-01           -0.75999D-02            0.55678D-02
      0.22772D+03            0.85738D-01           -0.25674D-01            0.18829D-01
      0.10358D+03            0.22460D+00           -0.70265D-01            0.51815D-01
      0.49288D+02            0.42322D+00           -0.14007D+00            0.10378D+00
      0.24269D+02            0.50000D+00           -0.17028D+00            0.12714D+00
      0.12161D+02            0.29906D+00           -0.29699D-01            0.13392D-01
      0.60571D+01            0.58770D-01            0.31297D+00           -0.27682D+00
      0.28656D+01            0.79084D-03            0.50000D+00           -0.48239D+00
      0.13099D+01            0.20085D-03            0.31085D+00           -0.26654D+00
      0.52487D+00           -0.92061D-04            0.47309D-01            0.50000D+00
  1  1  1  1  1
      0.23379D+00            1.0000000
  1  1  1  1  1
      0.97666D-01            1.0000000
  1  1  1  1  1
      0.37811D-01            1.0000000
  1  2  2  8  1
      0.58327D+03            0.60303D-03
      0.17668D+03            0.53976D-02
      0.68981D+02            0.27819D-01
      0.30008D+02            0.10158D+00
      0.13692D+02            0.25222D+00
      0.65483D+01            0.42428D+00
      0.31090D+01            0.50000D+00
      0.14407D+01            0.42947D+00
  1  2  2  1  1
      0.63896D+00            1.0000000
  1  2  2  1  1
      0.26123D+00            1.0000000
  1  2  2  1  1
      0.10400D+00            1.0000000
  1  3  3  1  1
      1.280000D+00           1.0000000
  1  3  3  1  1
      0.320000D+00           1.0000000
  1  4  4  1  1
      0.480000D+00           1.0000000
# ARSENIC
As pc-3
  15
  1  0  0  17  4
      0.87002D+07            0.99875D-05           -0.17535D-05            0.58919D-06            0.30127D-06
      0.13028D+07            0.77655D-04           -0.13628D-04            0.45736D-05            0.23394D-05
      0.29658D+06            0.40800D-03           -0.71676D-04            0.24098D-04            0.12321D-04
      0.84061D+05            0.17199D-02           -0.30218D-03            0.10137D-03            0.51860D-04
      0.27444D+05            0.62331D-02           -0.10998D-02            0.37018D-03            0.18924D-03
      0.99138D+04            0.20073D-01           -0.35646D-02            0.11966D-02            0.61240D-03
      0.38689D+04            0.57888D-01           -0.10500D-01            0.35493D-02            0.18149D-02
      0.16055D+04            0.14729D+00           -0.27852D-01            0.94157D-02            0.48250D-02
      0.70023D+03            0.31360D+00           -0.65501D-01            0.22572D-01            0.11566D-01
      0.31895D+03            0.50000D+00           -0.12516D+00            0.43803D-01            0.22574D-01
      0.15028D+03            0.48511D+00           -0.17283D+00            0.64668D-01            0.33432D-01
      0.72646D+02            0.19669D+00           -0.59317D-01            0.22184D-01            0.11828D-01
      0.32554D+02            0.14072D-01            0.34200D+00           -0.17293D+00           -0.94214D-01
      0.15595D+02           -0.87185D-03            0.50000D+00           -0.37450D+00           -0.21323D+00
      0.74883D+01            0.23271D-03            0.16086D+00           -0.48591D-01           -0.31469D-01
      0.33900D+01           -0.75755D-04            0.26982D-02            0.50000D+00            0.39912D+00
      0.15049D+01            0.27301D-04            0.74798D-03            0.39590D+00            0.50000D+00
  1  0  0  1  1
      0.49276D+00            1.0000000
  1  0  0  1  1
      0.23872D+00            1.0000000
  1  0  0  1  1
      0.95580D-01            1.0000000
  1  1  1  13  3
      0.19946D+05            0.11287D-03           -0.32769D-04            0.21329D-04
      0.47248D+04            0.99972D-03           -0.29185D-03            0.19010D-03
      0.15337D+04            0.57281D-02           -0.16731D-02            0.10898D-02
      0.58368D+03            0.24966D-01           -0.73936D-02            0.48235D-02
      0.24800D+03            0.83380D-01           -0.25117D-01            0.16414D-01
      0.11276D+03            0.21995D+00           -0.69211D-01            0.45463D-01
      0.53681D+02            0.41819D+00           -0.13922D+00            0.91997D-01
      0.26456D+02            0.50000D+00           -0.17182D+00            0.11430D+00
      0.13277D+02            0.30440D+00           -0.34407D-01            0.15194D-01
      0.66252D+01            0.61692D-01            0.30702D+00           -0.24546D+00
      0.31521D+01            0.87519D-03            0.50000D+00           -0.43626D+00
      0.14546D+01            0.23722D-03            0.30878D+00           -0.23067D+00
      0.58259D+00           -0.11529D-03            0.45626D-01            0.50000D+00
  1  1  1  1  1
      0.27023D+00            1.0000000
  1  1  1  1  1
      0.11753D+00            1.0000000
  1  1  1  1  1
      0.47220D-01            1.0000000
  1  2  2  8  1
      0.61499D+03            0.63542D-03
      0.18619D+03            0.56957D-02
      0.72746D+02            0.29212D-01
      0.31780D+02            0.10528D+00
      0.14543D+02            0.26025D+00
      0.69559D+01            0.43163D+00
      0.33037D+01            0.50000D+00
      0.15343D+01            0.40597D+00
  1  2  2  1  1
      0.68172D+00            1.0000000
  1  2  2  1  1
      0.27389D+00            1.0000000
  1  2  2  1  1
      0.11000D+00            1.0000000
  1  3  3  1  1
      1.410000D+00           1.0000000
  1  3  3  1  1
      0.350000D+00           1.0000000
  1  4  4  1  1
      0.530000D+00           1.0000000
# SELENIUM
Se pc-3
  15
  1  0  0  17  4
      0.98520D+07            0.92597D-05           -0.16038D-05            0.56053D-06            0.27006D-06
      0.14754D+07            0.71979D-04           -0.12459D-04            0.43486D-05            0.20957D-05
      0.33589D+06            0.37831D-03           -0.65570D-04            0.22932D-04            0.11047D-04
      0.95154D+05            0.15965D-02           -0.27662D-03            0.96503D-04            0.46514D-04
      0.31046D+05            0.57935D-02           -0.10083D-02            0.35305D-03            0.17007D-03
      0.11207D+05            0.18698D-01           -0.32721D-02            0.11422D-02            0.55070D-03
      0.43699D+04            0.54135D-01           -0.96725D-02            0.34006D-02            0.16386D-02
      0.18114D+04            0.13886D+00           -0.25779D-01            0.90578D-02            0.43728D-02
      0.78912D+03            0.29976D+00           -0.61229D-01            0.21929D-01            0.10589D-01
      0.35908D+03            0.49106D+00           -0.11899D+00            0.43210D-01            0.20976D-01
      0.16904D+03            0.50000D+00           -0.17078D+00            0.66185D-01            0.32254D-01
      0.81666D+02            0.22239D+00           -0.75387D-01            0.29749D-01            0.14852D-01
      0.36108D+02            0.19329D-01            0.31422D+00           -0.16324D+00           -0.83805D-01
      0.17384D+02           -0.18743D-02            0.50000D+00           -0.38257D+00           -0.20556D+00
      0.84334D+01            0.68740D-03            0.17888D+00           -0.83256D-01           -0.50230D-01
      0.37904D+01           -0.28228D-03            0.54547D-02            0.50000D+00            0.37858D+00
      0.16991D+01            0.12122D-03            0.37009D-03            0.42336D+00            0.50000D+00
  1  0  0  1  1
      0.58236D+00            1.0000000
  1  0  0  1  1
      0.28424D+00            1.0000000
  1  0  0  1  1
      0.11374D+00            1.0000000
  1  1  1  13  3
      0.23660D+05            0.93854D-04           -0.27888D-04           -0.21006D-04
      0.55992D+04            0.83450D-03           -0.24843D-03           -0.18689D-03
      0.18162D+04            0.48033D-02           -0.14350D-02           -0.10815D-02
      0.69251D+03            0.20965D-01           -0.63236D-02           -0.47645D-02
      0.29534D+03            0.71115D-01           -0.21854D-01           -0.16525D-01
      0.13449D+03            0.19301D+00           -0.61524D-01           -0.46656D-01
      0.64336D+02            0.38320D+00           -0.12955D+00           -0.99101D-01
      0.31941D+02            0.50000D+00           -0.17590D+00           -0.13512D+00
      0.16126D+02            0.35399D+00           -0.79676D-01           -0.56051D-01
      0.81097D+01            0.93103D-01            0.24969D+00            0.23532D+00
      0.39104D+01            0.29434D-02            0.50000D+00            0.50000D+00
      0.18470D+01            0.40621D-03            0.36326D+00            0.36384D+00
      0.81737D+00           -0.22436D-03            0.74397D-01           -0.37730D+00
  1  1  1  1  1
      0.37000D+00            1.0000000
  1  1  1  1  1
      0.15277D+00            1.0000000
  1  1  1  1  1
      0.58996D-01            1.0000000
  1  2  2  8  1
      0.74511D+03            0.50094D-03
      0.22627D+03            0.45486D-02
      0.88192D+02            0.24374D-01
      0.38249D+02            0.92564D-01
      0.17596D+02            0.23484D+00
      0.85125D+01            0.41168D+00
      0.41102D+01            0.50000D+00
      0.19548D+01            0.42224D+00
  1  2  2  1  1
      0.89611D+00            1.0000000
  1  2  2  1  1
      0.37932D+00            1.0000000
  1  2  2  1  1
      0.15200D+00            1.0000000
  1  3  3  1  1
      1.550000D+00           1.0000000
  1  3  3  1  1
      0.390000D+00           1.0000000
  1  4  4  1  1
      0.580000D+00           1.0000000
# BROMINE
Br pc-3
  15
  1  0  0  17  4
      0.10707D+08            0.89026D-05           -0.15548D-05            0.55247D-06            0.25994D-06
      0.16020D+07            0.69287D-04           -0.12093D-04            0.42911D-05            0.20196D-05
      0.36452D+06            0.36432D-03           -0.63670D-04            0.22639D-04            0.10651D-04
      0.10325D+06            0.15377D-02           -0.26862D-03            0.95275D-04            0.44847D-04
      0.33687D+05            0.55794D-02           -0.97912D-03            0.34854D-03            0.16396D-03
      0.12161D+05            0.18015D-01           -0.31777D-02            0.11277D-02            0.53101D-03
      0.47418D+04            0.52218D-01           -0.94023D-02            0.33607D-02            0.15814D-02
      0.19656D+04            0.13421D+00           -0.25085D-01            0.89597D-02            0.42244D-02
      0.85664D+03            0.29097D+00           -0.59732D-01            0.21744D-01            0.10254D-01
      0.39000D+03            0.48147D+00           -0.11682D+00            0.43106D-01            0.20439D-01
      0.18371D+03            0.50000D+00           -0.17012D+00            0.66937D-01            0.31863D-01
      0.88786D+02            0.23127D+00           -0.82344D-01            0.33187D-01            0.16180D-01
      0.39182D+02            0.21773D-01            0.30102D+00           -0.15833D+00           -0.79531D-01
      0.18952D+02           -0.23185D-02            0.50000D+00           -0.38589D+00           -0.20291D+00
      0.92567D+01            0.89252D-03            0.18933D+00           -0.10130D+00           -0.60127D-01
      0.41452D+01           -0.37530D-03            0.72305D-02            0.50000D+00            0.37582D+00
      0.18755D+01            0.16629D-03            0.89733D-04            0.43477D+00            0.50000D+00
  1  0  0  1  1
      0.65038D+00            1.0000000
  1  0  0  1  1
      0.32073D+00            1.0000000
  1  0  0  1  1
      0.13005D+00            1.0000000
  1  1  1  13  3
      0.25337D+05            0.92564D-04           -0.27515D-04           -0.20311D-04
      0.60012D+04            0.82209D-03           -0.24492D-03           -0.18066D-03
      0.19476D+04            0.47303D-02           -0.14138D-02           -0.10443D-02
      0.74295D+03            0.20661D-01           -0.62370D-02           -0.46082D-02
      0.31679D+03            0.70328D-01           -0.21622D-01           -0.16026D-01
      0.14424D+03            0.19149D+00           -0.61104D-01           -0.45458D-01
      0.69004D+02            0.38191D+00           -0.12921D+00           -0.96940D-01
      0.34271D+02            0.50000D+00           -0.17635D+00           -0.13309D+00
      0.17322D+02            0.35510D+00           -0.80112D-01           -0.54787D-01
      0.87272D+01            0.93923D-01            0.24803D+00            0.23139D+00
      0.42222D+01            0.30254D-02            0.50000D+00            0.50000D+00
      0.20030D+01            0.40529D-03            0.35622D+00            0.34178D+00
      0.87968D+00           -0.22787D-03            0.68037D-01           -0.44475D+00
  1  1  1  1  1
      0.40713D+00            1.0000000
  1  1  1  1  1
      0.17139D+00            1.0000000
  1  1  1  1  1
      0.67851D-01            1.0000000
  1  2  2  8  1
      0.80710D+03            0.49253D-03
      0.24520D+03            0.44893D-02
      0.95574D+02            0.24177D-01
      0.41515D+02            0.92054D-01
      0.19147D+02            0.23453D+00
      0.92814D+01            0.41231D+00
      0.44951D+01            0.50000D+00
      0.21495D+01            0.40986D+00
  1  2  2  1  1
      0.99179D+00            1.0000000
  1  2  2  1  1
      0.41734D+00            1.0000000
  1  2  2  1  1
      0.16700D+00            1.0000000
  1  3  3  1  1
      1.700000D+00           1.0000000
  1  3  3  1  1
      0.430000D+00           1.0000000
  1  4  4  1  1
      0.640000D+00           1.0000000
# KRYPTON
Kr pc-3
  15
  1  0  0  17  4
      0.11581D+08            0.85888D-05           -0.15126D-05            0.54637D-06            0.25063D-06
      0.17342D+07            0.66791D-04           -0.11755D-04            0.42403D-05            0.19455D-05
      0.39466D+06            0.35120D-03           -0.61894D-04            0.22371D-04            0.10261D-04
      0.11179D+06            0.14824D-02           -0.26113D-03            0.94151D-04            0.43204D-04
      0.36470D+05            0.53806D-02           -0.95213D-03            0.34454D-03            0.15802D-03
      0.13166D+05            0.17373D-01           -0.30895D-02            0.11145D-02            0.51159D-03
      0.51355D+04            0.50373D-01           -0.91412D-02            0.33212D-02            0.15237D-02
      0.21298D+04            0.12970D+00           -0.24408D-01            0.88610D-02            0.40727D-02
      0.92866D+03            0.28240D+00           -0.58266D-01            0.21555D-01            0.99113D-02
      0.42301D+03            0.47197D+00           -0.11469D+00            0.42996D-01            0.19874D-01
      0.19935D+03            0.50000D+00           -0.16945D+00            0.67669D-01            0.31422D-01
      0.96325D+02            0.24026D+00           -0.89186D-01            0.36680D-01            0.17409D-01
      0.42451D+02            0.24296D-01            0.28769D+00           -0.15319D+00           -0.75092D-01
      0.20626D+02           -0.27356D-02            0.50000D+00           -0.38895D+00           -0.19989D+00
      0.10130D+02            0.10813D-02            0.20022D+00           -0.12002D+00           -0.69511D-01
      0.45234D+01           -0.45973D-03            0.90589D-02            0.50000D+00            0.37128D+00
      0.20635D+01            0.20827D-03           -0.18586D-03            0.44661D+00            0.50000D+00
  1  0  0  1  1
      0.72508D+00            1.0000000
  1  0  0  1  1
      0.35825D+00            1.0000000
  1  0  0  1  1
      0.14646D+00            1.0000000
  1  1  1  13  3
      0.27327D+05            0.90094D-04           -0.26865D-04           -0.19559D-04
      0.64694D+04            0.80081D-03           -0.23934D-03           -0.17412D-03
      0.20991D+04            0.46134D-02           -0.13831D-02           -0.10076D-02
      0.80082D+03            0.20172D-01           -0.61083D-02           -0.44512D-02
      0.34153D+03            0.68894D-01           -0.21244D-01           -0.15533D-01
      0.15555D+03            0.18836D+00           -0.60285D-01           -0.44246D-01
      0.74469D+02            0.37826D+00           -0.12835D+00           -0.95044D-01
      0.37022D+02            0.50000D+00           -0.17719D+00           -0.13204D+00
      0.18741D+02            0.36013D+00           -0.84021D-01           -0.57015D-01
      0.94685D+01            0.97661D-01            0.24184D+00            0.22516D+00
      0.46022D+01            0.34200D-02            0.50000D+00            0.50000D+00
      0.21964D+01            0.40170D-03            0.35521D+00            0.33291D+00
      0.96661D+00           -0.23063D-03            0.66063D-01           -0.47942D+00
  1  1  1  1  1
      0.45189D+00            1.0000000
  1  1  1  1  1
      0.19315D+00            1.0000000
  1  1  1  1  1
      0.77913D-01            1.0000000
  1  2  2  8  1
      0.10220D+04            0.36153D-03
      0.31079D+03            0.33764D-02
      0.12034D+03            0.19214D-01
      0.52104D+02            0.76214D-01
      0.24487D+02            0.19895D+00
      0.12115D+02            0.37981D+00
      0.60408D+01            0.50000D+00
      0.29982D+01            0.46194D+00
  1  2  2  1  1
      0.14391D+01            1.0000000
  1  2  2  1  1
      0.64266D+00            1.0000000
  1  2  2  1  1
      0.25700D+00            1.0000000
  1  3  3  1  1
      1.870000D+00           1.0000000
  1  3  3  1  1
      0.470000D+00           1.0000000
  1  4  4  1  1
      0.700000D+00           1.0000000
# SCANDIUM (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Sc pc-3
  18
  1  0  0  17  4
      0.27455D+07            0.12517D-04           -0.25347D-05            0.69133D-06            0.41859D-06
      0.41107D+06            0.97346D-04           -0.19733D-04            0.53706D-05            0.32525D-05
      0.93538D+05            0.51188D-03           -0.10366D-03            0.28302D-04            0.17135D-04
      0.26494D+05            0.21582D-02           -0.43842D-03            0.11922D-03            0.72212D-04
      0.86429D+04            0.78166D-02           -0.15901D-02            0.43484D-03            0.26325D-03
      0.31200D+04            0.25050D-01           -0.51606D-02            0.14037D-02            0.85046D-03
      0.12168D+04            0.71345D-01           -0.14997D-01            0.41216D-02            0.24959D-02
      0.50424D+03            0.17623D+00           -0.39269D-01            0.10751D-01            0.65217D-02
      0.21888D+03            0.35485D+00           -0.88405D-01            0.24818D-01            0.15058D-01
      0.98769D+02            0.50000D+00           -0.15718D+00            0.44523D-01            0.27150D-01
      0.45696D+02            0.38368D+00           -0.17507D+00            0.54093D-01            0.33096D-01
      0.20814D+02            0.91196D-01            0.41221D-01           -0.16904D-01           -0.10298D-01
      0.96374D+01           -0.25067D-02            0.49010D+00           -0.20400D+00           -0.13093D+00
      0.44339D+01            0.20047D-02            0.50000D+00           -0.32403D+00           -0.21961D+00
      0.18914D+01           -0.11623D-02            0.98542D-01            0.61096D-01            0.47213D-01
      0.94923D+00            0.69730D-03           -0.96862D-02            0.50000D+00            0.47489D+00
      0.41858D+00           -0.26904D-03            0.28597D-02            0.32822D+00            0.50000D+00
  1  0  0  1  1
      0.12270D+00            1.0000000
  1  0  0  1  1
      0.60831D-01            1.0000000
  1  0  0  1  1
      0.25511D-01            1.0000000
  1  1  1  11  2
      0.71514D+04            0.12540D-03           -0.34151D-04
      0.16940D+04            0.11101D-02           -0.29847D-03
      0.54947D+03            0.63048D-02           -0.17255D-02
      0.20820D+03            0.27255D-01           -0.74164D-02
      0.88510D+02            0.86873D-01           -0.24437D-01
      0.40306D+02            0.22017D+00           -0.62746D-01
      0.19265D+02            0.39850D+00           -0.12286D+00
      0.94952D+01            0.50000D+00           -0.15229D+00
      0.46718D+01            0.34663D+00           -0.78897D-01
      0.22688D+01            0.87853D-01            0.24027D+00
      0.10802D+01            0.13537D-02            0.50000D+00
  1  1  1  1  1
      0.49637D+00            1.0000000
  1  1  1  1  1
      0.21481D+00            1.0000000
  1  1  1  1  1
      0.61000D-01            1.0000000
  1  2  2  7  1
      0.11697D+03            0.14588D-02
      0.34321D+02            0.12168D-01
      0.12620D+02            0.55012D-01
      0.54037D+01            0.14240D+00
      0.24641D+01            0.30775D+00
      0.11323D+01            0.44818D+00
      0.51425D+00            0.50000D+00
  1  2  2  1  1
      0.22852D+00            1.0000000
  1  2  2  1  1
      0.98744D-01            1.0000000
  1  2  2  1  1
      0.39444D-01            1.0000000
  1  3  3  1  1
      3.971000D+00           1.0000000
  1  3  3  1  1
      1.103000D+00           1.0000000
  1  3  3  1  1
      0.306000D+00           1.0000000
  1  4  4  1  1
      2.647000D+00           1.0000000
  1  4  4  1  1
      0.588000D+00           1.0000000
  1  5  5  1  1
      1.341000D+00           1.0000000
# TITANIUM (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Ti pc-3
  18
  1  0  0  17  4
      0.30885D+07            0.12198D-04           -0.24381D-05            0.67821D-06            0.41319D-06
      0.46252D+06            0.94842D-04           -0.18973D-04            0.52671D-05            0.32097D-05
      0.10525D+06            0.49876D-03           -0.99701D-04            0.27761D-04            0.16911D-04
      0.29809D+05            0.21032D-02           -0.42159D-03            0.11695D-03            0.71277D-04
      0.97243D+04            0.76188D-02           -0.15299D-02            0.42664D-03            0.25987D-03
      0.35104D+04            0.24430D-01           -0.49643D-02            0.13776D-02            0.83985D-03
      0.13691D+04            0.69687D-01           -0.14453D-01            0.40502D-02            0.24677D-02
      0.56735D+03            0.17276D+00           -0.37910D-01            0.10591D-01            0.64647D-02
      0.24634D+03            0.35012D+00           -0.85823D-01            0.24565D-01            0.14996D-01
      0.11124D+03            0.50000D+00           -0.15382D+00            0.44482D-01            0.27300D-01
      0.51549D+02            0.39298D+00           -0.17566D+00            0.55281D-01            0.34032D-01
      0.23687D+02            0.98671D-01            0.29341D-01           -0.12967D-01           -0.78831D-02
      0.10950D+02           -0.16629D-02            0.47570D+00           -0.20224D+00           -0.13077D+00
      0.50563D+01            0.18672D-02            0.50000D+00           -0.32940D+00           -0.22462D+00
      0.21869D+01           -0.10767D-02            0.10196D+00            0.57702D-01            0.44961D-01
      0.10828D+01            0.63064D-03           -0.86467D-02            0.50000D+00            0.47848D+00
      0.47707D+00           -0.24586D-03            0.26746D-02            0.32435D+00            0.50000D+00
  1  0  0  1  1
      0.14167D+00            1.0000000
  1  0  0  1  1
      0.68055D-01            1.0000000
  1  0  0  1  1
      0.28083D-01            1.0000000
  1  1  1  11  2
      0.81077D+04            0.12019D-03           -0.33306D-04
      0.19205D+04            0.10648D-02           -0.29174D-03
      0.62280D+03            0.60625D-02           -0.16884D-02
      0.23617D+03            0.26238D-01           -0.72769D-02
      0.10049D+03            0.84330D-01           -0.24140D-01
      0.45753D+02            0.21593D+00           -0.62796D-01
      0.21873D+02            0.39570D+00           -0.12422D+00
      0.10798D+02            0.50000D+00           -0.15605D+00
      0.53329D+01            0.34885D+00           -0.80562D-01
      0.26045D+01            0.89267D-01            0.24257D+00
      0.12430D+01            0.16655D-02            0.50000D+00
  1  1  1  1  1
      0.57357D+00            1.0000000
  1  1  1  1  1
      0.24913D+00            1.0000000
  1  1  1  1  1
      0.71000D-01            1.0000000
  1  2  2  7  1
      0.17542D+03            0.86142D-03
      0.52202D+02            0.73079D-02
      0.20282D+02            0.32009D-01
      0.89689D+01            0.10046D+00
      0.39602D+01            0.24980D+00
      0.18269D+01            0.41424D+00
      0.83414D+00            0.50000D+00
  1  2  2  1  1
      0.36979D+00            1.0000000
  1  2  2  1  1
      0.15730D+00            1.0000000
  1  2  2  1  1
      0.61494D-01            1.0000000
  1  3  3  1  1
      4.368000D+00           1.0000000
  1  3  3  1  1
      1.213000D+00           1.0000000
  1  3  3  1  1
      0.337000D+00           1.0000000
  1  4  4  1  1
      2.912000D+00           1.0000000
  1  4  4  1  1
      0.647000D+00           1.0000000
  1  5  5  1  1
      1.475000D+00           1.0000000
# VANADIUM (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
V pc-3
  18
  1  0  0  17  4
      0.34546D+07            0.11916D-04           -0.23533D-05            0.66812D-06            0.40372D-06
      0.51731D+06            0.92650D-04           -0.18311D-04            0.51890D-05            0.31363D-05
      0.11772D+06            0.48717D-03           -0.96232D-04            0.27346D-04            0.16522D-04
      0.33343D+05            0.20546D-02           -0.40683D-03            0.11521D-03            0.69643D-04
      0.10877D+05            0.74441D-02           -0.14771D-02            0.42036D-03            0.25397D-03
      0.39264D+04            0.23884D-01           -0.47928D-02            0.13578D-02            0.82105D-03
      0.15313D+04            0.68233D-01           -0.13977D-01            0.39968D-02            0.24154D-02
      0.63452D+03            0.16972D+00           -0.36721D-01            0.10475D-01            0.63420D-02
      0.27557D+03            0.34594D+00           -0.83546D-01            0.24397D-01            0.14773D-01
      0.12452D+03            0.50000D+00           -0.15080D+00            0.44555D-01            0.27120D-01
      0.57800D+02            0.40164D+00           -0.17608D+00            0.56465D-01            0.34484D-01
      0.26765D+02            0.10604D+00            0.18961D-01           -0.93784D-02           -0.56098D-02
      0.12352D+02           -0.76284D-03            0.46230D+00           -0.20086D+00           -0.12878D+00
      0.57251D+01            0.17201D-02            0.50000D+00           -0.33468D+00           -0.22615D+00
      0.25089D+01           -0.99147D-03            0.10567D+00            0.52380D-01            0.40738D-01
      0.12273D+01            0.56803D-03           -0.75960D-02            0.50000D+00            0.47053D+00
      0.53925D+00           -0.22430D-03            0.24862D-02            0.32603D+00            0.50000D+00
  1  0  0  1  1
      0.16398D+00            1.0000000
  1  0  0  1  1
      0.75963D-01            1.0000000
  1  0  0  1  1
      0.30570D-01            1.0000000
  1  1  1  11  2
      0.91030D+04            0.11621D-03           -0.32597D-04
      0.21558D+04            0.10302D-02           -0.28618D-03
      0.69916D+03            0.58744D-02           -0.16560D-02
      0.26537D+03            0.25441D-01           -0.71543D-02
      0.11299D+03            0.82348D-01           -0.23862D-01
      0.51446D+02            0.21262D+00           -0.62766D-01
      0.24598D+02            0.39384D+00           -0.12520D+00
      0.12157D+02            0.50000D+00           -0.15901D+00
      0.60245D+01            0.35011D+00           -0.81156D-01
      0.29557D+01            0.90081D-01            0.24438D+00
      0.14111D+01            0.19197D-02            0.50000D+00
  1  1  1  1  1
      0.65058D+00            1.0000000
  1  1  1  1  1
      0.28219D+00            1.0000000
  1  1  1  1  1
      0.81000D-01            1.0000000
  1  2  2  7  1
      0.20661D+03            0.81491D-03
      0.61670D+02            0.69690D-02
      0.24028D+02            0.31300D-01
      0.10576D+02            0.10153D+00
      0.46823D+01            0.25206D+00
      0.21713D+01            0.41796D+00
      0.99731D+00            0.50000D+00
  1  2  2  1  1
      0.44516D+00            1.0000000
  1  2  2  1  1
      0.18977D+00            1.0000000
  1  2  2  1  1
      0.73987D-01            1.0000000
  1  3  3  1  1
      4.804000D+00           1.0000000
  1  3  3  1  1
      1.335000D+00           1.0000000
  1  3  3  1  1
      0.371000D+00           1.0000000
  1  4  4  1  1
      3.203000D+00           1.0000000
  1  4  4  1  1
      0.712000D+00           1.0000000
  1  5  5  1  1
      1.623000D+00           1.0000000
# CHROMIUM (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Cr pc-3
  18
  1  0  0  17  4
      0.38062D+07            0.11791D-04           -0.23175D-05            0.66614D-06            0.40252D-06
      0.56978D+06            0.91708D-04           -0.18035D-04            0.51754D-05            0.31281D-05
      0.12968D+06            0.48204D-03           -0.94764D-04            0.27261D-04            0.16471D-04
      0.36746D+05            0.20312D-02           -0.40019D-03            0.11477D-03            0.69378D-04
      0.11992D+05            0.73583D-02           -0.14532D-02            0.41861D-03            0.25291D-03
      0.43299D+04            0.23607D-01           -0.47129D-02            0.13523D-02            0.81774D-03
      0.16892D+04            0.67459D-01           -0.13751D-01            0.39799D-02            0.24051D-02
      0.70025D+03            0.16804D+00           -0.36146D-01            0.10446D-01            0.63243D-02
      0.30430D+03            0.34353D+00           -0.82451D-01            0.24369D-01            0.14756D-01
      0.13763D+03            0.50000D+00           -0.14947D+00            0.44774D-01            0.27255D-01
      0.63984D+02            0.40692D+00           -0.17674D+00            0.57326D-01            0.35010D-01
      0.29776D+02            0.11078D+00            0.13033D-01           -0.72192D-02           -0.42702D-02
      0.13758D+02           -0.17026D-03            0.45486D+00           -0.20080D+00           -0.12875D+00
      0.64010D+01            0.16314D-02            0.50000D+00           -0.33833D+00           -0.22836D+00
      0.28345D+01           -0.93404D-03            0.10774D+00            0.52206D-01            0.40720D-01
      0.13701D+01            0.52354D-03           -0.66659D-02            0.50000D+00            0.46750D+00
      0.60066D+00           -0.20853D-03            0.22903D-02            0.32477D+00            0.50000D+00
  1  0  0  1  1
      0.18525D+00            1.0000000
  1  0  0  1  1
      0.83011D-01            1.0000000
  1  0  0  1  1
      0.32758D-01            1.0000000
  1  1  1  11  2
      0.10099D+05            0.11389D-03           -0.32241D-04
      0.23923D+04            0.10092D-02           -0.28341D-03
      0.77610D+03            0.57593D-02           -0.16387D-02
      0.29478D+03            0.24959D-01           -0.70972D-02
      0.12558D+03            0.81220D-01           -0.23759D-01
      0.57192D+02            0.21083D+00           -0.63007D-01
      0.27355D+02            0.39351D+00           -0.12634D+00
      0.13536D+02            0.50000D+00           -0.16146D+00
      0.67298D+01            0.34965D+00           -0.80464D-01
      0.33168D+01            0.89890D-01            0.24715D+00
      0.15834D+01            0.21226D-02            0.50000D+00
  1  1  1  1  1
      0.72906D+00            1.0000000
  1  1  1  1  1
      0.31575D+00            1.0000000
  1  1  1  1  1
      0.90000D-01            1.0000000
  1  2  2  7  1
      0.22930D+03            0.85079D-03
      0.68440D+02            0.73318D-02
      0.26605D+02            0.33370D-01
      0.11737D+02            0.10680D+00
      0.52469D+01            0.26150D+00
      0.24447D+01            0.42569D+00
      0.11263D+01            0.50000D+00
  1  2  2  1  1
      0.50320D+00            1.0000000
  1  2  2  1  1
      0.21363D+00            1.0000000
  1  2  2  1  1
      0.82645D-01            1.0000000
  1  3  3  1  1
      5.285000D+00           1.0000000
  1  3  3  1  1
      1.468000D+00           1.0000000
  1  3  3  1  1
      0.408000D+00           1.0000000
  1  4  4  1  1
      3.523000D+00           1.0000000
  1  4  4  1  1
      0.783000D+00           1.0000000
  1  5  5  1  1
      1.785000D+00           1.0000000
# MANGANESE (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Mn pc-3
  18
  1  0  0  17  4
      0.42472D+07            0.11432D-04           -0.22316D-05            0.64960D-06            0.39174D-06
      0.63549D+06            0.89014D-04           -0.17384D-04            0.50527D-05            0.30479D-05
      0.14446D+06            0.46879D-03           -0.91539D-04            0.26666D-04            0.16078D-04
      0.40876D+05            0.19792D-02           -0.38721D-03            0.11249D-03            0.67863D-04
      0.13327D+05            0.71761D-02           -0.14076D-02            0.41057D-03            0.24754D-03
      0.48077D+04            0.23079D-01           -0.45736D-02            0.13295D-02            0.80234D-03
      0.18728D+04            0.66162D-01           -0.13390D-01            0.39235D-02            0.23662D-02
      0.77555D+03            0.16537D+00           -0.35266D-01            0.10326D-01            0.62396D-02
      0.33684D+03            0.33998D+00           -0.80846D-01            0.24187D-01            0.14615D-01
      0.15231D+03            0.50000D+00           -0.14754D+00            0.44800D-01            0.27219D-01
      0.70843D+02            0.41386D+00           -0.17745D+00            0.58192D-01            0.35458D-01
      0.33105D+02            0.11674D+00            0.61164D-02           -0.46186D-02           -0.26360D-02
      0.15273D+02            0.56331D-03            0.44641D+00           -0.20008D+00           -0.12803D+00
      0.71247D+01            0.15186D-02            0.50000D+00           -0.34153D+00           -0.22966D+00
      0.31782D+01           -0.86991D-03            0.10989D+00            0.50744D-01            0.39216D-01
      0.15202D+01            0.47875D-03           -0.59685D-02            0.50000D+00            0.46437D+00
      0.66397D+00           -0.19132D-03            0.21431D-02            0.32445D+00            0.50000D+00
  1  0  0  1  1
      0.20535D+00            1.0000000
  1  0  0  1  1
      0.89815D-01            1.0000000
  1  0  0  1  1
      0.34836D-01            1.0000000
  1  1  1  11  2
      0.11175D+05            0.11115D-03           -0.31753D-04
      0.26488D+04            0.98407D-03           -0.27932D-03
      0.85951D+03            0.56239D-02           -0.16149D-02
      0.32660D+03            0.24402D-01           -0.70140D-02
      0.13915D+03            0.79878D-01           -0.23583D-01
      0.63355D+02            0.20872D+00           -0.63114D-01
      0.30289D+02            0.39299D+00           -0.12737D+00
      0.14988D+02            0.50000D+00           -0.16388D+00
      0.74675D+01            0.34902D+00           -0.79445D-01
      0.36886D+01            0.89348D-01            0.25039D+00
      0.17603D+01            0.21584D-02            0.50000D+00
  1  1  1  1  1
      0.80955D+00            1.0000000
  1  1  1  1  1
      0.34987D+00            1.0000000
  1  1  1  1  1
      0.10000D+00            1.0000000
  1  2  2  7  1
      0.26065D+03            0.83078D-03
      0.78074D+02            0.71829D-02
      0.30399D+02            0.33234D-01
      0.13402D+02            0.10779D+00
      0.60196D+01            0.26354D+00
      0.28178D+01            0.42856D+00
      0.13050D+01            0.50000D+00
  1  2  2  1  1
      0.58711D+00            1.0000000
  1  2  2  1  1
      0.25066D+00            1.0000000
  1  2  2  1  1
      0.97262D-01            1.0000000
  1  3  3  1  1
      5.813000D+00           1.0000000
  1  3  3  1  1
      1.615000D+00           1.0000000
  1  3  3  1  1
      0.449000D+00           1.0000000
  1  4  4  1  1
      3.876000D+00           1.0000000
  1  4  4  1  1
      0.861000D+00           1.0000000
  1  5  5  1  1
      1.964000D+00           1.0000000
# IRON (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Fe pc-3
  18
  1  0  0  17  4
      0.46579D+07            0.11285D-04           -0.21892D-05            0.63973D-06            0.39301D-06
      0.69747D+06            0.87756D-04           -0.17030D-04            0.49697D-05            0.30538D-05
      0.15869D+06            0.46164D-03           -0.89589D-04            0.26197D-04            0.16092D-04
      0.44914D+05            0.19505D-02           -0.37915D-03            0.11059D-03            0.67965D-04
      0.14630D+05            0.70858D-02           -0.13814D-02            0.40443D-03            0.24841D-03
      0.52730D+04            0.22806D-01           -0.44898D-02            0.13105D-02            0.80565D-03
      0.20540D+04            0.65386D-01           -0.13148D-01            0.38670D-02            0.23759D-02
      0.85096D+03            0.16361D+00           -0.34635D-01            0.10184D-01            0.62686D-02
      0.36988D+03            0.33736D+00           -0.79592D-01            0.23898D-01            0.14713D-01
      0.16739D+03            0.50000D+00           -0.14594D+00            0.44519D-01            0.27551D-01
      0.77952D+02            0.41976D+00           -0.17795D+00            0.58528D-01            0.36343D-01
      0.36582D+02            0.12211D+00            0.33253D-03           -0.24304D-02           -0.13318D-02
      0.16851D+02            0.13315D-02            0.43968D+00           -0.19822D+00           -0.12921D+00
      0.78782D+01            0.13711D-02            0.50000D+00           -0.34242D+00           -0.23442D+00
      0.35376D+01           -0.78210D-03            0.11152D+00            0.50585D-01            0.39639D-01
      0.16708D+01            0.41797D-03           -0.52378D-02            0.50000D+00            0.47386D+00
      0.72574D+00           -0.16356D-03            0.19290D-02            0.31887D+00            0.50000D+00
  1  0  0  1  1
      0.21232D+00            1.0000000
  1  0  0  1  1
      0.94208D-01            1.0000000
  1  0  0  1  1
      0.36855D-01            1.0000000
  1  1  1  11  2
      0.12322D+05            0.10869D-03           -0.31235D-04
      0.29157D+04            0.96565D-03           -0.27612D-03
      0.94518D+03            0.55296D-02           -0.15974D-02
      0.35928D+03            0.24005D-01           -0.69520D-02
      0.15310D+03            0.78959D-01           -0.23455D-01
      0.69704D+02            0.20734D+00           -0.63225D-01
      0.33329D+02            0.39266D+00           -0.12812D+00
      0.16509D+02            0.50000D+00           -0.16561D+00
      0.82446D+01            0.34861D+00           -0.78752D-01
      0.40855D+01            0.89090D-01            0.25262D+00
      0.19480D+01            0.22845D-02            0.50000D+00
  1  1  1  1  1
      0.89703D+00            1.0000000
  1  1  1  1  1
      0.38847D+00            1.0000000
  1  1  1  1  1
      0.11100D+00            1.0000000
  1  2  2  7  1
      0.27056D+03            0.96255D-03
      0.80792D+02            0.83663D-02
      0.31257D+02            0.38793D-01
      0.13809D+02            0.12076D+00
      0.62555D+01            0.28593D+00
      0.29228D+01            0.44482D+00
      0.13442D+01            0.50000D+00
  1  2  2  1  1
      0.59678D+00            1.0000000
  1  2  2  1  1
      0.25050D+00            1.0000000
  1  2  2  1  1
      0.95029D-01            1.0000000
  1  3  3  1  1
      6.395000D+00           1.0000000
  1  3  3  1  1
      1.776000D+00           1.0000000
  1  3  3  1  1
      0.493000D+00           1.0000000
  1  4  4  1  1
      4.263000D+00           1.0000000
  1  4  4  1  1
      0.947000D+00           1.0000000
  1  5  5  1  1
      2.160000D+00           1.0000000
# COBALT (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Co pc-3
  18
  1  0  0  17  4
      0.50257D+07            0.11288D-04           -0.21986D-05            0.64103D-06            0.40268D-06
      0.75244D+06            0.87824D-04           -0.17111D-04            0.49828D-05            0.31311D-05
      0.17115D+06            0.46203D-03           -0.90019D-04            0.26263D-04            0.16495D-04
      0.48472D+05            0.19486D-02           -0.38028D-03            0.11070D-03            0.69574D-04
      0.15808D+05            0.70687D-02           -0.13835D-02            0.40410D-03            0.25379D-03
      0.57020D+04            0.22739D-01           -0.44942D-02            0.13093D-02            0.82320D-03
      0.22224D+04            0.65166D-01           -0.13157D-01            0.38601D-02            0.24248D-02
      0.92103D+03            0.16318D+00           -0.34679D-01            0.10181D-01            0.64090D-02
      0.40035D+03            0.33689D+00           -0.79803D-01            0.23905D-01            0.15046D-01
      0.18121D+03            0.50000D+00           -0.14657D+00            0.44677D-01            0.28284D-01
      0.84447D+02            0.42056D+00           -0.17893D+00            0.58724D-01            0.37266D-01
      0.39693D+02            0.12293D+00           -0.41628D-03           -0.20729D-02           -0.10728D-02
      0.18365D+02            0.14643D-02            0.43926D+00           -0.19859D+00           -0.13256D+00
      0.86147D+01            0.13530D-02            0.50000D+00           -0.34227D+00           -0.23913D+00
      0.38904D+01           -0.75360D-03            0.11158D+00            0.55104D-01            0.43273D-01
      0.18174D+01            0.38959D-03           -0.46480D-02            0.50000D+00            0.48612D+00
      0.78574D+00           -0.14867D-03            0.17325D-02            0.31219D+00            0.50000D+00
  1  0  0  1  1
      0.21739D+00            1.0000000
  1  0  0  1  1
      0.96783D-01            1.0000000
  1  0  0  1  1
      0.38260D-01            1.0000000
  1  1  1  11  2
      0.13773D+05            0.10266D-03           -0.29771D-04
      0.32630D+04            0.91058D-03           -0.26289D-03
      0.10584D+04            0.52222D-02           -0.15222D-02
      0.40245D+03            0.22737D-01           -0.66473D-02
      0.17143D+03            0.75574D-01           -0.22641D-01
      0.77938D+02            0.20085D+00           -0.61822D-01
      0.37233D+02            0.38631D+00           -0.12704D+00
      0.18424D+02            0.50000D+00           -0.16786D+00
      0.91941D+01            0.35456D+00           -0.82539D-01
      0.45487D+01            0.92170D-01            0.24923D+00
      0.21658D+01            0.24176D-02            0.50000D+00
  1  1  1  1  1
      0.99561D+00            1.0000000
  1  1  1  1  1
      0.43036D+00            1.0000000
  1  1  1  1  1
      0.12300D+00            1.0000000
  1  2  2  7  1
      0.30844D+03            0.90560D-03
      0.92330D+02            0.78994D-02
      0.35867D+02            0.37096D-01
      0.15802D+02            0.11928D+00
      0.71451D+01            0.28397D+00
      0.33436D+01            0.44411D+00
      0.15405D+01            0.50000D+00
  1  2  2  1  1
      0.68406D+00            1.0000000
  1  2  2  1  1
      0.28699D+00            1.0000000
  1  2  2  1  1
      0.10879D+00            1.0000000
  1  3  3  1  1
      7.034000D+00           1.0000000
  1  3  3  1  1
      1.954000D+00           1.0000000
  1  3  3  1  1
      0.543000D+00           1.0000000
  1  4  4  1  1
      4.689000D+00           1.0000000
  1  4  4  1  1
      1.042000D+00           1.0000000
  1  5  5  1  1
      2.376000D+00           1.0000000
# NICKEL (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Ni pc-3
  18
  1  0  0  17  4
      0.54837D+07            0.11138D-04           -0.21545D-05            0.63274D-06            0.40011D-06
      0.82061D+06            0.86698D-04           -0.16773D-04            0.49205D-05            0.31127D-05
      0.18663D+06            0.45620D-03           -0.88276D-04            0.25940D-04            0.16401D-04
      0.52841D+05            0.19249D-02           -0.37300D-03            0.10939D-03            0.69211D-04
      0.17236D+05            0.69769D-02           -0.13562D-02            0.39897D-03            0.25222D-03
      0.62223D+04            0.22417D-01           -0.43984D-02            0.12910D-02            0.81715D-03
      0.24271D+04            0.64264D-01           -0.12882D-01            0.38065D-02            0.24068D-02
      0.10062D+04            0.16123D+00           -0.33984D-01            0.10052D-01            0.63711D-02
      0.43752D+03            0.33416D+00           -0.78459D-01            0.23666D-01            0.14992D-01
      0.19811D+03            0.50000D+00           -0.14482D+00            0.44488D-01            0.28359D-01
      0.92400D+02            0.42653D+00           -0.17923D+00            0.59182D-01            0.37787D-01
      0.43592D+02            0.12860D+00           -0.61765D-02            0.13098D-03            0.39147D-03
      0.20119D+02            0.22775D-02            0.43230D+00           -0.19707D+00           -0.13251D+00
      0.94519D+01            0.12120D-02            0.50000D+00           -0.34396D+00           -0.24135D+00
      0.42943D+01           -0.68143D-03            0.11345D+00            0.52925D-01            0.41150D-01
      0.19867D+01            0.34463D-03           -0.39613D-02            0.50000D+00            0.48854D+00
      0.85448D+00           -0.12928D-03            0.15409D-02            0.31147D+00            0.50000D+00
  1  0  0  1  1
      0.22643D+00            1.0000000
  1  0  0  1  1
      0.10034D+00            1.0000000
  1  0  0  1  1
      0.39770D-01            1.0000000
  1  1  1  11  2
      0.14973D+05            0.10171D-03           -0.29667D-04
      0.35432D+04            0.90424D-03           -0.26292D-03
      0.11486D+04            0.51910D-02           -0.15219D-02
      0.43698D+03            0.22592D-01           -0.66533D-02
      0.18620D+03            0.75298D-01           -0.22695D-01
      0.84675D+02            0.20070D+00           -0.62283D-01
      0.40451D+02            0.38744D+00           -0.12825D+00
      0.20029D+02            0.50000D+00           -0.16948D+00
      0.10019D+02            0.35233D+00           -0.80828D-01
      0.49756D+01            0.91021D-01            0.25208D+00
      0.23694D+01            0.25445D-02            0.50000D+00
  1  1  1  1  1
      0.10895D+01            1.0000000
  1  1  1  1  1
      0.47095D+00            1.0000000
  1  1  1  1  1
      0.13500D+00            1.0000000
  1  2  2  7  1
      0.34056D+03            0.90048D-03
      0.10206D+03            0.78887D-02
      0.39662D+02            0.37411D-01
      0.17467D+02            0.12114D+00
      0.79180D+01            0.28708D+00
      0.37118D+01            0.44666D+00
      0.17119D+01            0.50000D+00
  1  2  2  1  1
      0.75974D+00            1.0000000
  1  2  2  1  1
      0.31789D+00            1.0000000
  1  2  2  1  1
      0.11987D+00            1.0000000
  1  3  3  1  1
      7.738000D+00           1.0000000
  1  3  3  1  1
      2.149000D+00           1.0000000
  1  3  3  1  1
      0.597000D+00           1.0000000
  1  4  4  1  1
      5.158000D+00           1.0000000
  1  4  4  1  1
      1.146000D+00           1.0000000
  1  5  5  1  1
      2.614000D+00           1.0000000
# COPPER (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Cu pc-3
  18
  1  0  0  17  4
      0.58784D+07            0.11146D-04           -0.21680D-05            0.63645D-06            0.40655D-06
      0.88071D+06            0.86602D-04           -0.16848D-04            0.49413D-05            0.31578D-05
      0.20047D+06            0.45538D-03           -0.88613D-04            0.26026D-04            0.16622D-04
      0.56771D+05            0.19216D-02           -0.37444D-03            0.10979D-03            0.70178D-04
      0.18518D+05            0.69654D-02           -0.13616D-02            0.40033D-03            0.25563D-03
      0.66846D+04            0.22384D-01           -0.44165D-02            0.12962D-02            0.82892D-03
      0.26074D+04            0.64169D-01           -0.12937D-01            0.38201D-02            0.24398D-02
      0.10810D+04            0.16104D+00           -0.34137D-01            0.10099D-01            0.64672D-02
      0.47008D+03            0.33397D+00           -0.78885D-01            0.23780D-01            0.15215D-01
      0.21286D+03            0.50000D+00           -0.14577D+00            0.44827D-01            0.28875D-01
      0.99317D+02            0.42661D+00           -0.18040D+00            0.59534D-01            0.38383D-01
      0.46874D+02            0.12852D+00           -0.57804D-02            0.10531D-03            0.42566D-03
      0.21733D+02            0.22131D-02            0.43344D+00           -0.19861D+00           -0.13506D+00
      0.10242D+02            0.12512D-02            0.50000D+00           -0.34425D+00           -0.24362D+00
      0.46733D+01           -0.68953D-03            0.11327D+00            0.56962D-01            0.44146D-01
      0.21484D+01            0.34159D-03           -0.36218D-02            0.50000D+00            0.49397D+00
      0.92213D+00           -0.12681D-03            0.14386D-02            0.30806D+00            0.50000D+00
  1  0  0  1  1
      0.23922D+00            1.0000000
  1  0  0  1  1
      0.10521D+00            1.0000000
  1  0  0  1  1
      0.41629D-01            1.0000000
  1  1  1  11  2
      0.16206D+05            0.10083D-03           -0.29573D-04
      0.38372D+04            0.89557D-03           -0.26221D-03
      0.12444D+04            0.51418D-02           -0.15159D-02
      0.47362D+03            0.22394D-01           -0.66413D-02
      0.20177D+03            0.74927D-01           -0.22713D-01
      0.91728D+02            0.20038D+00           -0.62675D-01
      0.43801D+02            0.38842D+00           -0.12938D+00
      0.21685D+02            0.50000D+00           -0.17111D+00
      0.10862D+02            0.34988D+00           -0.78568D-01
      0.54039D+01            0.89383D-01            0.25603D+00
      0.25731D+01            0.24993D-02            0.50000D+00
  1  1  1  1  1
      0.11834D+01            1.0000000
  1  1  1  1  1
      0.51174D+00            1.0000000
  1  1  1  1  1
      0.14600D+00            1.0000000
  1  2  2  7  1
      0.36574D+03            0.94145D-03
      0.10961D+03            0.82721D-02
      0.42546D+02            0.39423D-01
      0.18750D+02            0.12652D+00
      0.85333D+01            0.29601D+00
      0.40034D+01            0.45311D+00
      0.18461D+01            0.50000D+00
  1  2  2  1  1
      0.81860D+00            1.0000000
  1  2  2  1  1
      0.34174D+00            1.0000000
  1  2  2  1  1
      0.12829D+00            1.0000000
  1  3  3  1  1
      8.511000D+00           1.0000000
  1  3  3  1  1
      2.364000D+00           1.0000000
  1  3  3  1  1
      0.657000D+00           1.0000000
  1  4  4  1  1
      5.674000D+00           1.0000000
  1  4  4  1  1
      1.261000D+00           1.0000000
  1  5  5  1  1
      2.875000D+00           1.0000000
# ZINC (20s,14p,10d,3f,2g,1h) -> [7s,5p,4d,3f,2g,1h]
Zn pc-3
  18
  1  0  0  17  4
      0.63422D+07            0.11057D-04           -0.21491D-05            0.63296D-06            0.40685D-06
      0.94980D+06            0.85961D-04           -0.16711D-04            0.49177D-05            0.31625D-05
      0.21616D+06            0.45195D-03           -0.87888D-04            0.25895D-04            0.16641D-04
      0.61229D+05            0.19063D-02           -0.37118D-03            0.10921D-03            0.70249D-04
      0.19976D+05            0.69098D-02           -0.13499D-02            0.39811D-03            0.25580D-03
      0.72114D+04            0.22210D-01           -0.43784D-02            0.12896D-02            0.82990D-03
      0.28124D+04            0.63732D-01           -0.12839D-01            0.38028D-02            0.24437D-02
      0.11657D+04            0.16017D+00           -0.33913D-01            0.10070D-01            0.64896D-02
      0.50683D+03            0.33275D+00           -0.78495D-01            0.23733D-01            0.15278D-01
      0.22954D+03            0.50000D+00           -0.14543D+00            0.44913D-01            0.29118D-01
      0.10714D+03            0.42915D+00           -0.18100D+00            0.59886D-01            0.38838D-01
      0.50645D+02            0.13080D+00           -0.78541D-02            0.99808D-03            0.10486D-02
      0.23510D+02            0.25331D-02            0.43098D+00           -0.19883D+00           -0.13611D+00
      0.11100D+02            0.12033D-02            0.50000D+00           -0.34496D+00           -0.24525D+00
      0.50763D+01           -0.66020D-03            0.11366D+00            0.58414D-01            0.45191D-01
      0.23203D+01            0.32250D-03           -0.33948D-02            0.50000D+00            0.49606D+00
      0.99255D+00           -0.11872D-03            0.13733D-02            0.30600D+00            0.50000D+00
  1  0  0  1  1
      0.25270D+00            1.0000000
  1  0  0  1  1
      0.11023D+00            1.0000000
  1  0  0  1  1
      0.43366D-01            1.0000000
  1  1  1  11  2
      0.17442D+05            0.10062D-03           -0.29647D-04
      0.41297D+04            0.89346D-03           -0.26313D-03
      0.13396D+04            0.51302D-02           -0.15197D-02
      0.51006D+03            0.22345D-01           -0.66666D-02
      0.21736D+03            0.74874D-01           -0.22810D-01
      0.98880D+02            0.20045D+00           -0.63124D-01
      0.47240D+02            0.38948D+00           -0.13042D+00
      0.23402D+02            0.50000D+00           -0.17253D+00
      0.11743D+02            0.34787D+00           -0.76472D-01
      0.58521D+01            0.88115D-01            0.25914D+00
      0.27873D+01            0.24669D-02            0.50000D+00
  1  1  1  1  1
      0.12815D+01            1.0000000
  1  1  1  1  1
      0.55370D+00            1.0000000
  1  1  1  1  1
      0.15800D+00            1.0000000
  1  2  2  7  1
      0.40137D+03            0.92840D-03
      0.12043D+03            0.81836D-02
      0.46778D+02            0.39332D-01
      0.20613D+02            0.12707D+00
      0.94033D+01            0.29681D+00
      0.44190D+01            0.45394D+00
      0.20392D+01            0.50000D+00
  1  2  2  1  1
      0.90400D+00            1.0000000
  1  2  2  1  1
      0.37687D+00            1.0000000
  1  2  2  1  1
      0.14113D+00            1.0000000
  1  3  3  1  1
      9.363000D+00           1.0000000
  1  3  3  1  1
      2.601000D+00           1.0000000
  1  3  3  1  1
      0.722000D+00           1.0000000
  1  4  4  1  1
      6.242000D+00           1.0000000
  1  4  4  1  1
      1.387000D+00           1.0000000
  1  5  5  1  1
      3.162000D+00           1.0000000
#
#  pc-4  EMSL  Basis Set Exchange Library  1/23/17 10:15 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
# K Ca Ga Ge As Se Br Kr: Frank Jensen, Polarization Consistent Basis Sets. VII. The Elements K, Ca, Ga, Ge, As, Se, Br and Kr, J. Chem. Phys. 136, 094110 (2012).
# Sc Ti V Cr Mn Fe Co Ni Cu Zn: Frank Jensen, Polarization Consistent Basis Sets. VIII. The Transition Metals Sc-Zn, J. Chem. Phys. 138, 014107 (2013).
#
# HYDROGEN
H  pc-4
 19
  1  0  0  5  1
       3079.70000000          0.00023473
        461.52000000          0.00182450
        105.06000000          0.00959330
         29.76400000          0.04046100
          9.71830000          0.14607000
  1  0  0  1  1
          3.51790000          1.00000000
  1  0  0  1  1
          1.37700000          1.00000000
  1  0  0  1  1
          0.56831000          1.00000000
  1  0  0  1  1
          0.24341000          1.00000000
  1  0  0  1  1
          0.10505000          1.00000000
  1  0  0  1  1
          0.04419800          1.00000000
  1  1  1  1  1
         30.00000000          1.00000000
  1  1  1  1  1
          6.60000000          1.00000000
  1  1  1  1  1
          2.10000000          1.00000000
  1  1  1  1  1
          0.95000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          3.20000000          1.00000000
# HELIUM
He pc-4
 19
  1  0  0  5  1
       8780.20000000          0.00146640
       1315.60000000          0.01139500
        299.46000000          0.05981900
         84.83300000          0.25089000
         27.69100000          0.89135000
  1  0  0  1  1
         10.00800000          1.00000000
  1  0  0  1  1
          3.89240000          1.00000000
  1  0  0  1  1
          1.58190000          1.00000000
  1  0  0  1  1
          0.65698000          1.00000000
  1  0  0  1  1
          0.26459000          1.00000000
  1  0  0  1  1
          0.10585000          1.00000000
  1  1  1  1  1
         40.50000000          1.00000000
  1  1  1  1  1
          8.90000000          1.00000000
  1  1  1  1  1
          2.85000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
  1  1  1  1  1
          0.60000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          3.70000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          4.10000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  4  4  1  1
          4.65000000          1.00000000
# LITHIUM
Li pc-4
 17
  1  0  0 13  2
      70681.00000000          0.00000544          0.00000000
      13594.00000000          0.00003328         -0.00000011
       3100.40000000          0.00019175          0.00000017
        826.46000000          0.00089686         -0.00000357
        253.76000000          0.00344770          0.00000859
         88.45100000          0.01143500         -0.00005557
         34.49300000          0.03095700          0.00028213
         14.83100000          0.07323700         -0.00045594
          6.92990000          0.12668000          0.00524910
          3.46780000          0.21423000         -0.00487050
          1.83160000          0.17857000          0.04683100
          1.00630000          0.28492000         -0.03228200
          0.56678000          0.00000000          0.10296000
  1  0  0  1  1
          0.32254000          1.00000000
  1  0  0  1  1
          0.18277000          1.00000000
  1  0  0  1  1
          0.10164000          1.00000000
  1  0  0  1  1
          0.05466600          1.00000000
  1  0  0  1  1
          0.02802500          1.00000000
  1  0  0  1  1
          0.01349700          1.00000000
  1  1  1  5  1
         28.50000000          0.00036754
          6.64000000          0.00322359
          1.92000000          0.01432120
          0.77000000          0.03648140
          0.32000000          0.07577460
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06600000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  4  4  1  1
          0.55000000          1.00000000
# BERYLLIUM
Be pc-4
 17
  1  0  0 13  2
     139330.00000000          0.00000244          0.00000000
      26774.00000000          0.00001494         -0.00000040
       6112.00000000          0.00008580          0.00000060
       1632.90000000          0.00040022         -0.00001224
        503.03000000          0.00152890          0.00003235
        176.03000000          0.00505860         -0.00017006
         68.93900000          0.01364400          0.00113620
         29.76800000          0.03273000         -0.00064192
         13.96300000          0.05754600          0.02159000
          7.00900000          0.10067000          0.00042561
          3.70940000          0.08634800          0.18149000
          2.03920000          0.12653000          0.01235200
          1.14720000          0.00000000          0.38475000
  1  0  0  1  1
          0.65070000          1.00000000
  1  0  0  1  1
          0.36659000          1.00000000
  1  0  0  1  1
          0.20211000          1.00000000
  1  0  0  1  1
          0.10742000          1.00000000
  1  0  0  1  1
          0.05423100          1.00000000
  1  0  0  1  1
          0.02561900          1.00000000
  1  1  1  5  1
         45.70000000          0.00065877
         10.60000000          0.00573382
          3.08000000          0.02784590
          1.23000000          0.05643490
          0.51000000          0.17616700
  1  1  1  1  1
          0.23000000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  1  1  1  1
          0.04000000          1.00000000
  1  2  2  1  1
          3.35000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.75000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.80000000          1.00000000
# BORON
B  pc-4
 26
  1  0  0 12  2
     742500.00000000          0.00000122          0.00000000
     110930.00000000          0.00000944          0.00000000
      25203.00000000          0.00005028          0.00000000
       7129.30000000          0.00020962          0.00000231
       2324.70000000          0.00077739         -0.00000366
        839.05000000          0.00247190          0.00004948
        327.79000000          0.00746650          0.00001943
        136.72000000          0.01909500          0.00110270
         60.29400000          0.04670600          0.00268300
         27.73100000          0.08501500          0.02218600
         12.99200000          0.14297000          0.06084500
          6.25510000          0.00000000          0.28114000
  1  0  0  1  1
          3.14720000          1.00000000
  1  0  0  1  1
          1.56270000          1.00000000
  1  0  0  1  1
          0.74066000          1.00000000
  1  0  0  1  1
          0.31290000          1.00000000
  1  0  0  1  1
          0.13142000          1.00000000
  1  0  0  1  1
          0.05470700          1.00000000
  1  1  1  5  1
        227.84000000          0.00112430
         53.92200000          0.00973930
         17.04800000          0.05453600
          6.00200000          0.23171000
          2.60660000          0.49931000
  1  1  1  1  1
          1.19620000          1.00000000
  1  1  1  1  1
          0.56967000          1.00000000
  1  1  1  1  1
          0.27377000          1.00000000
  1  1  1  1  1
          0.12880000          1.00000000
  1  1  1  1  1
          0.05965300          1.00000000
  1  1  1  1  1
          0.02619000          1.00000000
  1  2  2  1  1
          5.30000000          1.00000000
  1  2  2  1  1
          1.90000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          1.90000000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.65000000          1.00000000
  1  4  4  1  1
          0.70000000          1.00000000
  1  5  5  1  1
          1.75000000          1.00000000
# CARBON
C  pc-4
 26
  1  0  0 12  2
     527780.00000000          0.00000297          0.00000000
      79105.00000000          0.00002316          0.00000000
      18006.00000000          0.00012089          0.00000036
       5100.80000000          0.00051490         -0.00000359
       1664.70000000          0.00184580          0.00001809
        601.66000000          0.00602860          0.00000125
        235.40000000          0.01702300          0.00071075
         98.26300000          0.04407700          0.00253460
         43.26900000          0.08906100          0.01993400
         19.85800000          0.14817000          0.06504700
          9.56920000          0.06143600          0.27000000
          4.93730000          0.00000000          0.32854000
  1  0  0  1  1
          2.66870000          1.00000000
  1  0  0  1  1
          1.46740000          1.00000000
  1  0  0  1  1
          0.63863000          1.00000000
  1  0  0  1  1
          0.30240000          1.00000000
  1  0  0  1  1
          0.14116000          1.00000000
  1  0  0  1  1
          0.06374900          1.00000000
  1  1  1  5  1
        382.21000000          0.00098484
         90.48900000          0.00858470
         28.87100000          0.04827200
         10.38500000          0.20454000
          4.49720000          0.49867000
  1  1  1  1  1
          2.02740000          1.00000000
  1  1  1  1  1
          0.95154000          1.00000000
  1  1  1  1  1
          0.44815000          1.00000000
  1  1  1  1  1
          0.20721000          1.00000000
  1  1  1  1  1
          0.09487000          1.00000000
  1  1  1  1  1
          0.04084300          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.40000000          1.00000000
  1  4  4  1  1
          2.10000000          1.00000000
  1  4  4  1  1
          0.90000000          1.00000000
  1  5  5  1  1
          1.85000000          1.00000000
# NITROGEN
N  pc-4
 26
  1  0  0 12  2
     894760.00000000          0.00000226          0.00000000
     134830.00000000          0.00001754          0.00000000
      30808.00000000          0.00009117          0.00000000
       8751.50000000          0.00038740         -0.00000321
       2862.00000000          0.00138700          0.00001370
       1035.30000000          0.00455030         -0.00001486
        404.73000000          0.01300900          0.00048102
        168.33000000          0.03469600          0.00153840
         73.69500000          0.07480400          0.01355500
         33.75300000          0.13457000          0.04731100
         16.15700000          0.11672000          0.20160000
          7.96880000          0.00000000          0.40713000
  1  0  0  1  1
          3.95210000          1.00000000
  1  0  0  1  1
          1.94540000          1.00000000
  1  0  0  1  1
          0.92929000          1.00000000
  1  0  0  1  1
          0.44085000          1.00000000
  1  0  0  1  1
          0.20340000          1.00000000
  1  0  0  1  1
          0.09122600          1.00000000
  1  1  1  5  1
        566.23000000          0.00092433
        134.10000000          0.00808980
         43.01300000          0.04546300
         15.61200000          0.19622000
          6.64270000          0.51754000
  1  1  1  1  1
          2.97480000          1.00000000
  1  1  1  1  1
          1.38850000          1.00000000
  1  1  1  1  1
          0.65012000          1.00000000
  1  1  1  1  1
          0.30028000          1.00000000
  1  1  1  1  1
          0.13620000          1.00000000
  1  1  1  1  1
          0.05784500          1.00000000
  1  2  2  1  1
         12.80000000          1.00000000
  1  2  2  1  1
          4.40000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.37000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          2.30000000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          2.55000000          1.00000000
  1  4  4  1  1
          1.10000000          1.00000000
  1  5  5  1  1
          1.95000000          1.00000000
# OXYGEN
O  pc-4
 26
  1  0  0 12  2
    1259700.00000000          0.00000207          0.00000000
     190110.00000000          0.00001596          0.00000000
      43449.00000000          0.00008333          0.00000000
      12342.00000000          0.00035212         -0.00000088
       4035.00000000          0.00127090          0.00000749
       1459.70000000          0.00413240          0.00001892
        570.66000000          0.01197000          0.00035166
        237.50000000          0.03156100          0.00170470
        104.11000000          0.06996000          0.01141200
         47.58100000          0.12702000          0.04602500
         22.54600000          0.11899000          0.19140000
         11.09300000          0.00000000          0.40260000
  1  0  0  1  1
          5.54090000          1.00000000
  1  0  0  1  1
          2.77940000          1.00000000
  1  0  0  1  1
          1.28370000          1.00000000
  1  0  0  1  1
          0.59649000          1.00000000
  1  0  0  1  1
          0.27057000          1.00000000
  1  0  0  1  1
          0.12028000          1.00000000
  1  1  1  5  1
        708.61000000          0.00104560
        167.86000000          0.00912920
         53.96700000          0.05097700
         19.80700000          0.21599000
          8.38320000          0.58777000
  1  1  1  1  1
          3.74470000          1.00000000
  1  1  1  1  1
          1.73220000          1.00000000
  1  1  1  1  1
          0.79977000          1.00000000
  1  1  1  1  1
          0.36323000          1.00000000
  1  1  1  1  1
          0.15963000          1.00000000
  1  1  1  1  1
          0.06566400          1.00000000
  1  2  2  1  1
         18.20000000          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  4  4  1  1
          3.05000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  5  5  1  1
          2.05000000          1.00000000
# FLUORINE
F  pc-4
 26
  1  0  0 12  2
    1856000.00000000          0.00000172          0.00000000
     280070.00000000          0.00001324          0.00000000
      64078.00000000          0.00006902          0.00000000
      18216.00000000          0.00029162         -0.00000081
       5957.80000000          0.00105220          0.00000585
       2155.00000000          0.00343010          0.00001118
        841.96000000          0.00997250          0.00026452
        349.82000000          0.02662500          0.00124470
        152.79000000          0.06039700          0.00880460
         69.36700000          0.11468000          0.03666600
         32.57400000          0.11487000          0.16212000
         15.88900000          0.00000000          0.37403000
  1  0  0  1  1
          7.86510000          1.00000000
  1  0  0  1  1
          3.91990000          1.00000000
  1  0  0  1  1
          1.78610000          1.00000000
  1  0  0  1  1
          0.82065000          1.00000000
  1  0  0  1  1
          0.36937000          1.00000000
  1  0  0  1  1
          0.16198000          1.00000000
  1  1  1  5  1
        917.89000000          0.00104500
        217.41000000          0.00914290
         69.93900000          0.05122700
         25.83100000          0.21558000
         10.96900000          0.59660000
  1  1  1  1  1
          4.92150000          1.00000000
  1  1  1  1  1
          2.28390000          1.00000000
  1  1  1  1  1
          1.05790000          1.00000000
  1  1  1  1  1
          0.48135000          1.00000000
  1  1  1  1  1
          0.20902000          1.00000000
  1  1  1  1  1
          0.08555600          1.00000000
  1  2  2  1  1
         25.50000000          1.00000000
  1  2  2  1  1
          8.00000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.45000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          3.10000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  4  4  1  1
          3.60000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  5  5  1  1
          2.15000000          1.00000000
# NEON
Ne pc-4
 26
  1  0  0 12  2
    2522600.00000000          0.00000767          0.00000000
     377060.00000000          0.00005983          0.00000000
      85713.00000000          0.00031441          0.00000000
      24261.00000000          0.00133260         -0.00000020
       7911.70000000          0.00483320          0.00000212
       2855.50000000          0.01576300          0.00000758
       1113.60000000          0.04612300          0.00011055
        461.89000000          0.12339000          0.00058283
        201.35000000          0.28428000          0.00387530
         91.19800000          0.54569000          0.01708600
         42.68000000          0.58141000          0.07497800
         20.74200000          0.00000000          0.18391000
  1  0  0  1  1
         10.24900000          1.00000000
  1  0  0  1  1
          5.10130000          1.00000000
  1  0  0  1  1
          2.30310000          1.00000000
  1  0  0  1  1
          1.05310000          1.00000000
  1  0  0  1  1
          0.47222000          1.00000000
  1  0  0  1  1
          0.20466000          1.00000000
  1  1  1  5  1
       1169.90000000          0.00051064
        277.11000000          0.00447380
         89.26400000          0.02511000
         33.10000000          0.10593000
         14.03100000          0.29958000
  1  1  1  1  1
          6.29850000          1.00000000
  1  1  1  1  1
          2.92340000          1.00000000
  1  1  1  1  1
          1.35370000          1.00000000
  1  1  1  1  1
          0.61362000          1.00000000
  1  1  1  1  1
          0.26362000          1.00000000
  1  1  1  1  1
          0.10755000          1.00000000
  1  2  2  1  1
         32.00000000          1.00000000
  1  2  2  1  1
         10.10000000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.85000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          3.60000000          1.00000000
  1  3  3  1  1
          1.55000000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  4  4  1  1
          4.20000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  5  5  1  1
          2.25000000          1.00000000
# SODIUM
Na pc-4
 16
  1  0  0 17  3
    1918700.00000000          0.00000274          0.00000000          0.00000000
     287270.00000000          0.00002133          0.00000000          0.00000000
      65382.00000000          0.00011221          0.00000000          0.00000000
      18523.00000000          0.00047369          0.00000000          0.00000000
       6045.40000000          0.00172350          0.00000000         -0.00000144
       2184.20000000          0.00559140         -0.00001790         -0.00001306
        853.11000000          0.01646100         -0.00006498         -0.00009742
        354.69000000          0.04377600         -0.00060909         -0.00063787
        155.33000000          0.10266000         -0.00260940         -0.00333940
         71.23400000          0.20074000         -0.01329500         -0.01514500
         33.83500000          0.30952000         -0.03986700         -0.04907900
         16.34900000          0.30826000         -0.09610800         -0.10865000
          8.00820000          0.14855000         -0.07047900         -0.08852700
          3.67130000          0.01711300          0.24565000          0.29366000
          1.71180000         -0.00155410          0.55362000          0.47915000
          0.79147000          0.00000000          0.45869000          0.15680000
          0.35479000          0.00000000          0.00000000         -0.57853000
  1  0  0  1  1
          0.09066400          1.00000000
  1  0  0  1  1
          0.04431300          1.00000000
  1  0  0  1  1
          0.02194800          1.00000000
  1  0  0  1  1
          0.01082100          1.00000000
  1  1  1 11  1
       3044.20000000          0.00002935
        720.02000000          0.00026100
        234.42000000          0.00148190
         89.66600000          0.00648150
         36.69500000          0.02480300
         16.25600000          0.06595400
          7.65930000          0.14794000
          3.71250000          0.24400000
          1.79920000          0.30244000
          0.86288000          0.27557000
          0.40104000          0.16219000
  1  1  1  1  1
          0.17759000          1.00000000
  1  1  1  1  1
          0.08070000          1.00000000
  1  1  1  1  1
          0.03670000          1.00000000
  1  1  1  1  1
          0.01670000          1.00000000
  1  2  2  1  1
          2.35000000          1.00000000
  1  2  2  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  3  3  1  1
          1.08000000          1.00000000
  1  3  3  1  1
          0.24000000          1.00000000
  1  4  4  1  1
          0.30000000          1.00000000
# MAGNESIUM
Mg pc-4
 16
  1  0  0 17  3
    3199100.00000000          0.00000090          0.00000000          0.00000000
     479000.00000000          0.00000701          0.00000000          0.00000000
     109010.00000000          0.00003689          0.00000000          0.00000000
      30878.00000000          0.00015584          0.00000000          0.00000000
      10075.00000000          0.00056784          0.00000000          0.00000000
       3637.90000000          0.00184930         -0.00000336          0.00000000
       1419.50000000          0.00548860         -0.00001119          0.00000139
        589.35000000          0.01487100         -0.00011126          0.00001097
        257.53000000          0.03631500         -0.00050000          0.00005638
        117.17000000          0.07751300         -0.00266410          0.00026010
         54.76200000          0.13593000         -0.00983480          0.00092696
         26.28800000          0.16490000         -0.02596400          0.00140020
         12.86000000          0.11240000         -0.03988900          0.00021032
          6.26040000          0.02650100          0.02928600         -0.00139360
          2.85140000          0.00006822          0.16700000          0.06338500
          1.30580000          0.00000000          0.15689000          0.35178000
          0.58331000          0.00000000          0.00000000          0.45980000
  1  0  0  1  1
          0.16849000          1.00000000
  1  0  0  1  1
          0.08564600          1.00000000
  1  0  0  1  1
          0.04507700          1.00000000
  1  0  0  1  1
          0.02193400          1.00000000
  1  1  1 11  1
       4157.80000000          0.00001234
        984.53000000          0.00010978
        320.09000000          0.00063086
        121.73000000          0.00283310
         49.89200000          0.01077300
         22.54200000          0.02877200
         10.74900000          0.06653700
          5.28990000          0.11557000
          2.59960000          0.15417000
          1.25180000          0.14665000
          0.59246000          0.08190400
  1  1  1  1  1
          0.26941000          1.00000000
  1  1  1  1  1
          0.12250000          1.00000000
  1  1  1  1  1
          0.05570000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  2  2  1  1
          3.36000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.35000000          1.00000000
# ALUMINUM
Al pc-4
 22
  1  0  0 17  3
    3845200.00000000          0.00000175          0.00000000          0.00000000
     575260.00000000          0.00001365          0.00000000          0.00000000
     130860.00000000          0.00007187          0.00000000          0.00000000
      37063.00000000          0.00030355          0.00000000          0.00000000
      12094.00000000          0.00110600          0.00000000         -0.00000109
       4366.80000000          0.00360350         -0.00001133         -0.00001050
       1703.60000000          0.01070200         -0.00006005         -0.00007868
        707.13000000          0.02903600         -0.00046344         -0.00052023
        308.97000000          0.07104500         -0.00237800         -0.00291520
        140.71000000          0.15195000         -0.01184200         -0.01384800
         65.91700000          0.26792000         -0.04567500         -0.05496800
         31.73000000          0.32914000         -0.11864000         -0.13850000
         15.58700000          0.22998000         -0.19088000         -0.22663000
          7.63820000          0.05743300          0.12421000          0.15454000
          3.54540000          0.00040260          0.72353000          0.75844000
          1.66790000          0.00000000          0.75665000          0.53134000
          0.76939000          0.00000000          0.00000000         -0.50362000
  1  0  0  1  1
          0.27917000          1.00000000
  1  0  0  1  1
          0.14016000          1.00000000
  1  0  0  1  1
          0.07033600          1.00000000
  1  0  0  1  1
          0.03366000          1.00000000
  1  1  1 12  2
       5687.30000000          0.00001998          0.00000000
       1345.20000000          0.00017728          0.00001010
        436.38000000          0.00103710          0.00000000
        165.45000000          0.00470060          0.00022858
         68.61900000          0.01742700         -0.00026528
         31.87500000          0.04664300          0.00155100
         15.43200000          0.11224000         -0.00904470
          7.75700000          0.20457000         -0.00361670
          3.92560000          0.29828000         -0.07048600
          1.97640000          0.30142000         -0.01171600
          0.99918000          0.18905000          0.04407300
          0.50630000          0.00000000          0.55310000
  1  1  1  1  1
          0.25847000          1.00000000
  1  1  1  1  1
          0.11566000          1.00000000
  1  1  1  1  1
          0.05104800          1.00000000
  1  1  1  1  1
          0.02120000          1.00000000
  1  2  2  1  1
         17.81000000          1.00000000
  1  2  2  1  1
          5.09000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.63000000          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  3  3  1  1
          2.17000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  4  4  1  1
          1.14000000          1.00000000
  1  4  4  1  1
          0.38000000          1.00000000
  1  5  5  1  1
          0.69000000          1.00000000
# SILICON
Si pc-4
 22
  1  0  0 17  3
    4615800.00000000          0.00000166          0.00000000          0.00000000
     719010.00000000          0.00001213          0.00000000          0.00000000
     169990.00000000          0.00006097          0.00000000          0.00000000
      49400.00000000          0.00025124          0.00000000          0.00000000
      16385.00000000          0.00090088         -0.00000095          0.00000000
       5985.40000000          0.00290390         -0.00000194         -0.00000381
       2354.10000000          0.00858520         -0.00004218         -0.00002900
        981.40000000          0.02342100         -0.00020469         -0.00018868
        428.90000000          0.05842200         -0.00142610         -0.00109670
        194.54000000          0.12977000         -0.00637950         -0.00533750
         90.77700000          0.24037000         -0.02866400         -0.02274900
         43.71500000          0.32480000         -0.07569500         -0.06293600
         21.49100000          0.26684000         -0.15473000         -0.12525000
         10.66900000          0.09132400          0.01591300          0.00521670
          4.88820000          0.00534240          0.46344000          0.43080000
          2.33610000          0.00000000          0.60218000          0.71833000
          1.09670000          0.00000000          0.00000000          0.38360000
  1  0  0  1  1
          0.42312000          1.00000000
  1  0  0  1  1
          0.24276000          1.00000000
  1  0  0  1  1
          0.11703000          1.00000000
  1  0  0  1  1
          0.05286100          1.00000000
  1  1  1 12  2
       6453.30000000          0.00002165          0.00000000
       1533.90000000          0.00019162          0.00000096
        498.38000000          0.00111430         -0.00000017
        188.98000000          0.00508300          0.00001992
         77.88700000          0.01926900         -0.00003897
         35.51400000          0.05309100          0.00006333
         17.01600000          0.12639000         -0.00140570
          8.49770000          0.22312000         -0.00120800
          4.35440000          0.29854000         -0.01139000
          2.25750000          0.28651000          0.00460790
          1.15970000          0.17168000         -0.00057688
          0.59343000          0.00000000          0.13174000
  1  1  1  1  1
          0.29012000          1.00000000
  1  1  1  1  1
          0.13825000          1.00000000
  1  1  1  1  1
          0.06459400          1.00000000
  1  1  1  1  1
          0.02835400          1.00000000
  1  2  2  1  1
         19.52000000          1.00000000
  1  2  2  1  1
          5.58000000          1.00000000
  1  2  2  1  1
          1.92000000          1.00000000
  1  2  2  1  1
          0.69000000          1.00000000
  1  2  2  1  1
          0.29900000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  3  3  1  1
          2.64000000          1.00000000
  1  3  3  1  1
          0.62000000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  4  4  1  1
          1.35000000          1.00000000
  1  4  4  1  1
          0.45000000          1.00000000
  1  5  5  1  1
          0.78000000          1.00000000
# PHOSPHOROUS
P  pc-4
 22
  1  0  0 17  3
    5262500.00000000          0.00000167          0.00000000          0.00000000
     822130.00000000          0.00001221          0.00000000          0.00000000
     194250.00000000          0.00006144          0.00000000          0.00000000
      56424.00000000          0.00025322          0.00000000          0.00000000
      18716.00000000          0.00090752         -0.00000088          0.00000000
       6839.30000000          0.00292300         -0.00000120         -0.00000486
       2693.10000000          0.00861380         -0.00003678         -0.00003786
       1126.50000000          0.02332900         -0.00016467         -0.00024017
        495.21000000          0.05764100         -0.00118610         -0.00138650
        226.38000000          0.12694000         -0.00509360         -0.00661190
        106.62000000          0.23408000         -0.02293900         -0.02784700
         51.90500000          0.31805000         -0.05950300         -0.07656600
         25.85100000          0.27002000         -0.12532000         -0.15527000
         13.02200000          0.10197000         -0.00340880         -0.01712400
          6.05680000          0.00808990          0.33461000          0.48842000
          2.95740000          0.00000000          0.50380000          0.90895000
          1.40780000          0.00000000          0.00000000          0.53649000
  1  0  0  1  1
          0.57187000          1.00000000
  1  0  0  1  1
          0.31078000          1.00000000
  1  0  0  1  1
          0.14947000          1.00000000
  1  0  0  1  1
          0.06831300          1.00000000
  1  1  1 12  2
       7748.60000000          0.00002087          0.00000000
       1833.60000000          0.00018596          0.00000082
        595.55000000          0.00107990         -0.00000028
        226.61000000          0.00489460          0.00001597
         94.19100000          0.01832000         -0.00004740
         43.33200000          0.05066900          0.00000117
         20.90700000          0.12156000         -0.00158320
         10.50200000          0.21931000         -0.00181170
          5.42550000          0.29640000         -0.01346500
          2.88180000          0.28179000          0.00615030
          1.52840000          0.17853000         -0.00714440
          0.81081000          0.00000000          0.14315000
  1  1  1  1  1
          0.39028000          1.00000000
  1  1  1  1  1
          0.18645000          1.00000000
  1  1  1  1  1
          0.08756700          1.00000000
  1  1  1  1  1
          0.03867300          1.00000000
  1  2  2  1  1
         21.23000000          1.00000000
  1  2  2  1  1
          6.07000000          1.00000000
  1  2  2  1  1
          2.09000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  3  3  1  1
          3.12000000          1.00000000
  1  3  3  1  1
          0.73000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.52000000          1.00000000
  1  5  5  1  1
          0.87000000          1.00000000
# SULFUR
S  pc-4
 22
  1  0  0 17  3
    6359200.00000000          0.00000156          0.00000000          0.00000000
     983890.00000000          0.00001156          0.00000000          0.00000000
     229770.00000000          0.00005902          0.00000000          0.00000000
      66276.00000000          0.00024474          0.00000000          0.00000000
      21884.00000000          0.00088159         -0.00000082          0.00000000
       7969.60000000          0.00284940         -0.00000103         -0.00000282
       3129.90000000          0.00842730         -0.00003412         -0.00002108
       1305.20000000          0.02295100         -0.00015187         -0.00013709
        571.70000000          0.05703800         -0.00110930         -0.00078935
        260.58000000          0.12616000         -0.00479670         -0.00382300
        122.48000000          0.23373000         -0.02168200         -0.01607200
         59.51800000          0.31883000         -0.05690800         -0.04492200
         29.62700000          0.27098000         -0.11915000         -0.09013700
         14.94300000          0.10217000         -0.00271680         -0.01063100
          7.04790000          0.00813260          0.30365000          0.27687000
          3.50400000          0.00000000          0.47588000          0.51960000
          1.69970000          0.00000000          0.00000000          0.30991000
  1  0  0  1  1
          0.73101000          1.00000000
  1  0  0  1  1
          0.37948000          1.00000000
  1  0  0  1  1
          0.18185000          1.00000000
  1  0  0  1  1
          0.08396100          1.00000000
  1  1  1 12  2
       9341.40000000          0.00001949          0.00000000
       2208.60000000          0.00017432          0.00000061
        716.27000000          0.00101610         -0.00000034
        272.51000000          0.00461720          0.00001063
        113.77000000          0.01716300         -0.00005018
         52.57100000          0.04813200         -0.00007805
         25.39700000          0.11704000         -0.00161880
         12.77000000          0.21602000         -0.00265510
          6.62240000          0.29528000         -0.01377700
          3.53880000          0.28825000          0.00242460
          1.87560000          0.17982000          0.00058572
          0.99018000          0.00000000          0.16518000
  1  1  1  1  1
          0.47723000          1.00000000
  1  1  1  1  1
          0.22692000          1.00000000
  1  1  1  1  1
          0.10473000          1.00000000
  1  1  1  1  1
          0.04530300          1.00000000
  1  2  2  1  1
         22.93000000          1.00000000
  1  2  2  1  1
          6.55000000          1.00000000
  1  2  2  1  1
          2.26000000          1.00000000
  1  2  2  1  1
          0.81000000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  2  2  1  1
          0.14600000          1.00000000
  1  3  3  1  1
          3.59000000          1.00000000
  1  3  3  1  1
          0.84000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.76000000          1.00000000
  1  4  4  1  1
          0.59000000          1.00000000
  1  5  5  1  1
          0.95000000          1.00000000
# CHLORINE
Cl pc-4
 22
  1  0  0 17  3
    7421200.00000000          0.00000150          0.00000000          0.00000000
    1141100.00000000          0.00001124          0.00000000          0.00000000
     264430.00000000          0.00005800          0.00000000          0.00000000
      75791.00000000          0.00024215          0.00000000          0.00000000
      24925.00000000          0.00087550         -0.00000134          0.00000000
       9052.60000000          0.00283760         -0.00000184         -0.00000371
       3548.10000000          0.00840860         -0.00005817         -0.00002924
       1478.00000000          0.02290600         -0.00026634         -0.00018902
        647.35000000          0.05689500         -0.00191720         -0.00109400
        295.33000000          0.12569000         -0.00835970         -0.00529080
        138.98000000          0.23327000         -0.03750200         -0.02220500
         67.54900000          0.31894000         -0.09949500         -0.06245500
         33.66100000          0.27117000         -0.20640000         -0.12439000
         17.02700000          0.10247000         -0.00520630         -0.01497300
          8.15040000          0.00830670          0.50048000          0.36440000
          4.13190000          0.00000000          0.83332000          0.68717000
          2.04570000          0.00000000          0.00000000          0.39343000
  1  0  0  1  1
          0.94029000          1.00000000
  1  0  0  1  1
          0.46901000          1.00000000
  1  0  0  1  1
          0.22219000          1.00000000
  1  0  0  1  1
          0.10220000          1.00000000
  1  1  1 12  2
      11035.00000000          0.00001851          0.00000000
       2611.50000000          0.00016527          0.00000056
        848.02000000          0.00096233         -0.00000035
        323.00000000          0.00437770          0.00000920
        135.33000000          0.01621800         -0.00005112
         62.68400000          0.04610400         -0.00010597
         30.29800000          0.11348000         -0.00166890
         15.24000000          0.21353000         -0.00309980
          7.92590000          0.29438000         -0.01462800
          4.28530000          0.28778000          0.00123450
          2.30430000          0.18269000          0.00153150
          1.23570000          0.00000000          0.16993000
  1  1  1  1  1
          0.60021000          1.00000000
  1  1  1  1  1
          0.28739000          1.00000000
  1  1  1  1  1
          0.13185000          1.00000000
  1  1  1  1  1
          0.05697000          1.00000000
  1  2  2  1  1
         24.63000000          1.00000000
  1  2  2  1  1
          7.04000000          1.00000000
  1  2  2  1  1
          2.43000000          1.00000000
  1  2  2  1  1
          0.87000000          1.00000000
  1  2  2  1  1
          0.37700000          1.00000000
  1  2  2  1  1
          0.15700000          1.00000000
  1  3  3  1  1
          4.06000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.39000000          1.00000000
  1  4  4  1  1
          1.97000000          1.00000000
  1  4  4  1  1
          0.66000000          1.00000000
  1  5  5  1  1
          1.04000000          1.00000000
# ARGON
Ar pc-4
 22
  1  0  0 17  3
    9445100.00000000          0.00000065          0.00000000          0.00000000
    1414100.00000000          0.00000503          0.00000000          0.00000000
     321810.00000000          0.00002648          0.00000000          0.00000000
      91158.00000000          0.00011190          0.00000000          0.00000000
      29743.00000000          0.00040791         -0.00000056          0.00000000
      10740.00000000          0.00133090         -0.00000040         -0.00000430
       4190.00000000          0.00396580         -0.00002366         -0.00003226
       1738.90000000          0.01086300         -0.00010267         -0.00021559
        759.29000000          0.02715900         -0.00077891         -0.00124380
        345.50000000          0.06051400         -0.00337400         -0.00612440
        162.36000000          0.11351000         -0.01548200         -0.02587800
         78.88800000          0.15827000         -0.04168700         -0.07483000
         39.32100000          0.13900000         -0.08942400         -0.15278000
         19.91800000          0.05564500         -0.01062200         -0.03707900
          9.57640000          0.00513770          0.20099000          0.43524000
          4.91610000          0.00000000          0.36722000          0.88582000
          2.46480000          0.00000000          0.00000000          0.60951000
  1  0  0  1  1
          1.18300000          1.00000000
  1  0  0  1  1
          0.57521000          1.00000000
  1  0  0  1  1
          0.27041000          1.00000000
  1  0  0  1  1
          0.12312000          1.00000000
  1  1  1 12  2
      13006.00000000          0.00000869          0.00000000
       3078.10000000          0.00007761          0.00000276
        999.56000000          0.00045249         -0.00000183
        380.97000000          0.00205950          0.00004540
        160.28000000          0.00758720         -0.00025551
         74.49400000          0.02182200         -0.00054968
         36.06500000          0.05433200         -0.00835420
         18.16400000          0.10442000         -0.01650400
          9.46650000          0.14645000         -0.07654200
          5.16300000          0.14426000          0.00166060
          2.80850000          0.09437900          0.00120150
          1.52350000          0.00000000          0.85169000
  1  1  1  1  1
          0.74379000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16221000          1.00000000
  1  1  1  1  1
          0.06995600          1.00000000
  1  2  2  1  1
         26.33000000          1.00000000
  1  2  2  1  1
          7.53000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.93000000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  3  3  1  1
          4.53000000          1.00000000
  1  3  3  1  1
          1.06000000          1.00000000
  1  3  3  1  1
          0.44000000          1.00000000
  1  4  4  1  1
          2.18000000          1.00000000
  1  4  4  1  1
          0.73000000          1.00000000
  1  5  5  1  1
          1.12000000          1.00000000
# POTASSIUM
K pc-4
 18
 1  0  0  20  4
      0.19074D+08            0.98509D-06           -0.17483D-06            0.45340D-07            0.29661D-07
      0.28592D+07            0.76453D-05           -0.13561D-05            0.35127D-06            0.22972D-06
      0.65144D+06            0.40176D-04           -0.71327D-05            0.18507D-05            0.12109D-05
      0.18463D+06            0.16975D-03           -0.30109D-04            0.77947D-05            0.50966D-05
      0.60279D+05            0.61851D-03           -0.10990D-03            0.28535D-04            0.18673D-04
      0.21782D+05            0.20209D-02           -0.35891D-03            0.92871D-04            0.60715D-04
      0.85039D+04            0.60481D-02           -0.10792D-02            0.28051D-03            0.18361D-03
      0.35312D+04            0.16779D-01           -0.30061D-02            0.77798D-03            0.50854D-03
      0.15429D+04            0.43124D-01           -0.78571D-02            0.20482D-02            0.13413D-02
      0.70408D+03            0.10143D+00           -0.18966D-01            0.49242D-02            0.32193D-02
      0.33332D+03            0.21244D+00           -0.42294D-01            0.11141D-01            0.73052D-02
      0.16200D+03            0.37863D+00           -0.84307D-01            0.22230D-01            0.14552D-01
      0.80669D+02            0.50000D+00           -0.13611D+00            0.37297D-01            0.24566D-01
      0.41053D+02            0.41355D+00           -0.15999D+00            0.44330D-01            0.29140D-01
      0.21137D+02            0.15430D+00           -0.34998D-01            0.13125D-01            0.89825D-02
      0.10291D+02            0.12462D-01            0.27121D+00           -0.10437D+00           -0.71018D-01
      0.53605D+01           -0.48712D-03            0.50000D+00           -0.21509D+00           -0.14913D+00
      0.27301D+01            0.94640D-04            0.32912D+00           -0.25360D+00           -0.18881D+00
      0.13321D+01           -0.15743D-04            0.51469D-01            0.17593D+00            0.14768D+00
      0.60211D+00            0.16819D-05           -0.14446D-02            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.26387D+00            1.0000000
  1  0  0  1  1
      0.83481D-01            1.0000000
  1  0  0  1  1
      0.44619D-01            1.0000000
  1  0  0  1  1
      0.17288D-01            1.0000000
  1  1  1  13  2
      0.15262D+05            0.28267D-04           -0.72248D-05
      0.36131D+04            0.25262D-03           -0.63770D-04
      0.11739D+04            0.14707D-02           -0.37642D-03
      0.44794D+03            0.66975D-02           -0.16985D-02
      0.18932D+03            0.24455D-01           -0.63233D-02
      0.88336D+02            0.71130D-01           -0.18328D-01
      0.42883D+02            0.17772D+00           -0.47815D-01
      0.21680D+02            0.34796D+00           -0.93750D-01
      0.11361D+02            0.48974D+00           -0.14804D+00
      0.62759D+01            0.50000D+00           -0.12851D+00
      0.34782D+01            0.34469D+00           -0.95205D-01
      0.19213D+01            0.12496D+00            0.19721D+00
      0.95271D+00            0.12448D-01            0.50000D+00
  1  1  1  1  1
      0.47126D+00            1.0000000
  1  1  1  1  1
      0.22594D+00            1.0000000
  1  1  1  1  1
      0.10385D+00            1.0000000
  1  1  1  1  1
      0.32500D-01            1.0000000
  1  2  2  4  1
      0.19140D+02            0.23270D-01
      0.55500D+01            0.10266D+00
      0.21400D+01            0.25901D+00
      0.84000D+00            0.50000D+00
  1  2  2  1  1
      0.30400D+00            1.0000000
  1  2  2  1  1
      0.10200D+00            1.0000000
  1  2  2  1  1
      0.33300D-01            1.0000000
  1  2  2  1  1
      0.10700D-01            1.0000000
  1  3  3  1  1
      1.280000D+00           1.0000000
  1  3  3  1  1
      0.320000D+00           1.0000000
  1  4  4  1  1
      0.480000D+00           1.0000000
# CALCIUM
Ca pc-4
 18
 1  0  0  20  4
      0.20167D+08            0.10539D-05           -0.18843D-06            0.48751D-07            0.29111D-07
      0.30351D+07            0.81309D-05           -0.14530D-05            0.37564D-06            0.22444D-06
      0.69461D+06            0.42434D-04           -0.75892D-05            0.19642D-05            0.11726D-05
      0.19793D+06            0.17792D-03           -0.31793D-04            0.82165D-05            0.49108D-05
      0.64976D+05            0.64350D-03           -0.11519D-03            0.29827D-04            0.17800D-04
      0.23610D+05            0.20865D-02           -0.37334D-03            0.96459D-04            0.57671D-04
      0.92711D+04            0.61954D-02           -0.11138D-02            0.28865D-03            0.17221D-03
      0.38726D+04            0.17050D-01           -0.30780D-02            0.79559D-03            0.47592D-03
      0.17022D+04            0.43487D-01           -0.79838D-02            0.20749D-02            0.12376D-02
      0.78120D+03            0.10161D+00           -0.19147D-01            0.49674D-02            0.29748D-02
      0.37192D+03            0.21172D+00           -0.42461D-01            0.11150D-01            0.66526D-02
      0.18179D+03            0.37661D+00           -0.84372D-01            0.22253D-01            0.13369D-01
      0.91023D+02            0.50000D+00           -0.13658D+00            0.37286D-01            0.22295D-01
      0.46566D+02            0.42108D+00           -0.16259D+00            0.45250D-01            0.27534D-01
      0.24086D+02            0.16393D+00           -0.42469D-01            0.15007D-01            0.87171D-02
      0.11716D+02            0.14536D-01            0.26751D+00           -0.10316D+00           -0.63007D-01
      0.61570D+01           -0.78634D-03            0.50000D+00           -0.21540D+00           -0.14079D+00
      0.31786D+01            0.22541D-03            0.33678D+00           -0.26203D+00           -0.17550D+00
      0.16046D+01           -0.70401D-04            0.57966D-01            0.16486D+00            0.12099D+00
      0.73095D+00            0.22792D-04           -0.57441D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.32737D+00            1.0000000
  1  0  0  1  1
      0.92397D-01            1.0000000
  1  0  0  1  1
      0.45765D-01            1.0000000
  1  0  0  1  1
      0.20442D-01            1.0000000
  1  1  1  13  2
      0.18335D+05            0.25662D-04           -0.67558D-05
      0.43181D+04            0.23192D-03           -0.60214D-04
      0.13961D+04            0.13635D-02           -0.35939D-03
      0.53100D+03            0.62536D-02           -0.16311D-02
      0.22462D+03            0.22845D-01           -0.60831D-02
      0.10466D+03            0.67958D-01           -0.18009D-01
      0.50670D+02            0.17221D+00           -0.47713D-01
      0.25608D+02            0.34377D+00           -0.95323D-01
      0.13475D+02            0.48796D+00           -0.15240D+00
      0.75708D+01            0.50000D+00           -0.13284D+00
      0.43043D+01            0.36748D+00           -0.11224D+00
      0.24186D+01            0.15514D+00            0.16643D+00
      0.12173D+01            0.18936D-01            0.50000D+00
  1  1  1  1  1
      0.60912D+00            1.0000000
  1  1  1  1  1
      0.30038D+00            1.0000000
  1  1  1  1  1
      0.14290D+00            1.0000000
  1  1  1  1  1
      0.44700D-01            1.0000000
  1  2  2  4  1
      0.39610D+02            0.11158D-01
      0.11610D+02            0.66221D-01
      0.43600D+01            0.20829D+00
      0.17040D+01            0.50000D+00
  1  2  2  1  1
      0.66300D+00            1.0000000
  1  2  2  1  1
      0.24600D+00            1.0000000
  1  2  2  1  1
      0.88200D-01            1.0000000
  1  2  2  1  1
      0.30000D-01            1.0000000
  1  3  3  1  1
      1.600000D+00           1.0000000
  1  3  3  1  1
      0.400000D+00           1.0000000
  1  4  4  1  1
      0.600000D+00           1.0000000
# GALLIUM
Ga pc-4
 22
 1  0  0  20  4
      0.41052D+08            0.12789D-05           -0.25092D-06            0.82591D-07            0.41333D-07
      0.61403D+07            0.99638D-05           -0.19539D-05            0.64362D-06            0.32218D-06
      0.13964D+07            0.52406D-04           -0.10285D-04            0.33843D-05            0.16935D-05
      0.39579D+06            0.22132D-03           -0.43403D-04            0.14302D-04            0.71602D-05
      0.12921D+06            0.80614D-03           -0.15837D-03            0.52099D-04            0.26067D-04
      0.46729D+05            0.26264D-02           -0.51596D-03            0.17013D-03            0.85187D-04
      0.18274D+05            0.78262D-02           -0.15459D-02            0.50863D-03            0.25447D-03
      0.76058D+04            0.21551D-01           -0.42829D-02            0.14150D-02            0.70876D-03
      0.33317D+04            0.54831D-01           -0.11127D-01            0.36710D-02            0.18370D-02
      0.15221D+04            0.12712D+00           -0.26695D-01            0.88872D-02            0.44564D-02
      0.72134D+03            0.25684D+00           -0.58541D-01            0.19571D-01            0.98074D-02
      0.35358D+03            0.42389D+00           -0.11051D+00            0.37907D-01            0.19084D-01
      0.17755D+03            0.50000D+00           -0.17006D+00            0.59732D-01            0.30102D-01
      0.90908D+02            0.33564D+00           -0.15455D+00            0.59425D-01            0.30400D-01
      0.46302D+02            0.82327D-01            0.52055D-01           -0.26544D-01           -0.14075D-01
      0.24806D+02            0.28899D-03            0.41885D+00           -0.21393D+00           -0.11294D+00
      0.13027D+02            0.13991D-02            0.50000D+00           -0.37973D+00           -0.21307D+00
      0.68781D+01           -0.70462D-03            0.19020D+00           -0.85929D-01           -0.46002D-01
      0.34124D+01            0.35198D-03            0.12721D-01            0.41323D+00            0.28022D+00
      0.17089D+01           -0.17935D-03           -0.24078D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.83675D+00            1.0000000
  1  0  0  1  1
      0.29269D+00            1.0000000
  1  0  0  1  1
      0.12679D+00            1.0000000
  1  0  0  1  1
      0.52992D-01            1.0000000
  1  1  1  15  3
      0.64182D+05            0.12936D-04           -0.40048D-05           -0.30415D-05
      0.15174D+05            0.11611D-03           -0.35927D-04           -0.27342D-04
      0.49238D+04            0.68209D-03           -0.21151D-03           -0.16067D-03
      0.18881D+04            0.31032D-02           -0.96388D-03           -0.73376D-03
      0.81004D+03            0.11536D-01           -0.36091D-02           -0.27440D-02
      0.37346D+03            0.37901D-01           -0.11971D-01           -0.91275D-02
      0.18044D+03            0.10304D+00           -0.33353D-01           -0.25439D-01
      0.90936D+02            0.23501D+00           -0.78574D-01           -0.60267D-01
      0.47034D+02            0.41066D+00           -0.14628D+00           -0.11254D+00
      0.25005D+02            0.50000D+00           -0.17988D+00           -0.13953D+00
      0.13436D+02            0.36845D+00           -0.10215D+00           -0.74649D-01
      0.72385D+01            0.12495D+00            0.20844D+00            0.19039D+00
      0.36789D+01            0.11097D-01            0.50000D+00            0.46959D+00
      0.18324D+01           -0.35076D-03            0.48939D+00            0.50000D+00
      0.88073D+00            0.11114D-03            0.21770D+00            0.98784D-01
  1  1  1  1  1
      0.36271D+00            1.0000000
  1  1  1  1  1
      0.15439D+00            1.0000000
  1  1  1  1  1
      0.64041D-01            1.0000000
  1  1  1  1  1
      0.24806D-01            1.0000000
  1  2  2  9  1
      0.89567D+03            0.21721D-03
      0.27204D+03            0.20735D-02
      0.10500D+03            0.11981D-01
      0.46740D+02            0.44524D-01
      0.23006D+02            0.12305D+00
      0.11442D+02            0.27383D+00
      0.58338D+01            0.42844D+00
      0.29520D+01            0.50000D+00
      0.14631D+01            0.46128D+00
  1  2  2  1  1
      0.70135D+00            1.0000000
  1  2  2  1  1
      0.32126D+00            1.0000000
  1  2  2  1  1
      0.13549D+00            1.0000000
  1  2  2  1  1
      0.56000D-01            1.0000000
  1  3  3  1  1
      5.250000D+00           1.0000000
  1  3  3  1  1
      1.550000D+00           1.0000000
  1  3  3  1  1
      0.450000D+00           1.0000000
  1  3  3  1  1
      0.182000D+00           1.0000000
  1  4  4  1  1
      1.400000D+00           1.0000000
  1  4  4  1  1
      0.350000D+00           1.0000000
  1  5  5  1  1
      0.520000D+00           1.0000000
# GERMANIUM
Ge pc-4
 22
 1  0  0  20  4
      0.42730D+08            0.13192D-05           -0.26266D-06            0.86852D-07            0.41807D-07
      0.64047D+07            0.10243D-04           -0.20386D-05            0.67445D-06            0.32466D-06
      0.14580D+07            0.53906D-04           -0.10736D-04            0.35491D-05            0.17084D-05
      0.41296D+06            0.22779D-03           -0.45337D-04            0.15004D-04            0.72223D-05
      0.13481D+06            0.82997D-03           -0.16546D-03            0.54691D-04            0.26326D-04
      0.48692D+05            0.27121D-02           -0.54078D-03            0.17906D-03            0.86198D-04
      0.19011D+05            0.80913D-02           -0.16220D-02            0.53630D-03            0.25818D-03
      0.79071D+04            0.22267D-01           -0.44930D-02            0.14905D-02            0.71766D-03
      0.34657D+04            0.56426D-01           -0.11629D-01            0.38564D-02            0.18573D-02
      0.15877D+04            0.12978D+00           -0.27707D-01            0.92630D-02            0.44641D-02
      0.75562D+03            0.25998D+00           -0.60301D-01            0.20276D-01            0.97836D-02
      0.37194D+03            0.42594D+00           -0.11318D+00            0.38995D-01            0.18863D-01
      0.18725D+03            0.50000D+00           -0.17376D+00            0.61506D-01            0.29889D-01
      0.95823D+02            0.33294D+00           -0.15575D+00            0.60114D-01            0.29475D-01
      0.48343D+02            0.78996D-01            0.63096D-01           -0.31478D-01           -0.15720D-01
      0.26115D+02           -0.99862D-03            0.43043D+00           -0.22373D+00           -0.11479D+00
      0.13799D+02            0.18047D-02            0.50000D+00           -0.38588D+00           -0.20818D+00
      0.73169D+01           -0.90316D-03            0.18644D+00           -0.73241D-01           -0.39828D-01
      0.35980D+01            0.45772D-03            0.12060D-01            0.43428D+00            0.29513D+00
      0.18137D+01           -0.24900D-03           -0.38400D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.90014D+00            1.0000000
  1  0  0  1  1
      0.35149D+00            1.0000000
  1  0  0  1  1
      0.15603D+00            1.0000000
  1  0  0  1  1
      0.66450D-01            1.0000000
  1  1  1  15  3
      0.71870D+05            0.11953D-04           -0.37552D-05           -0.27688D-05
      0.17045D+05            0.10693D-03           -0.33553D-04           -0.24825D-04
      0.55290D+04            0.63016D-03           -0.19828D-03           -0.14624D-03
      0.21159D+04            0.28864D-02           -0.90910D-03           -0.67277D-03
      0.90429D+03            0.10872D-01           -0.34505D-02           -0.25474D-02
      0.41410D+03            0.36342D-01           -0.11637D-01           -0.86256D-02
      0.19900D+03            0.10016D+00           -0.32871D-01           -0.24349D-01
      0.99853D+02            0.23110D+00           -0.78322D-01           -0.58430D-01
      0.51586D+02            0.40685D+00           -0.14690D+00           -0.10979D+00
      0.27480D+02            0.50000D+00           -0.18293D+00           -0.13827D+00
      0.14832D+02            0.37621D+00           -0.10963D+00           -0.77805D-01
      0.80320D+01            0.13360D+00            0.19620D+00            0.17579D+00
      0.41132D+01            0.13022D-01            0.49604D+00            0.46104D+00
      0.20730D+01           -0.41009D-03            0.50000D+00            0.50000D+00
      0.10113D+01            0.14321D-03            0.22692D+00            0.10547D+00
  1  1  1  1  1
      0.42781D+00            1.0000000
  1  1  1  1  1
      0.19145D+00            1.0000000
  1  1  1  1  1
      0.83340D-01            1.0000000
  1  1  1  1  1
      0.33751D-01            1.0000000
  1  2  2  9  1
      0.11432D+04            0.15283D-03
      0.34598D+03            0.15006D-02
      0.13423D+03            0.86580D-02
      0.60572D+02            0.33246D-01
      0.29285D+02            0.10472D+00
      0.14341D+02            0.24378D+00
      0.73033D+01            0.40818D+00
      0.37113D+01            0.50000D+00
      0.18551D+01            0.47406D+00
  1  2  2  1  1
      0.89798D+00            1.0000000
  1  2  2  1  1
      0.41538D+00            1.0000000
  1  2  2  1  1
      0.17385D+00            1.0000000
  1  2  2  1  1
      0.73000D-01            1.0000000
  1  3  3  1  1
      5.780000D+00           1.0000000
  1  3  3  1  1
      1.700000D+00           1.0000000
  1  3  3  1  1
      0.500000D+00           1.0000000
  1  3  3  1  1
      0.200000D+00           1.0000000
  1  4  4  1  1
      1.540000D+00           1.0000000
  1  4  4  1  1
      0.380000D+00           1.0000000
  1  5  5  1  1
      0.520000D+00           1.0000000
# ARSENIC
As pc-4
 22
 1  0  0  20  4
      0.50062D+08            0.11835D-05           -0.22108D-06            0.72474D-07            0.36411D-07
      0.74942D+07            0.92058D-05           -0.17189D-05            0.56394D-06            0.28335D-06
      0.17055D+07            0.48416D-04           -0.90469D-05            0.29647D-05            0.14894D-05
      0.48330D+06            0.20457D-03           -0.38197D-04            0.12537D-04            0.62993D-05
      0.15754D+06            0.74865D-03           -0.14002D-03            0.45872D-04            0.23045D-04
      0.56716D+05            0.24597D-02           -0.46005D-03            0.15109D-03            0.75925D-04
      0.22052D+05            0.73946D-02           -0.13901D-02            0.45547D-03            0.22882D-03
      0.91239D+04            0.20530D-01           -0.38823D-02            0.12775D-02            0.64212D-03
      0.39792D+04            0.52479D-01           -0.10124D-01            0.33254D-02            0.16713D-02
      0.18171D+04            0.12151D+00           -0.24222D-01            0.80317D-02            0.40409D-02
      0.86548D+03            0.24496D+00           -0.52760D-01            0.17549D-01            0.88350D-02
      0.42775D+03            0.40872D+00           -0.99960D-01            0.34122D-01            0.17233D-01
      0.21694D+03            0.50000D+00           -0.15648D+00            0.54511D-01            0.27622D-01
      0.11241D+03            0.36553D+00           -0.15694D+00            0.59619D-01            0.30530D-01
      0.58715D+02            0.10946D+00            0.80392D-02           -0.69735D-02           -0.37334D-02
      0.30989D+02            0.49541D-02            0.36498D+00           -0.18128D+00           -0.96584D-01
      0.16233D+02            0.83481D-03            0.50000D+00           -0.36136D+00           -0.20311D+00
      0.85915D+01           -0.47685D-03            0.22060D+00           -0.13948D+00           -0.81337D-01
      0.43244D+01            0.26080D-03            0.19687D-01            0.34302D+00            0.23792D+00
      0.22033D+01           -0.14033D-03           -0.53398D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.10957D+01            1.0000000
  1  0  0  1  1
      0.41542D+00            1.0000000
  1  0  0  1  1
      0.18822D+00            1.0000000
  1  0  0  1  1
      0.80706D-01            1.0000000
  1  1  1  15  3
      0.70183D+05            0.14221D-04           -0.44834D-05           -0.33091D-05
      0.16594D+05            0.12773D-03           -0.40369D-04           -0.29916D-04
      0.53804D+04            0.75122D-03           -0.23727D-03           -0.17518D-03
      0.20626D+04            0.34156D-02           -0.10838D-02           -0.80346D-03
      0.88531D+03            0.12634D-01           -0.40284D-02           -0.29774D-02
      0.41043D+03            0.40755D-01           -0.13165D-01           -0.97785D-02
      0.19962D+03            0.10938D+00           -0.36144D-01           -0.26812D-01
      0.10144D+03            0.24458D+00           -0.83855D-01           -0.62744D-01
      0.52948D+02            0.42083D+00           -0.15324D+00           -0.11475D+00
      0.28463D+02            0.50000D+00           -0.18422D+00           -0.13988D+00
      0.15568D+02            0.36423D+00           -0.10194D+00           -0.70870D-01
      0.85785D+01            0.12917D+00            0.20347D+00            0.18316D+00
      0.44369D+01            0.13502D-01            0.50000D+00            0.47637D+00
      0.22722D+01           -0.63560D-03            0.49933D+00            0.50000D+00
      0.11326D+01            0.25160D-03            0.22450D+00            0.10734D+00
  1  1  1  1  1
      0.50258D+00            1.0000000
  1  1  1  1  1
      0.23025D+00            1.0000000
  1  1  1  1  1
      0.10119D+00            1.0000000
  1  1  1  1  1
      0.41818D-01            1.0000000
  1  2  2  9  1
      0.13163D+04            0.13294D-03
      0.39765D+03            0.13226D-02
      0.15442D+03            0.76777D-02
      0.69551D+02            0.30494D-01
      0.33306D+02            0.99649D-01
      0.16283D+02            0.23492D+00
      0.83003D+01            0.40194D+00
      0.42279D+01            0.50000D+00
      0.21236D+01            0.47162D+00
  1  2  2  1  1
      0.10337D+01            1.0000000
  1  2  2  1  1
      0.47975D+00            1.0000000
  1  2  2  1  1
      0.19243D+00            1.0000000
  1  2  2  1  1
      0.80000D-01            1.0000000
  1  3  3  1  1
      6.360000D+00           1.0000000
  1  3  3  1  1
      1.870000D+00           1.0000000
  1  3  3  1  1
      0.550000D+00           1.0000000
  1  3  3  1  1
      0.220000D+00           1.0000000
  1  4  4  1  1
      1.690000D+00           1.0000000
  1  4  4  1  1
      0.420000D+00           1.0000000
  1  5  5  1  1
      0.630000D+00           1.0000000
# SELENIUM
Se pc-4
 22
 1  0  0  20  4
      0.58887D+08            0.10370D-05           -0.18991D-06            0.63053D-07            0.31788D-07
      0.88051D+07            0.80629D-05           -0.14758D-05            0.49048D-06            0.24724D-06
      0.20052D+07            0.42424D-04           -0.77715D-05            0.25792D-05            0.13004D-05
      0.56763D+06            0.17941D-03           -0.32840D-04            0.10919D-04            0.55038D-05
      0.18530D+06            0.65367D-03           -0.11985D-03            0.39761D-04            0.20048D-04
      0.66916D+05            0.21390D-02           -0.39209D-03            0.13046D-03            0.65759D-04
      0.26093D+05            0.64111D-02           -0.11809D-02            0.39179D-03            0.19757D-03
      0.10833D+05            0.17734D-01           -0.32827D-02            0.10943D-02            0.55166D-03
      0.47426D+04            0.45351D-01           -0.85489D-02            0.28421D-02            0.14339D-02
      0.21698D+04            0.10617D+00           -0.20599D-01            0.69153D-02            0.34886D-02
      0.10313D+04            0.22004D+00           -0.45767D-01            0.15387D-01            0.77777D-02
      0.50584D+03            0.38468D+00           -0.89990D-01            0.31021D-01            0.15700D-01
      0.25421D+03            0.50000D+00           -0.14671D+00            0.51486D-01            0.26207D-01
      0.13070D+03            0.39871D+00           -0.16232D+00            0.61739D-01            0.31607D-01
      0.68108D+02            0.13789D+00           -0.22081D-01            0.61387D-02            0.32812D-02
      0.34853D+02            0.94111D-02            0.33454D+00           -0.16623D+00           -0.89250D-01
      0.18069D+02            0.31410D-03            0.50000D+00           -0.35715D+00           -0.20072D+00
      0.94975D+01           -0.26619D-03            0.23288D+00           -0.16252D+00           -0.97867D-01
      0.47991D+01            0.17134D-03            0.22253D-01            0.32084D+00            0.22819D+00
      0.24539D+01           -0.99504D-04           -0.45566D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.12283D+01            1.0000000
  1  0  0  1  1
      0.48979D+00            1.0000000
  1  0  0  1  1
      0.22350D+00            1.0000000
  1  0  0  1  1
      0.96000D-01            1.0000000
  1  1  1  15  3
      0.79850D+05            0.12529D-04           -0.40052D-05           -0.28959D-05
      0.18951D+05            0.11171D-03           -0.35742D-04           -0.25928D-04
      0.61646D+04            0.65414D-03           -0.20946D-03           -0.15149D-03
      0.23668D+04            0.29789D-02           -0.95676D-03           -0.69430D-03
      0.10143D+04            0.11167D-01           -0.36078D-02           -0.26122D-02
      0.46654D+03            0.36948D-01           -0.12071D-01           -0.87763D-02
      0.22535D+03            0.10122D+00           -0.33843D-01           -0.24598D-01
      0.11369D+03            0.23214D+00           -0.80388D-01           -0.58884D-01
      0.59015D+02            0.40877D+00           -0.15047D+00           -0.11049D+00
      0.31585D+02            0.50000D+00           -0.18727D+00           -0.13926D+00
      0.17190D+02            0.37545D+00           -0.11112D+00           -0.76747D-01
      0.94217D+01            0.13665D+00            0.19262D+00            0.17293D+00
      0.48821D+01            0.14629D-01            0.49566D+00            0.46856D+00
      0.25189D+01           -0.59757D-03            0.50000D+00            0.50000D+00
      0.12699D+01            0.24417D-03            0.22378D+00            0.90020D-01
  1  1  1  1  1
      0.58164D+00            1.0000000
  1  1  1  1  1
      0.26697D+00            1.0000000
  1  1  1  1  1
      0.11671D+00            1.0000000
  1  1  1  1  1
      0.48274D-01            1.0000000
  1  2  2  9  1
      0.14786D+04            0.12463D-03
      0.44692D+03            0.12421D-02
      0.17415D+03            0.72116D-02
      0.78511D+02            0.29167D-01
      0.37520D+02            0.97039D-01
      0.18450D+02            0.22907D+00
      0.94967D+01            0.39708D+00
      0.49116D+01            0.50000D+00
      0.25199D+01            0.47765D+00
  1  2  2  1  1
      0.12559D+01            1.0000000
  1  2  2  1  1
      0.59978D+00            1.0000000
  1  2  2  1  1
      0.25295D+00            1.0000000
  1  2  2  1  1
      0.10500D+00            1.0000000
  1  3  3  1  1
      6.990000D+00           1.0000000
  1  3  3  1  1
      2.060000D+00           1.0000000
  1  3  3  1  1
      0.610000D+00           1.0000000
  1  3  3  1  1
      0.242000D+00           1.0000000
  1  4  4  1  1
      1.860000D+00           1.0000000
  1  4  4  1  1
      0.460000D+00           1.0000000
  1  5  5  1  1
      0.700000D+00           1.0000000
# BROMINE
Br pc-4
 22
 1  0  0  20  4
      0.67476D+08            0.95481D-06           -0.17088D-06            0.54932D-07            0.28664D-07
      0.10151D+08            0.73702D-05           -0.13184D-05            0.42427D-06            0.22136D-06
      0.23220D+07            0.38502D-04           -0.68925D-05            0.22147D-05            0.11557D-05
      0.66095D+06            0.16176D-03           -0.28937D-04            0.93163D-05            0.48604D-05
      0.21660D+06            0.58674D-03           -0.10512D-03            0.33763D-04            0.17620D-04
      0.78562D+05            0.19072D-02           -0.34162D-03            0.11007D-03            0.57421D-04
      0.30791D+05            0.56820D-02           -0.10223D-02            0.32830D-03            0.17135D-03
      0.12834D+05            0.15705D-01           -0.28378D-02            0.91599D-03            0.47790D-03
      0.56261D+04            0.40356D-01           -0.74117D-02            0.23847D-02            0.12452D-02
      0.25729D+04            0.95470D-01           -0.17998D-01            0.58465D-02            0.30524D-02
      0.12205D+04            0.20208D+00           -0.40534D-01            0.13174D-01            0.68915D-02
      0.59637D+03            0.36522D+00           -0.81683D-01            0.27184D-01            0.14236D-01
      0.29911D+03            0.50000D+00           -0.13724D+00            0.46397D-01            0.24432D-01
      0.15373D+03            0.43751D+00           -0.16606D+00            0.60396D-01            0.31978D-01
      0.80216D+02            0.18015D+00           -0.55948D-01            0.19760D-01            0.10701D-01
      0.40066D+02            0.17849D-01            0.28847D+00           -0.13604D+00           -0.75484D-01
      0.20827D+02           -0.72489D-03            0.50000D+00           -0.33015D+00           -0.19149D+00
      0.11009D+02            0.23991D-03            0.27081D+00           -0.20723D+00           -0.12916D+00
      0.56925D+01           -0.83796D-04            0.34489D-01            0.24618D+00            0.17861D+00
      0.29069D+01            0.32601D-04           -0.38920D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.14466D+01            1.0000000
  1  0  0  1  1
      0.56731D+00            1.0000000
  1  0  0  1  1
      0.26161D+00            1.0000000
  1  0  0  1  1
      0.11239D+00            1.0000000
  1  1  1  15  3
      0.94089D+05            0.10486D-04           -0.33151D-05           -0.23699D-05
      0.22223D+05            0.94337D-04           -0.29758D-04           -0.21354D-04
      0.72027D+04            0.55675D-03           -0.17625D-03           -0.12604D-03
      0.27524D+04            0.25680D-02           -0.81302D-03           -0.58357D-03
      0.11720D+04            0.98167D-02           -0.31334D-02           -0.22433D-02
      0.53438D+03            0.33166D-01           -0.10672D-01           -0.76750D-02
      0.25710D+03            0.92180D-01           -0.30394D-01           -0.21845D-01
      0.12926D+03            0.21638D+00           -0.73625D-01           -0.53344D-01
      0.67012D+02            0.39088D+00           -0.14158D+00           -0.10283D+00
      0.35844D+02            0.50000D+00           -0.18521D+00           -0.13638D+00
      0.19440D+02            0.39868D+00           -0.12544D+00           -0.87241D-01
      0.10591D+02            0.15526D+00            0.16365D+00            0.14807D+00
      0.55071D+01            0.18006D-01            0.47374D+00            0.44760D+00
      0.28621D+01           -0.52009D-03            0.50000D+00            0.50000D+00
      0.14568D+01            0.23157D-03            0.23222D+00            0.10625D+00
  1  1  1  1  1
      0.68481D+00            1.0000000
  1  1  1  1  1
      0.31755D+00            1.0000000
  1  1  1  1  1
      0.13895D+00            1.0000000
  1  1  1  1  1
      0.57962D-01            1.0000000
  1  2  2  9  1
      0.15631D+04            0.12889D-03
      0.47356D+03            0.12795D-02
      0.18488D+03            0.74049D-02
      0.83567D+02            0.29762D-01
      0.40149D+02            0.98082D-01
      0.19822D+02            0.23174D+00
      0.10224D+02            0.40004D+00
      0.53037D+01            0.50000D+00
      0.27422D+01            0.46537D+00
  1  2  2  1  1
      0.13803D+01            1.0000000
  1  2  2  1  1
      0.66453D+00            1.0000000
  1  2  2  1  1
      0.27338D+00            1.0000000
  1  2  2  1  1
      0.11400D+00            1.0000000
  1  3  3  1  1
      7.690000D+00           1.0000000
  1  3  3  1  1
      2.260000D+00           1.0000000
  1  3  3  1  1
      0.670000D+00           1.0000000
  1  3  3  1  1
      0.266000D+00           1.0000000
  1  4  4  1  1
      2.040000D+00           1.0000000
  1  4  4  1  1
      0.510000D+00           1.0000000
  1  5  5  1  1
      0.770000D+00           1.0000000
# KRYPTON
Kr pc-4
 22
 1  0  0  20  4
      0.81180D+08            0.83286D-06           -0.14711D-06            0.45988D-07            0.24559D-07
      0.12174D+08            0.64608D-05           -0.11408D-05            0.35698D-06            0.19061D-06
      0.27750D+07            0.33921D-04           -0.59927D-05            0.18726D-05            0.10001D-05
      0.78719D+06            0.14313D-03           -0.25273D-04            0.79124D-05            0.42244D-05
      0.25719D+06            0.52131D-03           -0.92161D-04            0.28786D-04            0.15376D-04
      0.92980D+05            0.17029D-02           -0.30106D-03            0.94320D-04            0.50353D-04
      0.36316D+05            0.50998D-02           -0.90494D-03            0.28262D-03            0.15099D-03
      0.15086D+05            0.14176D-01           -0.25264D-02            0.79282D-03            0.42327D-03
      0.65926D+04            0.36671D-01           -0.66291D-02            0.20738D-02            0.11084D-02
      0.30072D+04            0.87545D-01           -0.16218D-01            0.51193D-02            0.27347D-02
      0.14229D+04            0.18835D+00           -0.36886D-01            0.11647D-01            0.62360D-02
      0.69338D+03            0.34917D+00           -0.75730D-01            0.24443D-01            0.13094D-01
      0.34715D+03            0.50000D+00           -0.13072D+00            0.42823D-01            0.23076D-01
      0.17790D+03            0.47325D+00           -0.16969D+00            0.59390D-01            0.32146D-01
      0.92353D+02            0.22200D+00           -0.82174D-01            0.29311D-01            0.16219D-01
      0.45341D+02            0.27298D-01            0.25094D+00           -0.11350D+00           -0.64491D-01
      0.23694D+02           -0.18715D-02            0.50000D+00           -0.30906D+00           -0.18282D+00
      0.12583D+02            0.85263D-03            0.30737D+00           -0.23963D+00           -0.15312D+00
      0.66050D+01           -0.39627D-03            0.48594D-01            0.19059D+00            0.14123D+00
      0.33541D+01            0.18344D-03           -0.32884D-04            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.16622D+01            1.0000000
  1  0  0  1  1
      0.65406D+00            1.0000000
  1  0  0  1  1
      0.30317D+00            1.0000000
  1  0  0  1  1
      0.12970D+00            1.0000000
  1  1  1  15  3
      0.97285D+05            0.10975D-04           -0.35054D-05           -0.24940D-05
      0.23066D+05            0.97926D-04           -0.31233D-04           -0.22303D-04
      0.75083D+04            0.57287D-03           -0.18325D-03           -0.13042D-03
      0.28842D+04            0.26135D-02           -0.83663D-03           -0.59763D-03
      0.12350D+04            0.98929D-02           -0.31912D-02           -0.22739D-02
      0.56595D+03            0.33181D-01           -0.10798D-01           -0.77286D-02
      0.27329D+03            0.91962D-01           -0.30650D-01           -0.21929D-01
      0.13778D+03            0.21555D+00           -0.74198D-01           -0.53526D-01
      0.71579D+02            0.39031D+00           -0.14293D+00           -0.10341D+00
      0.38347D+02            0.50000D+00           -0.18757D+00           -0.13764D+00
      0.20853D+02            0.39972D+00           -0.12747D+00           -0.88167D-01
      0.11399D+02            0.15743D+00            0.16250D+00            0.14787D+00
      0.59444D+01            0.18709D-01            0.47704D+00            0.45575D+00
      0.31150D+01           -0.57875D-03            0.50000D+00            0.50000D+00
      0.16060D+01            0.26790D-03            0.22892D+00            0.10108D+00
  1  1  1  1  1
      0.78222D+00            1.0000000
  1  1  1  1  1
      0.36532D+00            1.0000000
  1  1  1  1  1
      0.16062D+00            1.0000000
  1  1  1  1  1
      0.67693D-01            1.0000000
  1  2  2  9  1
      0.22197D+04            0.70314D-04
      0.67013D+03            0.71349D-03
      0.26309D+03            0.42479D-02
      0.11669D+03            0.19439D-01
      0.54856D+02            0.68495D-01
      0.27847D+02            0.16348D+00
      0.14745D+02            0.31872D+00
      0.78827D+01            0.45606D+00
      0.41703D+01            0.50000D+00
  1  2  2  1  1
      0.21682D+01            1.0000000
  1  2  2  1  1
      0.11032D+01            1.0000000
  1  2  2  1  1
      0.52379D+00            1.0000000
  1  2  2  1  1
      0.21800D+00            1.0000000
  1  3  3  1  1
      8.460000D+00           1.0000000
  1  3  3  1  1
      2.490000D+00           1.0000000
  1  3  3  1  1
      0.730000D+00           1.0000000
  1  3  3  1  1
      0.293000D+00           1.0000000
  1  4  4  1  1
      2.250000D+00           1.0000000
  1  4  4  1  1
      0.560000D+00           1.0000000
  1  5  5  1  1
      0.840000D+00           1.0000000
# SCANDIUM (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Sc pc-4
 26
 1  0  0  20  4
      0.25769D+08            0.88517D-06           -0.15726D-06            0.41645D-07            0.25079D-07
      0.38566D+07            0.68863D-05           -0.12231D-05            0.32366D-06            0.19502D-06
      0.87755D+06            0.36234D-04           -0.64386D-05            0.17056D-05            0.10269D-05
      0.24856D+06            0.15317D-03           -0.27205D-04            0.71970D-05            0.43378D-05
      0.81115D+05            0.55854D-03           -0.99318D-04            0.26320D-04            0.15842D-04
      0.29298D+05            0.18263D-02           -0.32479D-03            0.85903D-04            0.51792D-04
      0.11434D+05            0.54718D-02           -0.97663D-03            0.25902D-03            0.15586D-03
      0.47461D+04            0.15210D-01           -0.27273D-02            0.72165D-03            0.43529D-03
      0.20725D+04            0.39272D-01           -0.71440D-02            0.18995D-02            0.11428D-02
      0.94468D+03            0.93226D-01           -0.17395D-01            0.46196D-02            0.27893D-02
      0.44638D+03            0.19865D+00           -0.39210D-01            0.10527D-01            0.63362D-02
      0.21660D+03            0.36246D+00           -0.79642D-01            0.21496D-01            0.13018D-01
      0.10791D+03            0.50000D+00           -0.13219D+00            0.36831D-01            0.22222D-01
      0.54929D+02            0.44617D+00           -0.16583D+00            0.47283D-01            0.28967D-01
      0.28274D+02            0.18983D+00           -0.60619D-01            0.20542D-01            0.12259D-01
      0.13616D+02            0.19545D-01            0.24676D+00           -0.96589D-01           -0.59607D-01
      0.71461D+01           -0.13863D-02            0.50000D+00           -0.22171D+00           -0.14570D+00
      0.36831D+01            0.49449D-03            0.34951D+00           -0.27020D+00           -0.18327D+00
      0.18568D+01           -0.18800D-03            0.62067D-01            0.15932D+00            0.11927D+00
      0.85209D+00            0.71141D-04           -0.57556D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.38325D+00            1.0000000
  1  0  0  1  1
      0.11311D+00            1.0000000
  1  0  0  1  1
      0.54150D-01            1.0000000
  1  0  0  1  1
      0.23402D-01            1.0000000
  1  1  1  13  2
      0.20634D+05            0.24733D-04           -0.66763D-05
      0.48812D+04            0.22149D-03           -0.59040D-04
      0.15853D+04            0.12924D-02           -0.34935D-03
      0.60557D+03            0.58877D-02           -0.15766D-02
      0.25759D+03            0.21363D-01           -0.58344D-02
      0.12043D+03            0.63902D-01           -0.17390D-01
      0.58501D+02            0.16252D+00           -0.46174D-01
      0.29668D+02            0.32850D+00           -0.93714D-01
      0.15644D+02            0.47662D+00           -0.15217D+00
      0.87674D+01            0.50000D+00           -0.13924D+00
      0.49651D+01            0.37009D+00           -0.11332D+00
      0.27853D+01            0.15420D+00            0.17037D+00
      0.14061D+01            0.18727D-01            0.50000D+00
  1  1  1  1  1
      0.70874D+00            1.0000000
  1  1  1  1  1
      0.35232D+00            1.0000000
  1  1  1  1  1
      0.16789D+00            1.0000000
  1  1  1  1  1
      0.52000D-01            1.0000000
  1  2  2  8  1
      0.25868D+03            0.31493D-03
      0.78394D+02            0.27790D-02
      0.29814D+02            0.15446D-01
      0.12518D+02            0.55923D-01
      0.62270D+01            0.11318D+00
      0.32114D+01            0.24500D+00
      0.16553D+01            0.39001D+00
      0.83417D+00            0.50000D+00
  1  2  2  1  1
      0.40352D+00            1.0000000
  1  2  2  1  1
      0.19013D+00            1.0000000
  1  2  2  1  1
      0.85367D-01            1.0000000
  1  2  2  1  1
      0.35225D-01            1.0000000
  1  3  3  1  1
     10.891000D+00           1.0000000
  1  3  3  1  1
      3.403000D+00           1.0000000
  1  3  3  1  1
      1.261000D+00           1.0000000
  1  3  3  1  1
      0.525000D+00           1.0000000
  1  3  3  1  1
      0.219000D+00           1.0000000
  1  4  4  1  1
      5.882000D+00           1.0000000
  1  4  4  1  1
      1.471000D+00           1.0000000
  1  4  4  1  1
      0.368000D+00           1.0000000
  1  5  5  1  1
      3.177000D+00           1.0000000
  1  5  5  1  1
      0.706000D+00           1.0000000
  1  6  6  1  1
      1.609000D+00           1.0000000
# TITANIUM (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Ti pc-4
 26
 1  0  0  20  4
      0.27799D+08            0.90528D-06           -0.16174D-06            0.43321D-07            0.25847D-07
      0.41574D+07            0.70498D-05           -0.12590D-05            0.33722D-06            0.20130D-06
      0.94567D+06            0.37098D-04           -0.66297D-05            0.17757D-05            0.10592D-05
      0.26788D+06            0.15678D-03           -0.27999D-04            0.74996D-05            0.44779D-05
      0.87437D+05            0.57145D-03           -0.10220D-03            0.27375D-04            0.16325D-04
      0.31589D+05            0.18681D-02           -0.33404D-03            0.89487D-04            0.53447D-04
      0.12326D+05            0.56009D-02           -0.10056D-02            0.26946D-03            0.16066D-03
      0.51134D+04            0.15581D-01           -0.28096D-02            0.75338D-03            0.45015D-03
      0.22316D+04            0.40221D-01           -0.73642D-02            0.19775D-02            0.11789D-02
      0.10172D+04            0.95267D-01           -0.17891D-01            0.48186D-02            0.28820D-02
      0.48126D+03            0.20184D+00           -0.40186D-01            0.10893D-01            0.64973D-02
      0.23415D+03            0.36556D+00           -0.81046D-01            0.22227D-01            0.13335D-01
      0.11698D+03            0.50000D+00           -0.13406D+00            0.37679D-01            0.22538D-01
      0.59729D+02            0.44158D+00           -0.16612D+00            0.48486D-01            0.29429D-01
      0.30816D+02            0.18517D+00           -0.57468D-01            0.19073D-01            0.11286D-01
      0.14818D+02            0.18455D-01            0.26234D+00           -0.10333D+00           -0.63419D-01
      0.77800D+01           -0.13732D-02            0.50000D+00           -0.23171D+00           -0.15144D+00
      0.40558D+01            0.49582D-03            0.33378D+00           -0.26349D+00           -0.17749D+00
      0.20870D+01           -0.18695D-03            0.58525D-01            0.17416D+00            0.13003D+00
      0.95542D+00            0.67650D-04           -0.97517D-04            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.43154D+00            1.0000000
  1  0  0  1  1
      0.13157D+00            1.0000000
  1  0  0  1  1
      0.61279D-01            1.0000000
  1  0  0  1  1
      0.25948D-01            1.0000000
  1  1  1  13  2
      0.24009D+05            0.22187D-04           -0.62776D-05
      0.56843D+04            0.19857D-03           -0.55488D-04
      0.18458D+04            0.11608D-02           -0.32888D-03
      0.70526D+03            0.52924D-02           -0.14855D-02
      0.30077D+03            0.19192D-01           -0.54926D-02
      0.14044D+03            0.58517D-01           -0.16693D-01
      0.68110D+02            0.15055D+00           -0.44775D-01
      0.34527D+02            0.31012D+00           -0.92880D-01
      0.18190D+02            0.46258D+00           -0.15393D+00
      0.10133D+02            0.50000D+00           -0.14944D+00
      0.57021D+01            0.37276D+00           -0.11628D+00
      0.31919D+01            0.15383D+00            0.16989D+00
      0.16292D+01            0.18995D-01            0.50000D+00
  1  1  1  1  1
      0.82504D+00            1.0000000
  1  1  1  1  1
      0.41016D+00            1.0000000
  1  1  1  1  1
      0.19527D+00            1.0000000
  1  1  1  1  1
      0.61000D-01            1.0000000
  1  2  2  8  1
      0.30048D+03            0.31253D-03
      0.91092D+02            0.27915D-02
      0.34673D+02            0.15674D-01
      0.14554D+02            0.58776D-01
      0.70481D+01            0.12875D+00
      0.35655D+01            0.27443D+00
      0.18133D+01            0.42101D+00
      0.91299D+00            0.50000D+00
  1  2  2  1  1
      0.45282D+00            1.0000000
  1  2  2  1  1
      0.21972D+00            1.0000000
  1  2  2  1  1
      0.10222D+00            1.0000000
  1  2  2  1  1
      0.44281D-01            1.0000000
  1  3  3  1  1
     11.980000D+00           1.0000000
  1  3  3  1  1
      3.744000D+00           1.0000000
  1  3  3  1  1
      1.387000D+00           1.0000000
  1  3  3  1  1
      0.578000D+00           1.0000000
  1  3  3  1  1
      0.241000D+00           1.0000000
  1  4  4  1  1
      6.471000D+00           1.0000000
  1  4  4  1  1
      1.618000D+00           1.0000000
  1  4  4  1  1
      0.404000D+00           1.0000000
  1  5  5  1  1
      3.494000D+00           1.0000000
  1  5  5  1  1
      0.776000D+00           1.0000000
  1  6  6  1  1
      1.770000D+00           1.0000000
# VANADIUM (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
V pc-4
 26
 1  0  0  20  4
      0.19190D+08            0.16101D-05           -0.30993D-06            0.99100D-07            0.48903D-07
      0.28722D+07            0.12528D-04           -0.24102D-05            0.77198D-06            0.38085D-06
      0.65338D+06            0.65942D-04           -0.12698D-04            0.40571D-05            0.20023D-05
      0.18504D+06            0.27874D-03           -0.53626D-04            0.17190D-04            0.84797D-05
      0.60380D+05            0.10158D-02           -0.19583D-03            0.62525D-04            0.30862D-04
      0.21810D+05            0.33162D-02           -0.63929D-03            0.20517D-03            0.10120D-03
      0.85119D+04            0.98992D-02           -0.19203D-02            0.61289D-03            0.30258D-03
      0.35336D+04            0.27271D-01           -0.53274D-02            0.17142D-02            0.84553D-03
      0.15433D+04            0.69065D-01           -0.13821D-01            0.44206D-02            0.21838D-02
      0.70282D+03            0.15788D+00           -0.32860D-01            0.10668D-01            0.52656D-02
      0.33167D+03            0.30922D+00           -0.70818D-01            0.22934D-01            0.11354D-01
      0.16211D+03            0.47659D+00           -0.12677D+00            0.42578D-01            0.21078D-01
      0.81150D+02            0.50000D+00           -0.18114D+00            0.61384D-01            0.30638D-01
      0.41285D+02            0.27442D+00           -0.12159D+00            0.47527D-01            0.23725D-01
      0.20165D+02            0.45422D-01            0.14737D+00           -0.70517D-01           -0.35652D-01
      0.10721D+02           -0.26762D-02            0.50000D+00           -0.25024D+00           -0.13230D+00
      0.55372D+01            0.14416D-02            0.46502D+00           -0.37823D+00           -0.20944D+00
      0.28480D+01           -0.74508D-03            0.12797D+00            0.13724D-01            0.10124D-01
      0.14375D+01            0.40418D-03            0.24358D-02            0.50000D+00            0.35830D+00
      0.71877D+00           -0.21310D-03            0.97961D-03            0.48003D+00            0.50000D+00
  1  0  0  1  1
      0.35237D+00            1.0000000
  1  0  0  1  1
      0.13819D+00            1.0000000
  1  0  0  1  1
      0.60931D-01            1.0000000
  1  0  0  1  1
      0.25841D-01            1.0000000
  1  1  1  13  2
      0.27054D+05            0.21098D-04           -0.60788D-05
      0.64077D+04            0.18861D-03           -0.53763D-04
      0.20827D+04            0.11008D-02           -0.31762D-03
      0.79706D+03            0.50070D-02           -0.14335D-02
      0.34070D+03            0.18155D-01           -0.52912D-02
      0.15906D+03            0.55850D-01           -0.16256D-01
      0.77173D+02            0.14443D+00           -0.43727D-01
      0.39161D+02            0.30059D+00           -0.92025D-01
      0.20626D+02            0.45684D+00           -0.15431D+00
      0.11448D+02            0.50000D+00           -0.15471D+00
      0.64292D+01            0.37249D+00           -0.11562D+00
      0.35982D+01            0.15212D+00            0.17292D+00
      0.18417D+01            0.18688D-01            0.50000D+00
  1  1  1  1  1
      0.93346D+00            1.0000000
  1  1  1  1  1
      0.46450D+00            1.0000000
  1  1  1  1  1
      0.22078D+00            1.0000000
  1  1  1  1  1
      0.69000D-01            1.0000000
  1  2  2  8  1
      0.34822D+03            0.30548D-03
      0.10567D+03            0.27541D-02
      0.40282D+02            0.15594D-01
      0.17052D+02            0.58320D-01
      0.83005D+01            0.13125D+00
      0.41973D+01            0.27981D+00
      0.21442D+01            0.42596D+00
      0.10879D+01            0.50000D+00
  1  2  2  1  1
      0.54367D+00            1.0000000
  1  2  2  1  1
      0.26419D+00            1.0000000
  1  2  2  1  1
      0.12289D+00            1.0000000
  1  2  2  1  1
      0.53242D-01            1.0000000
  1  3  3  1  1
     13.178000D+00           1.0000000
  1  3  3  1  1
      4.118000D+00           1.0000000
  1  3  3  1  1
      1.525000D+00           1.0000000
  1  3  3  1  1
      0.636000D+00           1.0000000
  1  3  3  1  1
      0.265000D+00           1.0000000
  1  4  4  1  1
      7.118000D+00           1.0000000
  1  4  4  1  1
      1.779000D+00           1.0000000
  1  4  4  1  1
      0.445000D+00           1.0000000
  1  5  5  1  1
      3.844000D+00           1.0000000
  1  5  5  1  1
      0.854000D+00           1.0000000
  1  6  6  1  1
      1.947000D+00           1.0000000
# CHROMIUM (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Cr pc-4
 26
 1  0  0  20  4
      0.21431D+08            0.15439D-05           -0.29715D-06            0.90261D-07            0.47633D-07
      0.32086D+07            0.12017D-04           -0.23115D-05            0.70304D-06            0.37089D-06
      0.72981D+06            0.63207D-04           -0.12169D-04            0.36944D-05            0.19499D-05
      0.20699D+06            0.26644D-03           -0.51252D-04            0.15598D-04            0.82279D-05
      0.67612D+05            0.97125D-03           -0.18720D-03            0.56802D-04            0.29985D-04
      0.24395D+05            0.31818D-02           -0.61329D-03            0.18682D-03            0.98533D-04
      0.94966D+04            0.95418D-02           -0.18503D-02            0.56140D-03            0.29643D-03
      0.39314D+04            0.26379D-01           -0.51514D-02            0.15729D-02            0.82958D-03
      0.17140D+04            0.66931D-01           -0.13384D-01            0.40706D-02            0.21507D-02
      0.77995D+03            0.15338D+00           -0.31889D-01            0.98208D-02            0.51826D-02
      0.36780D+03            0.30215D+00           -0.69022D-01            0.21271D-01            0.11264D-01
      0.17940D+03            0.47073D+00           -0.12486D+00            0.39741D-01            0.21032D-01
      0.89477D+02            0.50000D+00           -0.18027D+00            0.58338D-01            0.31154D-01
      0.45280D+02            0.27614D+00           -0.12263D+00            0.45016D-01            0.24003D-01
      0.21907D+02            0.44871D-01            0.15393D+00           -0.69080D-01           -0.37312D-01
      0.11619D+02           -0.29007D-02            0.50000D+00           -0.24277D+00           -0.13767D+00
      0.60078D+01            0.14818D-02            0.45020D+00           -0.35326D+00           -0.20919D+00
      0.30893D+01           -0.72471D-03            0.11664D+00            0.46845D-01            0.32002D-01
      0.15110D+01            0.37012D-03            0.19035D-02            0.50000D+00            0.39029D+00
      0.73717D+00           -0.19690D-03            0.70721D-03            0.42409D+00            0.50000D+00
  1  0  0  1  1
      0.34938D+00            1.0000000
  1  0  0  1  1
      0.14711D+00            1.0000000
  1  0  0  1  1
      0.63934D-01            1.0000000
  1  0  0  1  1
      0.26992D-01            1.0000000
  1  1  1  13  2
      0.30054D+05            0.20347D-04           -0.59753D-05
      0.71283D+04            0.18114D-03           -0.52708D-04
      0.23224D+04            0.10533D-02           -0.30980D-03
      0.89041D+03            0.47813D-02           -0.13974D-02
      0.38149D+03            0.17305D-01           -0.51410D-02
      0.17836D+03            0.53378D-01           -0.15863D-01
      0.86775D+02            0.13820D+00           -0.42635D-01
      0.44157D+02            0.28989D+00           -0.90737D-01
      0.23271D+02            0.44939D+00           -0.15421D+00
      0.12855D+02            0.50000D+00           -0.16013D+00
      0.71889D+01            0.37159D+00           -0.11459D+00
      0.40172D+01            0.14925D+00            0.17630D+00
      0.20613D+01            0.18128D-01            0.50000D+00
  1  1  1  1  1
      0.10448D+01            1.0000000
  1  1  1  1  1
      0.51973D+00            1.0000000
  1  1  1  1  1
      0.24624D+00            1.0000000
  1  1  1  1  1
      0.77000D-01            1.0000000
  1  2  2  8  1
      0.38858D+03            0.31049D-03
      0.11805D+03            0.28043D-02
      0.45132D+02            0.15882D-01
      0.19138D+02            0.60297D-01
      0.92190D+01            0.13997D+00
      0.46370D+01            0.29342D+00
      0.23584D+01            0.43679D+00
      0.11907D+01            0.50000D+00
  1  2  2  1  1
      0.59180D+00            1.0000000
  1  2  2  1  1
      0.28576D+00            1.0000000
  1  2  2  1  1
      0.13223D+00            1.0000000
  1  2  2  1  1
      0.57108D-01            1.0000000
  1  3  3  1  1
     14.496000D+00           1.0000000
  1  3  3  1  1
      4.530000D+00           1.0000000
  1  3  3  1  1
      1.678000D+00           1.0000000
  1  3  3  1  1
      0.699000D+00           1.0000000
  1  3  3  1  1
      0.291000D+00           1.0000000
  1  4  4  1  1
      7.829000D+00           1.0000000
  1  4  4  1  1
      1.957000D+00           1.0000000
  1  4  4  1  1
      0.489000D+00           1.0000000
  1  5  5  1  1
      4.228000D+00           1.0000000
  1  5  5  1  1
      0.940000D+00           1.0000000
  1  6  6  1  1
      2.142000D+00           1.0000000
# MANGANESE (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Mn pc-4
 26
 1  0  0  20  4
      0.29296D+08            0.11201D-05           -0.22673D-06            0.74304D-07            0.35358D-07
      0.43247D+07            0.88841D-05           -0.17967D-05            0.58977D-06            0.28059D-06
      0.97294D+06            0.47418D-04           -0.96028D-05            0.31449D-05            0.14966D-05
      0.27290D+06            0.20292D-03           -0.41030D-04            0.13478D-04            0.64123D-05
      0.88258D+05            0.74844D-03           -0.15174D-03            0.49661D-04            0.23635D-04
      0.31616D+05            0.24693D-02           -0.50002D-03            0.16443D-03            0.78221D-04
      0.12251D+05            0.74511D-02           -0.15188D-02            0.49691D-03            0.23653D-03
      0.50466D+04            0.20842D-01           -0.42666D-02            0.14062D-02            0.66902D-03
      0.21863D+04            0.53782D-01           -0.11259D-01            0.36904D-02            0.17574D-02
      0.98801D+03            0.12627D+00           -0.27281D-01            0.90617D-02            0.43138D-02
      0.46298D+03            0.25767D+00           -0.60596D-01            0.20090D-01            0.95842D-02
      0.22402D+03            0.42834D+00           -0.11501D+00            0.39353D-01            0.18788D-01
      0.11064D+03            0.50000D+00           -0.17746D+00            0.61514D-01            0.29546D-01
      0.55489D+02            0.31916D+00           -0.15167D+00            0.58677D-01            0.28306D-01
      0.27067D+02            0.66363D-01            0.90609D-01           -0.44386D-01           -0.21645D-01
      0.14090D+02           -0.25298D-02            0.48397D+00           -0.24723D+00           -0.12510D+00
      0.71596D+01            0.18845D-02            0.50000D+00           -0.39537D+00           -0.21072D+00
      0.36218D+01           -0.10368D-02            0.14570D+00           -0.19953D-01           -0.79082D-02
      0.18406D+01            0.57910D-03            0.25295D-02            0.49515D+00            0.33178D+00
      0.90358D+00           -0.29484D-03            0.13469D-02            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.43307D+00            1.0000000
  1  0  0  1  1
      0.16427D+00            1.0000000
  1  0  0  1  1
      0.70191D-01            1.0000000
  1  0  0  1  1
      0.29014D-01            1.0000000
  1  1  1  13  2
      0.34193D+05            0.18795D-04           -0.56084D-05
      0.80795D+04            0.16880D-03           -0.50000D-04
      0.26206D+04            0.98996D-03           -0.29586D-03
      0.10019D+04            0.45145D-02           -0.13430D-02
      0.42862D+03            0.16448D-01           -0.49644D-02
      0.19960D+03            0.51432D-01           -0.15563D-01
      0.96840D+02            0.13421D+00           -0.42051D-01
      0.49215D+02            0.28383D+00           -0.90618D-01
      0.25897D+02            0.44632D+00           -0.15523D+00
      0.14246D+02            0.50000D+00           -0.16483D+00
      0.79461D+01            0.36920D+00           -0.11227D+00
      0.44368D+01            0.14522D+00            0.18178D+00
      0.22847D+01            0.17353D-01            0.50000D+00
  1  1  1  1  1
      0.11607D+01            1.0000000
  1  1  1  1  1
      0.57849D+00            1.0000000
  1  1  1  1  1
      0.27393D+00            1.0000000
  1  1  1  1  1
      0.86000D-01            1.0000000
  1  2  2  8  1
      0.54286D+03            0.19068D-03
      0.16513D+03            0.17865D-02
      0.63671D+02            0.10080D-01
      0.28769D+02            0.34532D-01
      0.14285D+02            0.99468D-01
      0.69273D+01            0.23425D+00
      0.34889D+01            0.39700D+00
      0.17486D+01            0.50000D+00
  1  2  2  1  1
      0.85650D+00            1.0000000
  1  2  2  1  1
      0.40581D+00            1.0000000
  1  2  2  1  1
      0.18415D+00            1.0000000
  1  2  2  1  1
      0.77156D-01            1.0000000
  1  3  3  1  1
     15.945000D+00           1.0000000
  1  3  3  1  1
      4.983000D+00           1.0000000
  1  3  3  1  1
      1.846000D+00           1.0000000
  1  3  3  1  1
      0.769000D+00           1.0000000
  1  3  3  1  1
      0.320000D+00           1.0000000
  1  4  4  1  1
      8.612000D+00           1.0000000
  1  4  4  1  1
      2.153000D+00           1.0000000
  1  4  4  1  1
      0.538000D+00           1.0000000
  1  5  5  1  1
      4.651000D+00           1.0000000
  1  5  5  1  1
      1.033000D+00           1.0000000
  1  6  6  1  1
      2.356000D+00           1.0000000
# IRON (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Fe pc-4
 26
 1  0  0  20  4
      0.27834D+08            0.13471D-05           -0.27451D-06            0.88454D-07            0.42628D-07
      0.41489D+07            0.10547D-04           -0.21479D-05            0.69298D-06            0.33395D-06
      0.93949D+06            0.55893D-04           -0.11394D-04            0.36695D-05            0.17684D-05
      0.26465D+06            0.23809D-03           -0.48489D-04            0.15653D-04            0.75434D-05
      0.85889D+05            0.87400D-03           -0.17836D-03            0.57413D-04            0.27669D-04
      0.30867D+05            0.28722D-02           -0.58601D-03            0.18934D-03            0.91250D-04
      0.11995D+05            0.86213D-02           -0.17695D-02            0.56956D-03            0.27450D-03
      0.49623D+04            0.23894D-01           -0.49350D-02            0.15981D-02            0.77033D-03
      0.21612D+04            0.60948D-01           -0.12877D-01            0.41545D-02            0.20031D-02
      0.98243D+03            0.14086D+00           -0.30859D-01            0.10076D-01            0.48610D-02
      0.46332D+03            0.28094D+00           -0.67284D-01            0.21989D-01            0.10620D-01
      0.22626D+03            0.44915D+00           -0.12395D+00            0.41781D-01            0.20226D-01
      0.11312D+03            0.50000D+00           -0.18428D+00            0.63181D-01            0.30720D-01
      0.57515D+02            0.30205D+00           -0.14470D+00            0.55552D-01            0.27242D-01
      0.28425D+02            0.59430D-01            0.11028D+00           -0.53085D-01           -0.26467D-01
      0.15154D+02           -0.24416D-02            0.49026D+00           -0.24782D+00           -0.12691D+00
      0.78706D+01            0.16986D-02            0.50000D+00           -0.39371D+00           -0.21298D+00
      0.40942D+01           -0.86941D-03            0.15462D+00           -0.20673D-01           -0.78147D-02
      0.20404D+01            0.44907D-03            0.58516D-02            0.49063D+00            0.33159D+00
      0.10117D+01           -0.22995D-03            0.48679D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.49177D+00            1.0000000
  1  0  0  1  1
      0.17927D+00            1.0000000
  1  0  0  1  1
      0.76051D-01            1.0000000
  1  0  0  1  1
      0.31366D-01            1.0000000
  1  1  1  13  2
      0.39749D+05            0.16351D-04           -0.50656D-05
      0.94039D+04            0.14672D-03           -0.45069D-04
      0.30505D+04            0.86127D-03           -0.26720D-03
      0.11669D+04            0.39303D-02           -0.12123D-02
      0.49990D+03            0.14383D-01           -0.45038D-02
      0.23187D+03            0.45992D-01           -0.14423D-01
      0.11215D+03            0.12188D+00           -0.39552D-01
      0.56768D+02            0.26497D+00           -0.87653D-01
      0.29733D+02            0.42968D+00           -0.15426D+00
      0.16221D+02            0.50000D+00           -0.17339D+00
      0.89390D+01            0.37727D+00           -0.11793D+00
      0.49333D+01            0.14582D+00            0.18110D+00
      0.25496D+01            0.16974D-01            0.50000D+00
  1  1  1  1  1
      0.12989D+01            1.0000000
  1  1  1  1  1
      0.64650D+00            1.0000000
  1  1  1  1  1
      0.30581D+00            1.0000000
  1  1  1  1  1
      0.96000D-01            1.0000000
  1  2  2  8  1
      0.48336D+03            0.30921D-03
      0.14704D+03            0.28232D-02
      0.56377D+02            0.16050D-01
      0.24153D+02            0.60879D-01
      0.11660D+02            0.14600D+00
      0.58563D+01            0.30331D+00
      0.29760D+01            0.44472D+00
      0.14967D+01            0.50000D+00
  1  2  2  1  1
      0.73705D+00            1.0000000
  1  2  2  1  1
      0.35034D+00            1.0000000
  1  2  2  1  1
      0.15832D+00            1.0000000
  1  2  2  1  1
      0.65876D-01            1.0000000
  1  3  3  1  1
     17.540000D+00           1.0000000
  1  3  3  1  1
      5.481000D+00           1.0000000
  1  3  3  1  1
      2.030000D+00           1.0000000
  1  3  3  1  1
      0.846000D+00           1.0000000
  1  3  3  1  1
      0.352000D+00           1.0000000
  1  4  4  1  1
      9.474000D+00           1.0000000
  1  4  4  1  1
      2.368000D+00           1.0000000
  1  4  4  1  1
      0.592000D+00           1.0000000
  1  5  5  1  1
      5.116000D+00           1.0000000
  1  5  5  1  1
      1.137000D+00           1.0000000
  1  6  6  1  1
      2.592000D+00           1.0000000
# COBALT (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Co pc-4
 26
 1  0  0  20  4
      0.28347D+08            0.14461D-05           -0.29222D-06            0.94601D-07            0.46271D-07
      0.42598D+07            0.11173D-04           -0.22567D-05            0.73134D-06            0.35776D-06
      0.97279D+06            0.58604D-04           -0.11847D-04            0.38334D-05            0.18749D-05
      0.27629D+06            0.24644D-03           -0.49774D-04            0.16139D-04            0.78956D-05
      0.90472D+05            0.89542D-03           -0.18120D-03            0.58610D-04            0.28664D-04
      0.32746D+05            0.29147D-02           -0.58980D-03            0.19140D-03            0.93646D-04
      0.12822D+05            0.86658D-02           -0.17639D-02            0.57053D-03            0.27902D-03
      0.53364D+04            0.23880D-01           -0.48919D-02            0.15910D-02            0.77862D-03
      0.23340D+04            0.60721D-01           -0.12721D-01            0.41253D-02            0.20182D-02
      0.10639D+04            0.14011D+00           -0.30444D-01            0.99825D-02            0.48902D-02
      0.50280D+03            0.27937D+00           -0.66312D-01            0.21790D-01            0.10677D-01
      0.24597D+03            0.44731D+00           -0.12234D+00            0.41405D-01            0.20360D-01
      0.12324D+03            0.50000D+00           -0.18209D+00            0.62843D-01            0.30981D-01
      0.62860D+02            0.30558D+00           -0.14545D+00            0.55910D-01            0.27903D-01
      0.31330D+02            0.62203D-01            0.10082D+00           -0.48811D-01           -0.24878D-01
      0.16780D+02           -0.20089D-02            0.47665D+00           -0.24202D+00           -0.12537D+00
      0.87527D+01            0.16003D-02            0.50000D+00           -0.39146D+00           -0.21508D+00
      0.45746D+01           -0.80588D-03            0.16125D+00           -0.32728D-01           -0.14080D-01
      0.22765D+01            0.40787D-03            0.70845D-02            0.47585D+00            0.32220D+00
      0.11308D+01           -0.20591D-03            0.33222D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.55017D+00            1.0000000
  1  0  0  1  1
      0.19325D+00            1.0000000
  1  0  0  1  1
      0.81240D-01            1.0000000
  1  0  0  1  1
      0.33338D-01            1.0000000
  1  1  1  13  2
      0.44520D+05            0.15245D-04           -0.48232D-05
      0.10535D+05            0.13646D-03           -0.42824D-04
      0.34301D+04            0.79370D-03           -0.25147D-03
      0.13190D+04            0.35928D-02           -0.11321D-02
      0.56707D+03            0.13173D-01           -0.42113D-02
      0.26247D+03            0.42755D-01           -0.13695D-01
      0.12667D+03            0.11462D+00           -0.37937D-01
      0.63960D+02            0.25334D+00           -0.85625D-01
      0.33414D+02            0.41967D+00           -0.15332D+00
      0.18126D+02            0.50000D+00           -0.17880D+00
      0.99170D+01            0.38142D+00           -0.12055D+00
      0.54335D+01            0.14552D+00            0.18232D+00
      0.28116D+01            0.16428D-01            0.50000D+00
  1  1  1  1  1
      0.14337D+01            1.0000000
  1  1  1  1  1
      0.71280D+00            1.0000000
  1  1  1  1  1
      0.33660D+00            1.0000000
  1  1  1  1  1
      0.10500D+00            1.0000000
  1  2  2  8  1
      0.54863D+03            0.29407D-03
      0.16662D+03            0.27106D-02
      0.63969D+02            0.15474D-01
      0.27673D+02            0.57845D-01
      0.13523D+02            0.14071D+00
      0.68056D+01            0.29672D+00
      0.34715D+01            0.44056D+00
      0.17526D+01            0.50000D+00
  1  2  2  1  1
      0.86504D+00            1.0000000
  1  2  2  1  1
      0.41198D+00            1.0000000
  1  2  2  1  1
      0.18676D+00            1.0000000
  1  2  2  1  1
      0.78207D-01            1.0000000
  1  3  3  1  1
     19.294000D+00           1.0000000
  1  3  3  1  1
      6.029000D+00           1.0000000
  1  3  3  1  1
      2.233000D+00           1.0000000
  1  3  3  1  1
      0.930000D+00           1.0000000
  1  3  3  1  1
      0.388000D+00           1.0000000
  1  4  4  1  1
     10.421000D+00           1.0000000
  1  4  4  1  1
      2.605000D+00           1.0000000
  1  4  4  1  1
      0.651000D+00           1.0000000
  1  5  5  1  1
      5.627000D+00           1.0000000
  1  5  5  1  1
      1.251000D+00           1.0000000
  1  6  6  1  1
      2.851000D+00           1.0000000
# NICKEL (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Ni pc-4
 26
 1  0  0  20  4
      0.34553D+08            0.12221D-05           -0.23917D-06            0.78357D-07            0.39839D-07
      0.51695D+07            0.95153D-05           -0.18609D-05            0.61040D-06            0.31043D-06
      0.11755D+07            0.50119D-04           -0.98119D-05            0.32129D-05            0.16333D-05
      0.33242D+06            0.21259D-03           -0.41575D-04            0.13644D-04            0.69402D-05
      0.10820D+06            0.77744D-03           -0.15236D-03            0.49868D-04            0.25348D-04
      0.39016D+05            0.25435D-02           -0.49822D-03            0.16365D-03            0.83254D-04
      0.15203D+05            0.76254D-02           -0.15025D-02            0.49171D-03            0.24992D-03
      0.62961D+04            0.21178D-01           -0.41951D-02            0.13809D-02            0.70274D-03
      0.27417D+04            0.54309D-01           -0.10990D-01            0.36050D-02            0.18326D-02
      0.12459D+04            0.12657D+00           -0.26473D-01            0.87820D-02            0.44739D-02
      0.58794D+03            0.25648D+00           -0.58265D-01            0.19347D-01            0.98475D-02
      0.28703D+03            0.42447D+00           -0.11011D+00            0.37634D-01            0.19246D-01
      0.14344D+03            0.50000D+00           -0.16965D+00            0.59001D-01            0.30186D-01
      0.73026D+02            0.33252D+00           -0.15271D+00            0.58706D-01            0.30493D-01
      0.36841D+02            0.78979D-01            0.57890D-01           -0.29415D-01           -0.15789D-01
      0.19411D+02           -0.28848D-03            0.43562D+00           -0.22016D+00           -0.11780D+00
      0.10033D+02            0.14433D-02            0.50000D+00           -0.38141D+00           -0.21733D+00
      0.52208D+01           -0.76733D-03            0.17531D+00           -0.72314D-01           -0.37809D-01
      0.26330D+01            0.39882D-03            0.92885D-02            0.42755D+00            0.29282D+00
      0.13083D+01           -0.19520D-03            0.38137D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.63314D+00            1.0000000
  1  0  0  1  1
      0.20854D+00            1.0000000
  1  0  0  1  1
      0.87199D-01            1.0000000
  1  0  0  1  1
      0.35563D-01            1.0000000
  1  1  1  13  2
      0.50205D+05            0.13977D-04           -0.44897D-05
      0.11910D+05            0.12456D-03           -0.39717D-04
      0.38814D+04            0.72487D-03           -0.23317D-03
      0.14924D+04            0.32887D-02           -0.10528D-02
      0.64042D+03            0.12197D-01           -0.39577D-02
      0.29478D+03            0.40185D-01           -0.13076D-01
      0.14187D+03            0.10882D+00           -0.36527D-01
      0.71408D+02            0.24452D+00           -0.83983D-01
      0.37156D+02            0.41326D+00           -0.15287D+00
      0.20039D+02            0.50000D+00           -0.18293D+00
      0.10909D+02            0.38290D+00           -0.12184D+00
      0.59548D+01            0.14474D+00            0.18366D+00
      0.30813D+01            0.16082D-01            0.50000D+00
  1  1  1  1  1
      0.15713D+01            1.0000000
  1  1  1  1  1
      0.78141D+00            1.0000000
  1  1  1  1  1
      0.36927D+00            1.0000000
  1  1  1  1  1
      0.11500D+00            1.0000000
  1  2  2  8  1
      0.60824D+03            0.28728D-03
      0.18494D+03            0.26651D-02
      0.71025D+02            0.15269D-01
      0.30843D+02            0.57191D-01
      0.15068D+02            0.14173D+00
      0.75680D+01            0.29888D+00
      0.38562D+01            0.44256D+00
      0.19435D+01            0.50000D+00
  1  2  2  1  1
      0.95672D+00            1.0000000
  1  2  2  1  1
      0.45483D+00            1.0000000
  1  2  2  1  1
      0.20623D+00            1.0000000
  1  2  2  1  1
      0.86270D-01            1.0000000
  1  3  3  1  1
     21.223000D+00           1.0000000
  1  3  3  1  1
      6.632000D+00           1.0000000
  1  3  3  1  1
      2.456000D+00           1.0000000
  1  3  3  1  1
      1.023000D+00           1.0000000
  1  3  3  1  1
      0.426000D+00           1.0000000
  1  4  4  1  1
     11.463000D+00           1.0000000
  1  4  4  1  1
      2.866000D+00           1.0000000
  1  4  4  1  1
      0.716000D+00           1.0000000
  1  5  5  1  1
      6.190000D+00           1.0000000
  1  5  5  1  1
      1.376000D+00           1.0000000
  1  6  6  1  1
      3.136000D+00           1.0000000
# COPPER (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Cu pc-4
 26
 1  0  0  20  4
      0.38689D+08            0.11555D-05           -0.22311D-06            0.73527D-07            0.37957D-07
      0.57781D+07            0.90164D-05           -0.17398D-05            0.57402D-06            0.29644D-06
      0.13122D+07            0.47570D-04           -0.91889D-05            0.30267D-05            0.15622D-05
      0.37108D+06            0.20137D-03           -0.38854D-04            0.12826D-04            0.66250D-05
      0.12096D+06            0.73540D-03           -0.14220D-03            0.46819D-04            0.24160D-04
      0.43601D+05            0.24124D-02           -0.46620D-03            0.15402D-03            0.79574D-04
      0.16968D+05            0.72439D-02           -0.14080D-02            0.46355D-03            0.23917D-03
      0.70254D+04            0.20108D-01           -0.39279D-02            0.13004D-02            0.67211D-03
      0.30620D+04            0.51552D-01           -0.10282D-01            0.33925D-02            0.17505D-02
      0.13932D+04            0.12041D+00           -0.24785D-01            0.82671D-02            0.42779D-02
      0.65815D+03            0.24574D+00           -0.54775D-01            0.18290D-01            0.94479D-02
      0.32125D+03            0.41348D+00           -0.10481D+00            0.35984D-01            0.18694D-01
      0.16039D+03            0.50000D+00           -0.16427D+00            0.57411D-01            0.29791D-01
      0.81622D+02            0.34668D+00           -0.15590D+00            0.59889D-01            0.31622D-01
      0.41410D+02            0.88998D-01            0.38967D-01           -0.20835D-01           -0.11569D-01
      0.21686D+02            0.90175D-03            0.41423D+00           -0.20927D+00           -0.11325D+00
      0.11194D+02            0.13414D-02            0.50000D+00           -0.37684D+00           -0.21784D+00
      0.58276D+01           -0.72778D-03            0.18452D+00           -0.90454D-01           -0.48691D-01
      0.29408D+01            0.37819D-03            0.11076D-01            0.40657D+00            0.27826D+00
      0.14577D+01           -0.18233D-03            0.27125D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.70128D+00            1.0000000
  1  0  0  1  1
      0.22228D+00            1.0000000
  1  0  0  1  1
      0.92219D-01            1.0000000
  1  0  0  1  1
      0.37389D-01            1.0000000
  1  1  1  13  2
      0.55020D+05            0.13553D-04           -0.44242D-05
      0.13075D+05            0.12033D-03           -0.39004D-04
      0.42697D+04            0.69782D-03           -0.22811D-03
      0.16451D+04            0.31558D-02           -0.10269D-02
      0.70737D+03            0.11699D-01           -0.38573D-02
      0.32573D+03            0.38680D-01           -0.12793D-01
      0.15700D+03            0.10503D+00           -0.35804D-01
      0.79152D+02            0.23747D+00           -0.82897D-01
      0.41275D+02            0.40585D+00           -0.15224D+00
      0.22281D+02            0.50000D+00           -0.18693D+00
      0.12123D+02            0.39163D+00           -0.12817D+00
      0.66010D+01            0.15104D+00            0.17711D+00
      0.34222D+01            0.17163D-01            0.50000D+00
  1  1  1  1  1
      0.17444D+01            1.0000000
  1  1  1  1  1
      0.86536D+00            1.0000000
  1  1  1  1  1
      0.40726D+00            1.0000000
  1  1  1  1  1
      0.12700D+00            1.0000000
  1  2  2  8  1
      0.67617D+03            0.27654D-03
      0.20559D+03            0.25770D-02
      0.79069D+02            0.14812D-01
      0.34502D+02            0.55414D-01
      0.16896D+02            0.13985D+00
      0.84740D+01            0.29690D+00
      0.43134D+01            0.44194D+00
      0.21694D+01            0.50000D+00
  1  2  2  1  1
      0.10641D+01            1.0000000
  1  2  2  1  1
      0.50322D+00            1.0000000
  1  2  2  1  1
      0.22658D+00            1.0000000
  1  2  2  1  1
      0.93766D-01            1.0000000
  1  3  3  1  1
     23.346000D+00           1.0000000
  1  3  3  1  1
      7.295000D+00           1.0000000
  1  3  3  1  1
      2.702000D+00           1.0000000
  1  3  3  1  1
      1.126000D+00           1.0000000
  1  3  3  1  1
      0.469000D+00           1.0000000
  1  4  4  1  1
     12.609000D+00           1.0000000
  1  4  4  1  1
      3.152000D+00           1.0000000
  1  4  4  1  1
      0.788000D+00           1.0000000
  1  5  5  1  1
      6.809000D+00           1.0000000
  1  5  5  1  1
      1.513000D+00           1.0000000
  1  6  6  1  1
      3.450000D+00           1.0000000
# ZINC (24s,17p,12d,5f,3g,2h,1i) -> [8s,6p,5d,5f,3g,2h,1i]
Zn pc-4
 26
 1  0  0  20  4
      0.42044D+08            0.11331D-05           -0.21652D-06            0.72023D-07            0.37421D-07
      0.62918D+07            0.88177D-05           -0.16839D-05            0.56073D-06            0.29147D-06
      0.14313D+07            0.46412D-04           -0.88722D-05            0.29499D-05            0.15324D-05
      0.40529D+06            0.19628D-03           -0.37481D-04            0.12487D-04            0.64923D-05
      0.13220D+06            0.71607D-03           -0.13702D-03            0.45539D-04            0.23651D-04
      0.47723D+05            0.23418D-02           -0.44788D-03            0.14933D-03            0.77661D-04
      0.18614D+05            0.70106D-02           -0.13483D-02            0.44809D-03            0.23267D-03
      0.77227D+04            0.19431D-01           -0.37555D-02            0.12547D-02            0.65281D-03
      0.33705D+04            0.49825D-01           -0.98262D-02            0.32728D-02            0.16995D-02
      0.15350D+04            0.11658D+00           -0.23712D-01            0.79802D-02            0.41569D-02
      0.72564D+03            0.23911D+00           -0.52542D-01            0.17709D-01            0.92046D-02
      0.35424D+03            0.40640D+00           -0.10132D+00            0.35076D-01            0.18343D-01
      0.17693D+03            0.50000D+00           -0.16041D+00            0.56569D-01            0.29529D-01
      0.90102D+02            0.35750D+00           -0.15806D+00            0.60993D-01            0.32419D-01
      0.45913D+02            0.97276D-01            0.26387D-01           -0.15179D-01           -0.86485D-02
      0.23891D+02            0.20133D-02            0.40060D+00           -0.20375D+00           -0.11075D+00
      0.12314D+02            0.12153D-02            0.50000D+00           -0.37647D+00           -0.21875D+00
      0.64077D+01           -0.66950D-03            0.18991D+00           -0.99104D-01           -0.53916D-01
      0.32156D+01            0.34712D-03            0.12079D-01            0.40035D+00            0.27361D+00
      0.15869D+01           -0.16719D-03            0.14819D-03            0.50000D+00            0.50000D+00
  1  0  0  1  1
      0.75979D+00            1.0000000
  1  0  0  1  1
      0.23625D+00            1.0000000
  1  0  0  1  1
      0.97241D-01            1.0000000
  1  0  0  1  1
      0.39151D-01            1.0000000
  1  1  1  13  2
      0.61415D+05            0.12641D-04           -0.41784D-05
      0.14549D+05            0.11303D-03           -0.37133D-04
      0.47319D+04            0.66103D-03           -0.21879D-03
      0.18169D+04            0.30080D-02           -0.99202D-03
      0.77921D+03            0.11225D-01           -0.37469D-02
      0.35804D+03            0.37277D-01           -0.12494D-01
      0.17261D+03            0.10159D+00           -0.35048D-01
      0.87009D+02            0.23175D+00           -0.82003D-01
      0.45312D+02            0.40162D+00           -0.15230D+00
      0.24393D+02            0.50000D+00           -0.19028D+00
      0.13250D+02            0.39362D+00           -0.13022D+00
      0.72083D+01            0.15214D+00            0.17604D+00
      0.37407D+01            0.17417D-01            0.50000D+00
  1  1  1  1  1
      0.19064D+01            1.0000000
  1  1  1  1  1
      0.94447D+00            1.0000000
  1  1  1  1  1
      0.44333D+00            1.0000000
  1  1  1  1  1
      0.13900D+00            1.0000000
  1  2  2  8  1
      0.75456D+03            0.26232D-03
      0.22928D+03            0.24682D-02
      0.88193D+02            0.14243D-01
      0.38661D+02            0.53362D-01
      0.18949D+02            0.13761D+00
      0.94920D+01            0.29412D+00
      0.48340D+01            0.44071D+00
      0.24331D+01            0.50000D+00
  1  2  2  1  1
      0.11942D+01            1.0000000
  1  2  2  1  1
      0.56476D+00            1.0000000
  1  2  2  1  1
      0.25398D+00            1.0000000
  1  2  2  1  1
      0.10470D+00            1.0000000
  1  3  3  1  1
     25.680000D+00           1.0000000
  1  3  3  1  1
      8.025000D+00           1.0000000
  1  3  3  1  1
      2.972000D+00           1.0000000
  1  3  3  1  1
      1.238000D+00           1.0000000
  1  3  3  1  1
      0.516000D+00           1.0000000
  1  4  4  1  1
     13.870000D+00           1.0000000
  1  4  4  1  1
      3.468000D+00           1.0000000
  1  4  4  1  1
      0.867000D+00           1.0000000
  1  5  5  1  1
      7.490000D+00           1.0000000
  1  5  5  1  1
      1.664000D+00           1.0000000
  1  6  6  1  1
      3.795000D+00           1.0000000
#
#  aug-pc-0  EMSL  Basis Set Exchange Library  6/6/08 12:16 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-0
  3
  1  0  0  2  1
          4.34480000          0.07929900
          0.66049000          0.42422000
  1  0  0  1  1
          0.13669000          1.00000000
  1  0  0  1  1
          0.02717400          1.00000000
# HELIUM
He aug-pc-0
  3
  1  0  0  2  1
         13.21000000          0.04350600
          1.94340000          0.21166000
  1  0  0  1  1
          0.35443000          1.00000000
  1  0  0  1  1
          0.06237000          1.00000000
# LITHIUM
Li aug-pc-0
  5
  1  0  0  4  2
         97.58500000          0.02235800          0.00000000
         14.75500000          0.14499000          0.00518750
          3.22330000          0.34594000          0.16698000
          0.78789000          0.00000000          0.72566000
  1  0  0  1  1
          0.05100900          1.00000000
  1  0  0  1  1
          0.01229000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          0.03687000          1.00000000
# BERYLLIUM
Be aug-pc-0
  5
  1  0  0  4  2
        187.54000000          0.01037300          0.00000000
         28.34500000          0.07200700         -0.00205070
          6.26140000          0.13085000          0.11312000
          1.58370000          0.00000000          0.30800000
  1  0  0  1  1
          0.10858000          1.00000000
  1  0  0  1  1
          0.02585000          1.00000000
  1  1  1  1  1
          0.43000000          1.00000000
  1  1  1  1  1
          0.07755000          1.00000000
# BORON
B  aug-pc-0
  6
  1  0  0  4  2
        303.73000000          0.02012100          0.00000000
         45.89400000          0.14410000         -0.00738180
         10.20500000          0.21961000          0.26153000
          2.63480000          0.00000000          0.59363000
  1  0  0  1  1
          0.19380000          1.00000000
  1  0  0  1  1
          0.04560000          1.00000000
  1  1  1  2  1
          2.79040000          0.10986000
          0.54195000          0.46846000
  1  1  1  1  1
          0.11876000          1.00000000
  1  1  1  1  1
          0.02494000          1.00000000
# CARBON
C  aug-pc-0
  6
  1  0  0  4  2
        446.51000000          0.01978800          0.00000000
         67.46200000          0.14534000         -0.00999100
         15.06700000          0.18529000          0.28519000
          3.93880000          0.00000000          0.56687000
  1  0  0  1  1
          0.29991000          1.00000000
  1  0  0  1  1
          0.06974800          1.00000000
  1  1  1  2  1
          4.36770000          0.11671000
          0.86982000          0.47558000
  1  1  1  1  1
          0.18893000          1.00000000
  1  1  1  1  1
          0.03936100          1.00000000
# NITROGEN
N  aug-pc-0
  6
  1  0  0  4  2
        615.85000000          0.01958800          0.00000000
         93.04400000          0.14695000         -0.01205900
         20.84800000          0.15560000          0.30199000
          5.49590000          0.00000000          0.54090000
  1  0  0  1  1
          0.42624000          1.00000000
  1  0  0  1  1
          0.09798600          1.00000000
  1  1  1  2  1
          6.26800000          0.12134000
          1.26900000          0.48013000
  1  1  1  1  1
          0.27390000          1.00000000
  1  1  1  1  1
          0.05670900          1.00000000
# OXYGEN
O  aug-pc-0
  6
  1  0  0  4  2
        812.12000000          0.01945000          0.00000000
        122.69000000          0.14774000         -0.01318900
         27.56100000          0.13593000          0.31510000
          7.31730000          0.00000000          0.52964000
  1  0  0  1  1
          0.57924000          1.00000000
  1  0  0  1  1
          0.13165000          1.00000000
  1  1  1  2  1
          8.21780000          0.12902000
          1.67540000          0.48706000
  1  1  1  1  1
          0.35067000          1.00000000
  1  1  1  1  1
          0.07041600          1.00000000
# FLUORINE
F  aug-pc-0
  6
  1  0  0  4  2
       1035.10000000          0.01935100          0.00000000
        156.38000000          0.14884000         -0.01433700
         35.19600000          0.11735000          0.32551000
          9.39210000          0.00000000          0.51681000
  1  0  0  1  1
          0.75342000          1.00000000
  1  0  0  1  1
          0.16931000          1.00000000
  1  1  1  2  1
         10.59900000          0.13273000
          2.17330000          0.48938000
  1  1  1  1  1
          0.44871000          1.00000000
  1  1  1  1  1
          0.08902900          1.00000000
# NEON
Ne aug-pc-0
  6
  1  0  0  4  2
       1284.50000000          0.09641900          0.00000000
        194.05000000          0.75019000         -0.00767080
         43.74600000          0.49765000          0.16693000
         11.72000000          0.00000000          0.25151000
  1  0  0  1  1
          0.94746000          1.00000000
  1  0  0  1  1
          0.21050000          1.00000000
  1  1  1  2  1
         13.34800000          0.06746700
          2.75090000          0.24531000
  1  1  1  1  1
          0.56434000          1.00000000
  1  1  1  1  1
          0.11120000          1.00000000
# SODIUM
Na aug-pc-0
  6
  1  0  0  7  3
       4553.50000000          0.00515830          0.00000000          0.00000000
        685.09000000          0.03860000         -0.00031854          0.00000000
        155.73000000          0.17385000         -0.00226480         -0.00007913
         43.37100000          0.45646000         -0.03392300         -0.00069906
         13.33900000          0.46291000         -0.07630900         -0.00320830
          2.31060000          0.00000000          0.33727000          0.03005600
          0.70669000          0.00000000          0.00000000          0.11224000
  1  0  0  1  1
          0.04594200          1.00000000
  1  0  0  1  1
          0.01141000          1.00000000
  1  1  1  4  1
         37.79300000          0.04649500
          8.41340000          0.24311000
          2.32100000          0.51738000
          0.60658000          0.42598000
  1  1  1  1  1
          0.09500000          1.00000000
  1  1  1  1  1
          0.03167000          1.00000000
# MAGNESIUM
Mg aug-pc-0
  6
  1  0  0  7  3
       5520.80000000          0.00252540          0.00000000          0.00000000
        830.56000000          0.01893200         -0.00015190          0.00000000
        188.81000000          0.08556500         -0.00087484         -0.00116040
         52.63800000          0.22776000         -0.01460700         -0.00988450
         16.23300000          0.23565000         -0.03034900         -0.04341600
          2.92750000          0.00000000          0.10360000          0.31196000
          0.94786000          0.00000000          0.00000000          0.72645000
  1  0  0  1  1
          0.07636100          1.00000000
  1  0  0  1  1
          0.01989000          1.00000000
  1  1  1  4  1
         49.45300000          0.02173900
         11.11600000          0.11690000
          3.12730000          0.25993000
          0.85940000          0.21108000
  1  1  1  1  1
          0.16000000          1.00000000
  1  1  1  1  1
          0.05333000          1.00000000
# ALUMINUM
Al aug-pc-0
  6
  1  0  0  7  3
       6587.10000000          0.00495700          0.00000000          0.00000000
        990.92000000          0.03722300         -0.00029525          0.00000000
        225.29000000          0.16875000         -0.00156740         -0.00034383
         62.86600000          0.45505000         -0.02743400         -0.00293810
         19.43200000          0.48010000         -0.05560000         -0.01304700
          3.62070000          0.00000000          0.15188000          0.08567900
          1.22880000          0.00000000          0.00000000          0.18025000
  1  0  0  1  1
          0.12068000          1.00000000
  1  0  0  1  1
          0.02898000          1.00000000
  1  1  1  5  2
         72.36500000          0.03295300          0.00000000
         16.54300000          0.18989000         -0.00030607
          4.82390000          0.47489000         -0.00812540
          1.43360000          0.48033000          0.00582160
          0.27689000          0.00000000          0.37831000
  1  1  1  1  1
          0.06985600          1.00000000
  1  1  1  1  1
          0.01678000          1.00000000
# SILICON
Si aug-pc-0
  6
  1  0  0  7  3
       7743.00000000          0.00488250          0.00000000          0.00000000
       1164.70000000          0.03674100         -0.00029111          0.00000000
        264.82000000          0.16695000         -0.00141220         -0.00044437
         73.96800000          0.45657000         -0.02604600         -0.00380670
         22.91200000          0.49043000         -0.05093300         -0.01707800
          4.37410000          0.00000000          0.10810000          0.10569000
          1.53910000          0.00000000          0.00000000          0.20429000
  1  0  0  1  1
          0.16775000          1.00000000
  1  0  0  1  1
          0.04273000          1.00000000
  1  1  1  5  2
         96.08000000          0.02803500          0.00000000
         22.15000000          0.16819000         -0.00072797
          6.56300000          0.45197000         -0.00866440
          2.02500000          0.50132000         -0.00353440
          0.47780000          0.00000000          0.31085000
  1  1  1  1  1
          0.12824000          1.00000000
  1  1  1  1  1
          0.03266600          1.00000000
# PHOSPHOROUS
P  aug-pc-0
  6
  1  0  0  7  3
       8990.80000000          0.00482060          0.00000000          0.00000000
       1352.40000000          0.03639200          0.00289000          0.00000000
        307.50000000          0.16563000          0.01263800         -0.00054512
         85.94100000          0.46217000          0.24790000         -0.00468380
         26.67100000          0.50582000          0.46165000         -0.02116000
          5.18810000          0.00000000         -0.70180000          0.12534000
          1.87780000          0.00000000          0.00000000          0.22427000
  1  0  0  1  1
          0.22010000          1.00000000
  1  0  0  1  1
          0.05606900          1.00000000
  1  1  1  5  2
        111.64000000          0.02866300          0.00000000
         25.78400000          0.17265000         -0.00068545
          7.67250000          0.46181000         -0.01129600
          2.39960000          0.49174000          0.00329620
          0.54943000          0.00000000          0.41613000
  1  1  1  1  1
          0.14748000          1.00000000
  1  1  1  1  1
          0.03756900          1.00000000
# SULFUR
S  aug-pc-0
  6
  1  0  0  7  3
      10330.00000000          0.00476850          0.00000000          0.00000000
       1553.70000000          0.03620900          0.00289030          0.00000000
        353.30000000          0.16491000          0.01157500         -0.00062501
         98.80500000          0.47548000          0.23993000         -0.00538810
         30.71600000          0.53319000          0.42830000         -0.02452100
          6.06330000          0.00000000         -0.42063000          0.14132000
          2.24750000          0.00000000          0.00000000          0.23948000
  1  0  0  1  1
          0.27853000          1.00000000
  1  0  0  1  1
          0.07074900          1.00000000
  1  1  1  5  2
        129.76000000          0.02870600          0.00000000
         30.02500000          0.17420000         -0.00011785
          8.97330000          0.46709000         -0.01448300
          2.84400000          0.48571000          0.01593900
          0.63361000          0.00000000          0.48257000
  1  1  1  1  1
          0.16955000          1.00000000
  1  1  1  1  1
          0.04306700          1.00000000
# CHLORINE
Cl aug-pc-0
  6
  1  0  0  7  3
      11759.00000000          0.00472480          0.00000000          0.00000000
       1768.60000000          0.03654600          0.00290530          0.00000000
        402.19000000          0.16597000          0.01066400         -0.00069197
        112.54000000          0.52530000          0.23406000         -0.00597600
         35.03900000          0.61955000          0.39915000         -0.02739400
          6.99560000          0.00000000         -0.17937000          0.15516000
          2.64550000          0.00000000          0.00000000          0.25028000
  1  0  0  1  1
          0.34157000          1.00000000
  1  0  0  1  1
          0.08657700          1.00000000
  1  1  1  5  2
        150.66000000          0.02829900          0.00000000
         34.93300000          0.17336000          0.00013598
         10.49200000          0.46812000         -0.01661100
          3.37260000          0.48321000          0.02235100
          0.75989000          0.00000000          0.51192000
  1  1  1  1  1
          0.20289000          1.00000000
  1  1  1  1  1
          0.05142700          1.00000000
# ARGON
Ar aug-pc-0
  6
  1  0  0  7  3
      13277.00000000          0.02344000          0.00000000          0.00000000
       1996.90000000          0.15225000          0.00146890          0.00000000
        454.12000000          0.72536000          0.00492820         -0.00037469
        127.14000000          0.33180000          0.11458000         -0.00324620
         39.63700000         -0.63751000          0.18548000         -0.01496800
          7.98170000          0.00000000          0.02189400          0.08393600
          3.07060000          0.00000000          0.00000000          0.12891000
  1  0  0  1  1
          0.40908000          1.00000000
  1  0  0  1  1
          0.10390000          1.00000000
  1  1  1  5  2
        173.23000000          0.01395500          0.00000000
         40.23900000          0.08622600          0.00013131
         12.13900000          0.23423000         -0.00914820
          3.95270000          0.24062000          0.01328000
          0.90626000          0.00000000          0.26503000
  1  1  1  1  1
          0.24252000          1.00000000
  1  1  1  1  1
          0.06160000          1.00000000
#  aug-pc-1  EMSL  Basis Set Exchange Library  6/6/08 12:17 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-1
  5
  1  0  0  3  1
         12.25200000          0.02282200
          1.86870000          0.15564000
          0.41821000          0.48898000
  1  0  0  1  1
          0.10610000          1.00000000
  1  0  0  1  1
          0.02562800          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
  1  1  1  1  1
          0.07688400          1.00000000
# HELIUM
He aug-pc-1
  5
  1  0  0  3  1
         36.86500000          0.01306200
          5.58020000          0.08349100
          1.19170000          0.23874000
  1  0  0  1  1
          0.26892000          1.00000000
  1  0  0  1  1
          0.05807000          1.00000000
  1  1  1  1  1
          1.45000000          1.00000000
  1  1  1  1  1
          0.17420000          1.00000000
# LITHIUM
Li aug-pc-1
  6
  1  0  0  6  2
        266.43000000          0.00652680          0.00000000
         40.16000000          0.04806500          0.00001102
          9.10820000          0.20095000         -0.00268490
          2.45430000          0.47007000         -0.01871100
          0.69626000          0.43130000         -0.08894800
          0.08372600          0.00000000          0.51836000
  1  0  0  1  1
          0.03082700          1.00000000
  1  0  0  1  1
          0.01057000          1.00000000
  1  1  1  2  1
          1.62000000          0.04165510
          0.32000000          0.11044500
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.03171000          1.00000000
# BERYLLIUM
Be aug-pc-1
  6
  1  0  0  6  2
        514.90000000          0.00300310          0.00000000
         77.55800000          0.02224300         -0.00009600
         17.60900000          0.09543400         -0.00121790
          4.80800000          0.23228000         -0.01369900
          1.40850000          0.22104000         -0.04215900
          0.19069000          0.00000000          0.26185000
  1  0  0  1  1
          0.06112500          1.00000000
  1  0  0  1  1
          0.01841000          1.00000000
  1  1  1  2  1
          3.42000000          0.04935190
          0.68000000          0.18982100
  1  1  1  1  1
          0.19000000          1.00000000
  1  1  1  1  1
          0.05523000          1.00000000
# BORON
B  aug-pc-1
  8
  1  0  0  6  2
        843.98000000          0.00573610          0.00000000
        127.08000000          0.04262500         -0.00023303
         28.86200000          0.18576000         -0.00254790
          7.92970000          0.46258000         -0.03092800
          2.36370000          0.44646000         -0.08695600
          0.34670000          0.00000000          0.53062000
  1  0  0  1  1
          0.10595000          1.00000000
  1  0  0  1  1
          0.03052000          1.00000000
  1  1  1  3  1
          5.81280000          0.04308400
          1.20020000          0.22295000
          0.32686000          0.50977000
  1  1  1  1  1
          0.08626400          1.00000000
  1  1  1  1  1
          0.02163000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.06488000          1.00000000
# CARBON
C  aug-pc-1
  8
  1  0  0  6  2
       1252.60000000          0.00557360          0.00000000
        188.57000000          0.04149600         -0.00027440
         42.83900000          0.18263000         -0.00255830
         11.81800000          0.46129000         -0.03337500
          3.55670000          0.44931000         -0.08730500
          0.54258000          0.00000000          0.53415000
  1  0  0  1  1
          0.16058000          1.00000000
  1  0  0  1  1
          0.04485600          1.00000000
  1  1  1  3  1
          9.14260000          0.04449900
          1.92980000          0.23108000
          0.52522000          0.51227000
  1  1  1  1  1
          0.13608000          1.00000000
  1  1  1  1  1
          0.03351800          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.10055000          1.00000000
# NITROGEN
N  aug-pc-1
  8
  1  0  0  6  2
       1742.20000000          0.00546030          0.00000000
        262.21000000          0.04070600         -0.00030104
         59.58500000          0.18038000         -0.00255110
         16.48900000          0.46009000         -0.03490000
          4.99450000          0.45173000         -0.08742900
          0.78673000          0.00000000          0.52660000
  1  0  0  1  1
          0.22837000          1.00000000
  1  0  0  1  1
          0.06273900          1.00000000
  1  1  1  3  1
         13.13200000          0.04551500
          2.81080000          0.23740000
          0.76351000          0.51392000
  1  1  1  1  1
          0.19560000          1.00000000
  1  1  1  1  1
          0.04770700          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
  1  2  2  1  1
          0.14312000          1.00000000
# OXYGEN
O  aug-pc-1
  8
  1  0  0  6  2
       2306.70000000          0.00539400          0.00000000
        347.15000000          0.04024800         -0.00031692
         78.89000000          0.17921000         -0.00259440
         21.87600000          0.45978000         -0.03624100
          6.66460000          0.45234000         -0.08779000
          1.06690000          0.00000000          0.53320000
  1  0  0  1  1
          0.30700000          1.00000000
  1  0  0  1  1
          0.08342500          1.00000000
  1  1  1  3  1
         17.02200000          0.04891900
          3.68380000          0.24962000
          0.99234000          0.51347000
  1  1  1  1  1
          0.24487000          1.00000000
  1  1  1  1  1
          0.05761600          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.17285000          1.00000000
# FLUORINE
F  aug-pc-1
  8
  1  0  0  6  2
       2954.60000000          0.00533370          0.00000000
        444.62000000          0.03982700         -0.00032962
        101.05000000          0.17802000         -0.00260830
         28.06800000          0.45917000         -0.03715000
          8.58370000          0.45352000         -0.08817800
          1.39860000          0.00000000          0.53135000
  1  0  0  1  1
          0.39969000          1.00000000
  1  0  0  1  1
          0.10802000          1.00000000
  1  1  1  3  1
         21.88300000          0.05024400
          4.77690000          0.25424000
          1.28230000          0.51220000
  1  1  1  1  1
          0.31127000          1.00000000
  1  1  1  1  1
          0.07205400          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.21616000          1.00000000
# NEON
Ne aug-pc-1
  8
  1  0  0  6  2
       3680.10000000          0.00264540          0.00000000
        553.75000000          0.01976300         -0.00017209
        125.87000000          0.08859000         -0.00130160
         35.01300000          0.22936000         -0.01898000
         10.73900000          0.22717000         -0.04400800
          1.76930000          0.00000000          0.26525000
  1  0  0  1  1
          0.50149000          1.00000000
  1  0  0  1  1
          0.13450000          1.00000000
  1  1  1  3  1
         27.50200000          0.02547700
          6.03970000          0.12855000
          1.61900000          0.25586000
  1  1  1  1  1
          0.38970000          1.00000000
  1  1  1  1  1
          0.08950000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.26850000          1.00000000
# SODIUM
Na aug-pc-1
  6
  1  0  0 10  3
      23207.00000000          0.00068100          0.00000000          0.00000000
       3481.60000000          0.00525120         -0.00002932          0.00000000
        792.72000000          0.02684500         -0.00003220         -0.00000132
        224.59000000          0.10188000         -0.00214850         -0.00001438
         73.08800000          0.27784000         -0.00931570         -0.00013687
         26.19000000          0.44489000         -0.06707100         -0.00048799
          9.86610000          0.28206000         -0.05678900         -0.00028773
          2.21550000          0.02068500          0.53608000         -0.01017800
          0.68590000          0.00000000          0.59788000         -0.11118000
          0.07033700          0.00000000          0.00000000          0.59314000
  1  0  0  1  1
          0.02607500          1.00000000
  1  0  0  1  1
          0.00900100          1.00000000
  1  1  1  6  1
        135.55000000          0.00617590
         31.56200000          0.04531500
          9.67740000          0.17332000
          3.36910000          0.36867000
          1.17030000          0.43998000
          0.37651000          0.22613000
  1  1  1  1  1
          0.07500000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
# MAGNESIUM
Mg aug-pc-1
  6
  1  0  0 10  3
      28706.00000000          0.00032513          0.00000000          0.00000000
       4306.60000000          0.00250760         -0.00001306          0.00000000
        980.54000000          0.01283700         -0.00001798          0.00000116
        277.76000000          0.04896400         -0.00100360          0.00001351
         90.38600000          0.13517000         -0.00468190          0.00013542
         32.37400000          0.22193000         -0.03305100          0.00075360
         12.17700000          0.14657000         -0.03271800          0.00150980
          2.81660000          0.01198000          0.26039000         -0.01906800
          0.92173000          0.00000000          0.30808000         -0.07524100
          0.12709000          0.00000000          0.00000000          0.27161000
  1  0  0  1  1
          0.04608000          1.00000000
  1  0  0  1  1
          0.01558000          1.00000000
  1  1  1  6  1
        177.60000000          0.00282590
         41.44200000          0.02110300
         12.81800000          0.08266600
          4.51740000          0.18285000
          1.61280000          0.22357000
          0.54531000          0.10869000
  1  1  1  1  1
          0.13500000          1.00000000
  1  1  1  1  1
          0.04500000          1.00000000
# ALUMINUM
Al aug-pc-1
  8
  1  0  0 10  3
      34702.00000000          0.00062778          0.00000000          0.00000000
       5205.90000000          0.00484320         -0.00002388          0.00000000
       1185.20000000          0.02481700         -0.00003937          0.00000451
        335.70000000          0.09502800         -0.00191680          0.00005323
        109.23000000          0.26474000         -0.00943620          0.00053333
         39.12000000          0.44274000         -0.06573900          0.00287540
         14.70900000          0.30134000         -0.07223200          0.00567340
          3.48960000          0.02681700          0.50924000         -0.05813300
          1.19360000          0.00000000          0.62972000         -0.18753000
          0.19585000          0.00000000          0.00000000          0.58570000
  1  0  0  1  1
          0.07143900          1.00000000
  1  0  0  1  1
          0.02429000          1.00000000
  1  1  1  7  2
        254.36000000          0.00429030          0.00000000
         59.51400000          0.03305500          0.00010756
         18.70800000          0.13486000         -0.00081981
          6.73620000          0.32836000         -0.00142160
          2.50450000          0.44798000         -0.01493000
          0.90820000          0.27040000          0.04377900
          0.20909000          0.00000000          0.49039000
  1  1  1  1  1
          0.05699000          1.00000000
  1  1  1  1  1
          0.01473000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.04419000          1.00000000
# SILICON
Si aug-pc-1
  8
  1  0  0 10  3
      41263.00000000          0.00060948          0.00000000          0.00000000
       6189.60000000          0.00470400         -0.00002246          0.00000000
       1408.70000000          0.02413600         -0.00004176          0.00000603
        398.77000000          0.09276200         -0.00185700          0.00007428
        129.69000000          0.26047000         -0.00951130          0.00074023
         46.42500000          0.44181000         -0.06580000          0.00401070
         17.45500000          0.30755000         -0.07754600          0.00801370
          4.22220000          0.02919700          0.50303000         -0.07409100
          1.49330000          0.00000000          0.63824000         -0.21382000
          0.27174000          0.00000000          0.00000000          0.61263000
  1  0  0  1  1
          0.09850200          1.00000000
  1  0  0  1  1
          0.03329300          1.00000000
  1  1  1  7  2
        310.73000000          0.00411980          0.00000000
         72.82300000          0.03198100          0.00012637
         22.98500000          0.13224000         -0.00102520
          8.32130000          0.32779000         -0.00213370
          3.13530000          0.45107000         -0.01877400
          1.16930000          0.26345000          0.05752800
          0.29281000          0.00000000          0.53571000
  1  1  1  1  1
          0.08270400          1.00000000
  1  1  1  1  1
          0.02211100          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.06633200          1.00000000
# PHOSPHOROUS
P  aug-pc-1
  8
  1  0  0 10  3
      48073.00000000          0.00059919          0.00000000          0.00000000
       7211.40000000          0.00462410         -0.00002131          0.00000000
       1641.70000000          0.02372400         -0.00004422          0.00000713
        464.92000000          0.09130300         -0.00182210          0.00008450
        151.28000000          0.25750000         -0.00963660          0.00085919
         54.18900000          0.44080000         -0.06607200          0.00464780
         20.39700000          0.31175000         -0.08182400          0.00958110
          5.02410000          0.03111800          0.49850000         -0.08406600
          1.82460000          0.00000000          0.64492000         -0.23124000
          0.35871000          0.00000000          0.00000000          0.62350000
  1  0  0  1  1
          0.12887000          1.00000000
  1  0  0  1  1
          0.04319400          1.00000000
  1  1  1  7  2
        366.24000000          0.00409770          0.00000000
         85.93100000          0.03195600          0.00012506
         27.17200000          0.13326000         -0.00121660
          9.86850000          0.33228000         -0.00318130
          3.75330000          0.45335000         -0.02147500
          1.43020000          0.25058000          0.06999100
          0.38653000          0.00000000          0.56081000
  1  1  1  1  1
          0.11146000          1.00000000
  1  1  1  1  1
          0.03038600          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.09115700          1.00000000
# SULFUR
S  aug-pc-1
  8
  1  0  0 10  3
      55510.00000000          0.00058899          0.00000000          0.00000000
       8326.70000000          0.00454600         -0.00002048          0.00000000
       1895.60000000          0.02333500         -0.00004543          0.00000835
        536.77000000          0.08996500         -0.00179370          0.00009831
        174.67000000          0.25486000         -0.00972520          0.00100400
         62.57800000          0.43998000         -0.06639900          0.00544090
         23.57300000          0.31549000         -0.08550200          0.01140000
          5.89080000          0.03282600          0.49588000         -0.09513400
          2.18520000          0.00000000          0.64988000         -0.24735000
          0.45282000          0.00000000          0.00000000          0.63973000
  1  0  0  1  1
          0.16202000          1.00000000
  1  0  0  1  1
          0.05410000          1.00000000
  1  1  1  7  2
        395.45000000          0.00462660          0.00000000
         92.83400000          0.03589800          0.00010934
         29.26600000          0.14854000         -0.00163580
         10.59500000          0.35878000         -0.00506320
          4.02720000          0.45417000         -0.02396000
          1.54840000          0.20545000          0.10388000
          0.46134000          0.00000000          0.58063000
  1  1  1  1  1
          0.13131000          1.00000000
  1  1  1  1  1
          0.03536400          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.10609000          1.00000000
# CHLORINE
Cl aug-pc-1
  8
  1  0  0 10  3
      63474.00000000          0.00058028          0.00000000          0.00000000
       9521.30000000          0.00447920         -0.00001982          0.00000000
       2167.40000000          0.02300000         -0.00004720          0.00000906
        613.74000000          0.08881500         -0.00177130          0.00010695
        199.72000000          0.25258000         -0.00980680          0.00109810
         71.56400000          0.43921000         -0.06671900          0.00598980
         26.97900000          0.31868000         -0.08871100          0.01276200
          6.82600000          0.03434800          0.49396000         -0.10307000
          2.57670000          0.00000000          0.65392000         -0.25941000
          0.55752000          0.00000000          0.00000000          0.64899000
  1  0  0  1  1
          0.19825000          1.00000000
  1  0  0  1  1
          0.06581600          1.00000000
  1  1  1  7  2
        413.12000000          0.00542510          0.00000000
         97.05400000          0.04164400         -0.00000174
         30.48200000          0.16990000         -0.00214410
         10.96200000          0.39275000         -0.00912980
          4.12760000          0.45045000         -0.01990600
          1.53380000          0.15308000          0.15582000
          0.51439000          0.00000000          0.58772000
  1  1  1  1  1
          0.15026000          1.00000000
  1  1  1  1  1
          0.04146700          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.12440000          1.00000000
# ARGON
Ar aug-pc-1
  8
  1  0  0 10  3
      71956.00000000          0.00028643          0.00000000          0.00000000
      10793.00000000          0.00221120         -0.00000961          0.00000000
       2457.00000000          0.01135800         -0.00002414          0.00000479
        695.72000000          0.04391600         -0.00087570          0.00005758
        226.40000000          0.12531000         -0.00493760          0.00058972
         81.13800000          0.21927000         -0.03351200          0.00323990
         30.61200000          0.16071000         -0.04576400          0.00698140
          7.82910000          0.01784900          0.24633000         -0.05491800
          2.99870000          0.00000000          0.32863000         -0.13472000
          0.67242000          0.00000000          0.00000000          0.32734000
  1  0  0  1  1
          0.23719000          1.00000000
  1  0  0  1  1
          0.07815000          1.00000000
  1  1  1  7  2
        446.27000000          0.00296130          0.00000000
        104.94000000          0.02259100         -0.00006082
         32.93100000          0.09152400         -0.00126610
         11.80900000          0.20642000         -0.00645890
          4.43040000          0.22195000         -0.00651050
          1.57510000          0.06276500          0.10436000
          0.56412000          0.00000000          0.29184000
  1  1  1  1  1
          0.17015000          1.00000000
  1  1  1  1  1
          0.04839000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.14520000          1.00000000
#  aug-pc-2  EMSL  Basis Set Exchange Library  6/6/08 12:17 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-2
  9
  1  0  0  4  1
         75.42300000          0.00240650
         11.35000000          0.01848700
          2.59930000          0.08974200
          0.73513000          0.28111000
  1  0  0  1  1
          0.23167000          1.00000000
  1  0  0  1  1
          0.07414700          1.00000000
  1  0  0  1  1
          0.02233400          1.00000000
  1  1  1  1  1
          1.60000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.06700100          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
  1  2  2  1  1
          0.08933400          1.00000000
# HELIUM
He aug-pc-2
  9
  1  0  0  4  1
        221.77000000          0.00144090
         33.37500000          0.01089400
          7.61140000          0.05018900
          2.10890000          0.14290000
  1  0  0  1  1
          0.62878000          1.00000000
  1  0  0  1  1
          0.18469000          1.00000000
  1  0  0  1  1
          0.05123000          1.00000000
  1  1  1  1  1
          2.40000000          1.00000000
  1  1  1  1  1
          0.68000000          1.00000000
  1  1  1  1  1
          0.15370000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.20490000          1.00000000
# LITHIUM
Li aug-pc-2
  9
  1  0  0  8  2
       1502.50000000          0.00076137          0.00000000
        225.51000000          0.00587120          0.00002104
         51.37500000          0.02974300         -0.00012177
         14.54700000          0.10959000         -0.00010088
          4.66450000          0.28000000         -0.00844260
          1.60080000          0.44163000         -0.02439400
          0.55262000          0.29922000         -0.09071800
          0.10366000          0.00000000          0.30659000
  1  0  0  1  1
          0.04744200          1.00000000
  1  0  0  1  1
          0.01979000          1.00000000
  1  0  0  1  1
          0.00762000          1.00000000
  1  1  1  3  1
          5.30000000          0.00554503
          1.15000000          0.05509120
          0.29000000          0.08756150
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.02286000          1.00000000
  1  2  2  1  1
          0.26000000          1.00000000
  1  2  2  1  1
          0.03048000          1.00000000
# BERYLLIUM
Be aug-pc-2
  9
  1  0  0  8  2
       3067.30000000          0.00032683          0.00000000
        460.24000000          0.00252340          0.00000139
        104.80000000          0.01286700         -0.00003643
         29.65700000          0.04860700         -0.00033196
          9.53650000          0.13111000         -0.00366180
          3.31060000          0.22124000         -0.01754000
          1.18040000          0.16345000         -0.04090500
          0.26871000          0.00000000          0.11357000
  1  0  0  1  1
          0.11774000          1.00000000
  1  0  0  1  1
          0.04468500          1.00000000
  1  0  0  1  1
          0.01576000          1.00000000
  1  1  1  3  1
          8.24000000          0.01114710
          1.79000000          0.08054940
          0.45000000          0.25574400
  1  1  1  1  1
          0.14000000          1.00000000
  1  1  1  1  1
          0.04728000          1.00000000
  1  2  2  1  1
          0.39000000          1.00000000
  1  2  2  1  1
          0.06304000          1.00000000
# BORON
B  aug-pc-2
 13
  1  0  0  8  2
       5220.40000000          0.00059530          0.00000000
        783.19000000          0.00459910          0.00000166
        178.31000000          0.02353000         -0.00006852
         50.46900000          0.09001500         -0.00068751
         16.28500000          0.24988000         -0.00736900
          5.68850000          0.44237000         -0.03709800
          2.04950000          0.34536000         -0.08698600
          0.51473000          0.00000000          0.21361000
  1  0  0  1  1
          0.21556000          1.00000000
  1  0  0  1  1
          0.07745700          1.00000000
  1  0  0  1  1
          0.02597000          1.00000000
  1  1  1  4  1
         21.81000000          0.00588410
          4.89300000          0.04179800
          1.39760000          0.15567000
          0.47747000          0.35997000
  1  1  1  1  1
          0.16419000          1.00000000
  1  1  1  1  1
          0.05400400          1.00000000
  1  1  1  1  1
          0.01667000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.05001000          1.00000000
  1  3  3  1  1
          0.87000000          1.00000000
  1  3  3  1  1
          0.06668000          1.00000000
# CARBON
C  aug-pc-2
 13
  1  0  0  8  2
       7857.10000000          0.00056825          0.00000000
       1178.70000000          0.00439150         -0.00000059
        268.32000000          0.02250400         -0.00006275
         75.94800000          0.08665300         -0.00075773
         24.55900000          0.24405000         -0.00733080
          8.62120000          0.44148000         -0.03893200
          3.12780000          0.35332000         -0.08890800
          0.82202000          0.00000000          0.21689000
  1  0  0  1  1
          0.33017000          1.00000000
  1  0  0  1  1
          0.11463000          1.00000000
  1  0  0  1  1
          0.03721700          1.00000000
  1  1  1  4  1
         33.77500000          0.00602940
          7.67660000          0.04322800
          2.23570000          0.16301000
          0.76447000          0.36504000
  1  1  1  1  1
          0.26232000          1.00000000
  1  1  1  1  1
          0.08463800          1.00000000
  1  1  1  1  1
          0.02644900          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.07934800          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.10580000          1.00000000
# NITROGEN
N  aug-pc-2
 13
  1  0  0  8  2
      11101.00000000          0.00054570          0.00000000
       1665.30000000          0.00421810         -0.00000150
        379.08000000          0.02164500         -0.00005875
        107.30000000          0.08377600         -0.00077453
         34.74700000          0.23881000         -0.00721610
         12.24900000          0.43994000         -0.03933800
          4.47430000          0.36364000         -0.09061100
          1.24040000          0.00000000          0.19882000
  1  0  0  1  1
          0.48743000          1.00000000
  1  0  0  1  1
          0.16484000          1.00000000
  1  0  0  1  1
          0.05216500          1.00000000
  1  1  1  4  1
         47.93400000          0.00617060
         10.99900000          0.04426000
          3.24720000          0.16825000
          1.11140000          0.36848000
  1  1  1  1  1
          0.37988000          1.00000000
  1  1  1  1  1
          0.12068000          1.00000000
  1  1  1  1  1
          0.03602300          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.10807000          1.00000000
  1  3  3  1  1
          1.02000000          1.00000000
  1  3  3  1  1
          0.14409000          1.00000000
# OXYGEN
O  aug-pc-2
 13
  1  0  0  8  2
      14782.00000000          0.00053519          0.00000000
       2217.30000000          0.00413750         -0.00000193
        504.74000000          0.02124500         -0.00005796
        142.87000000          0.08245300         -0.00079494
         46.30000000          0.23671000         -0.00731250
         16.33700000          0.44039000         -0.04057400
          5.98280000          0.36465000         -0.09159400
          1.67180000          0.00000000          0.20940000
  1  0  0  1  1
          0.64662000          1.00000000
  1  0  0  1  1
          0.21669000          1.00000000
  1  0  0  1  1
          0.06814100          1.00000000
  1  1  1  4  1
         60.42400000          0.00689490
         13.93500000          0.04900500
          4.15310000          0.18255000
          1.41580000          0.37633000
  1  1  1  1  1
          0.47549000          1.00000000
  1  1  1  1  1
          0.14529000          1.00000000
  1  1  1  1  1
          0.04187100          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.12561000          1.00000000
  1  3  3  1  1
          1.10000000          1.00000000
  1  3  3  1  1
          0.16748000          1.00000000
# FLUORINE
F  aug-pc-2
 13
  1  0  0  8  2
      19127.00000000          0.00052250          0.00000000
       2868.90000000          0.00404000         -0.00000226
        653.04000000          0.02075900         -0.00005664
        184.85000000          0.08080000         -0.00079782
         59.94900000          0.23362000         -0.00727130
         21.19000000          0.43965000         -0.04083100
          7.78460000          0.37041000         -0.09293100
          2.23050000          0.00000000          0.20228000
  1  0  0  1  1
          0.85409000          1.00000000
  1  0  0  1  1
          0.28336000          1.00000000
  1  0  0  1  1
          0.08827600          1.00000000
  1  1  1  4  1
         77.63900000          0.00703130
         17.96500000          0.05013700
          5.40050000          0.18553000
          1.84230000          0.37546000
  1  1  1  1  1
          0.61532000          1.00000000
  1  1  1  1  1
          0.18489000          1.00000000
  1  1  1  1  1
          0.05237600          1.00000000
  1  2  2  1  1
          2.80000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.15713000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.20951000          1.00000000
# NEON
Ne aug-pc-2
 13
  1  0  0  8  2
      23880.00000000          0.00025835          0.00000000
       3581.70000000          0.00199770         -0.00000765
        815.27000000          0.01026900         -0.00013638
        230.77000000          0.04003600         -0.00206690
         74.88400000          0.11619000         -0.01814000
         26.51800000          0.21959000         -0.10379000
          9.76920000          0.18608000         -0.23283000
          2.83050000          0.00000000          0.50798000
  1  0  0  1  1
          1.07400000          1.00000000
  1  0  0  1  1
          0.35400000          1.00000000
  1  0  0  1  1
          0.10950000          1.00000000
  1  1  1  4  1
         97.10600000          0.00356680
         22.54300000          0.02546700
          6.81730000          0.09401600
          2.32630000          0.18796000
  1  1  1  1  1
          0.77425000          1.00000000
  1  1  1  1  1
          0.23026000          1.00000000
  1  1  1  1  1
          0.06462000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  2  2  1  1
          0.19390000          1.00000000
  1  3  3  1  1
          1.30000000          1.00000000
  1  3  3  1  1
          0.25850000          1.00000000
# SODIUM
Na aug-pc-2
 10
  1  0  0 11  3
      64474.00000000          0.00019020          0.00000000          0.00000000
       9667.50000000          0.00147490          0.00000000          0.00000000
       2200.80000000          0.00767780         -0.00001388          0.00000450
        623.26000000          0.03133300         -0.00014242          0.00005447
        203.12000000          0.10269000         -0.00181590          0.00061058
         72.94400000          0.25598000         -0.01209300          0.00417240
         28.02600000          0.41517000         -0.05682300          0.01823100
         11.05500000          0.30473000         -0.10110000          0.02901700
          3.54900000          0.04114600          0.22498000         -0.05293200
          1.40820000          0.00000000          0.51711000          0.16965000
          0.51148000          0.00000000          0.00000000          0.88478000
  1  0  0  1  1
          0.06953400          1.00000000
  1  0  0  1  1
          0.02512000          1.00000000
  1  0  0  1  1
          0.00846300          1.00000000
  1  1  1  7  1
        230.53000000          0.00254200
         54.20100000          0.01976800
         17.40200000          0.08348000
          6.31520000          0.23282000
          2.40840000          0.38216000
          0.90249000          0.37985000
          0.31450000          0.16287000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03900000          1.00000000
  1  1  1  1  1
          0.01300000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
  1  2  2  1  1
          0.03385000          1.00000000
# MAGNESIUM
Mg aug-pc-2
 10
  1  0  0 11  3
      81017.00000000          0.00008905          0.00000000          0.00000000
      12143.00000000          0.00069088         -0.00000052          0.00000000
       2763.80000000          0.00359990         -0.00000408         -0.00001191
        782.58000000          0.01472100         -0.00008248         -0.00014781
        255.03000000          0.04857200         -0.00070727         -0.00168720
         91.62300000          0.12279000         -0.00549130         -0.01186400
         35.24500000          0.20506000         -0.02385900         -0.05598300
         13.96000000          0.15913000         -0.04982700         -0.11311000
          4.74220000          0.02509900          0.08349700          0.18789000
          1.92840000          0.00000000          0.19563000          0.71752000
          0.72424000          0.00000000          0.00000000          0.53956000
  1  0  0  1  1
          0.12353000          1.00000000
  1  0  0  1  1
          0.04303200          1.00000000
  1  0  0  1  1
          0.01401000          1.00000000
  1  1  1  7  1
        309.05000000          0.00111300
         72.89400000          0.00875690
         23.49400000          0.03825400
          8.56190000          0.11095000
          3.30680000          0.19174000
          1.26940000          0.19457000
          0.46106000          0.07820400
  1  1  1  1  1
          0.17700000          1.00000000
  1  1  1  1  1
          0.05700000          1.00000000
  1  1  1  1  1
          0.01900000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.05605000          1.00000000
# ALUMINUM
Al aug-pc-2
 13
  1  0  0 11  3
      99741.00000000          0.00016809          0.00000000          0.00000000
      14949.00000000          0.00130410         -0.00000048          0.00000000
       3402.50000000          0.00679790         -0.00000205         -0.00000556
        963.53000000          0.02784000         -0.00005573         -0.00006905
        314.05000000          0.09235800         -0.00041853         -0.00079085
        112.88000000          0.23633000         -0.00348130         -0.00564140
         43.47400000          0.40484000         -0.01486400         -0.02728800
         17.29200000          0.32992000         -0.03401200         -0.05953800
          6.16220000          0.05852100          0.04389600          0.07239300
          2.52260000          0.00000000          0.11958000          0.41226000
          0.96874000          0.00000000          0.00000000          0.39165000
  1  0  0  1  1
          0.19251000          1.00000000
  1  0  0  1  1
          0.06781300          1.00000000
  1  0  0  1  1
          0.02231000          1.00000000
  1  1  1  8  2
        579.71000000          0.00105610          0.00000000
        137.54000000          0.00863350          0.00002967
         44.06700000          0.04322700         -0.00010593
         16.14800000          0.14168000         -0.00017370
          6.48880000          0.30352000         -0.00443150
          2.66320000          0.40389000         -0.00441340
          1.07920000          0.28642000         -0.00107230
          0.39771000          0.00000000          0.17650000
  1  1  1  1  1
          0.13475000          1.00000000
  1  1  1  1  1
          0.04218500          1.00000000
  1  1  1  1  1
          0.01243000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          0.03729000          1.00000000
  1  3  3  1  1
          0.48000000          1.00000000
  1  3  3  1  1
          0.04972000          1.00000000
# SILICON
Si aug-pc-2
 13
  1  0  0 11  3
     120040.00000000          0.00016075          0.00000000          0.00000000
      17991.00000000          0.00124720         -0.00000068          0.00000000
       4094.80000000          0.00650400         -0.00000211         -0.00000399
       1159.60000000          0.02666500         -0.00006916         -0.00005020
        378.00000000          0.08881600         -0.00048080         -0.00057553
        135.93000000          0.22932000         -0.00416940         -0.00415240
         52.41100000          0.40025000         -0.01767400         -0.02043700
         20.92700000          0.33828000         -0.04289100         -0.04699800
          7.71300000          0.06551200          0.04536800          0.04398600
          3.16040000          0.00000000          0.13904000          0.33957000
          1.23480000          0.00000000          0.00000000          0.35038000
  1  0  0  1  1
          0.26775000          1.00000000
  1  0  0  1  1
          0.09406700          1.00000000
  1  0  0  1  1
          0.03087800          1.00000000
  1  1  1  8  2
        677.13000000          0.00109250          0.00000000
        160.67000000          0.00896010          0.00000790
         51.58500000          0.04474400         -0.00013613
         18.94800000          0.14748000         -0.00090378
          7.61630000          0.31480000         -0.00558630
          3.13170000          0.41339000         -0.01014100
          1.27030000          0.26440000          0.01866100
          0.43332000          0.00000000          0.28890000
  1  1  1  1  1
          0.16088000          1.00000000
  1  1  1  1  1
          0.05488300          1.00000000
  1  1  1  1  1
          0.01752700          1.00000000
  1  2  2  1  1
          1.68000000          1.00000000
  1  2  2  1  1
          0.38000000          1.00000000
  1  2  2  1  1
          0.05258000          1.00000000
  1  3  3  1  1
          0.54000000          1.00000000
  1  3  3  1  1
          0.07010700          1.00000000
# PHOSPHOROUS
P  aug-pc-2
 13
  1  0  0 11  3
     145680.00000000          0.00015016          0.00000000          0.00000000
      21836.00000000          0.00116500         -0.00000105          0.00000000
       4969.90000000          0.00607980         -0.00000168         -0.00000249
       1407.30000000          0.02496800         -0.00008760         -0.00003095
        458.78000000          0.08363700         -0.00052745         -0.00035776
        165.08000000          0.21863000         -0.00495750         -0.00261230
         63.74400000          0.39234000         -0.02053500         -0.01320400
         25.59800000          0.35038000         -0.05503000         -0.03284800
          9.93070000          0.07728700          0.04158300          0.01818200
          3.96860000          0.00000000          0.17029000          0.25722000
          1.55650000          0.00000000          0.00000000          0.30682000
  1  0  0  1  1
          0.35404000          1.00000000
  1  0  0  1  1
          0.12394000          1.00000000
  1  0  0  1  1
          0.04054800          1.00000000
  1  1  1  8  2
        826.23000000          0.00102250          0.00000000
        196.02000000          0.00844720          0.00000411
         62.95100000          0.04266400         -0.00015057
         23.22200000          0.14239000         -0.00111410
          9.38850000          0.31059000         -0.00649420
          3.89970000          0.41672000         -0.01246900
          1.60480000          0.26618000          0.02345800
          0.56053000          0.00000000          0.32270000
  1  1  1  1  1
          0.21175000          1.00000000
  1  1  1  1  1
          0.07348600          1.00000000
  1  1  1  1  1
          0.02384800          1.00000000
  1  2  2  1  1
          1.89000000          1.00000000
  1  2  2  1  1
          0.43000000          1.00000000
  1  2  2  1  1
          0.07154300          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  3  3  1  1
          0.09539000          1.00000000
# SULFUR
S  aug-pc-2
 13
  1  0  0 11  3
     172030.00000000          0.00014353          0.00000000          0.00000000
      25783.00000000          0.00111370         -0.00000119          0.00000000
       5868.20000000          0.00581430         -0.00000123         -0.00000220
       1661.70000000          0.02390300         -0.00009048         -0.00002837
        541.75000000          0.08035400         -0.00050105         -0.00032591
        195.01000000          0.21175000         -0.00495100         -0.00241310
         75.39600000          0.38664000         -0.02025200         -0.01235200
         30.40700000          0.35747000         -0.05738800         -0.03211900
         12.12100000          0.08613100          0.03484700          0.01161100
          4.77770000          0.00000000          0.16833000          0.25542000
          1.89060000          0.00000000          0.00000000          0.31384000
  1  0  0  1  1
          0.44686000          1.00000000
  1  0  0  1  1
          0.15621000          1.00000000
  1  0  0  1  1
          0.05103700          1.00000000
  1  1  1  8  2
        968.12000000          0.00100480          0.00000000
        229.70000000          0.00833130         -0.00000807
         73.83300000          0.04226000         -0.00016943
         27.31200000          0.14206000         -0.00152430
         11.07400000          0.31256000         -0.00719930
          4.63070000          0.41933000         -0.01611300
          1.92990000          0.25924000          0.03423400
          0.68783000          0.00000000          0.35518000
  1  1  1  1  1
          0.25663000          1.00000000
  1  1  1  1  1
          0.08725100          1.00000000
  1  1  1  1  1
          0.02777600          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.08332700          1.00000000
  1  3  3  1  1
          0.66000000          1.00000000
  1  3  3  1  1
          0.11110000          1.00000000
# CHLORINE
Cl aug-pc-2
 13
  1  0  0 11  3
     201150.00000000          0.00013753          0.00000000          0.00000000
      30146.00000000          0.00106710         -0.00000134          0.00000000
       6861.00000000          0.00557370         -0.00000095         -0.00000197
       1942.80000000          0.02293500         -0.00009465         -0.00002487
        633.42000000          0.07735400         -0.00048337         -0.00028967
        228.10000000          0.20534000         -0.00500090         -0.00215130
         88.28800000          0.38093000         -0.02023000         -0.01119500
         35.75000000          0.36361000         -0.06020900         -0.03018000
         14.57100000          0.09518200          0.02919500          0.00594560
          5.65800000          0.00000000          0.16993000          0.24702000
          2.25540000          0.00000000          0.00000000          0.31412000
  1  0  0  1  1
          0.54947000          1.00000000
  1  0  0  1  1
          0.19126000          1.00000000
  1  0  0  1  1
          0.06224100          1.00000000
  1  1  1  8  2
       1129.90000000          0.00097621          0.00000000
        268.06000000          0.00812600         -0.00001160
         86.22200000          0.04143300         -0.00018289
         31.97900000          0.14035000         -0.00171700
         13.00800000          0.31207000         -0.00789740
          5.47660000          0.42099000         -0.01823700
          2.30900000          0.25664000          0.04003500
          0.84601000          0.00000000          0.36717000
  1  1  1  1  1
          0.31659000          1.00000000
  1  1  1  1  1
          0.10716000          1.00000000
  1  1  1  1  1
          0.03397000          1.00000000
  1  2  2  1  1
          2.31000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.10191000          1.00000000
  1  3  3  1  1
          0.72000000          1.00000000
  1  3  3  1  1
          0.13588000          1.00000000
# ARGON
Ar aug-pc-2
 13
  1  0  0 11  3
     232510.00000000          0.00006626          0.00000000          0.00000000
      34844.00000000          0.00051412         -0.00000706          0.00000000
       7930.30000000          0.00268610         -0.00000242         -0.00000094
       2245.70000000          0.01106200         -0.00047564         -0.00001183
        732.22000000          0.03740800         -0.00227710         -0.00013817
        263.77000000          0.09992800         -0.02452700         -0.00103240
        102.19000000          0.18788000         -0.09819400         -0.00543290
         41.52500000          0.18427000         -0.30459000         -0.01508500
         17.20200000          0.05178200          0.11940000          0.00111200
          6.59670000          0.00000000          0.83173000          0.12461000
          2.64770000          0.00000000          0.00000000          0.16083000
  1  0  0  1  1
          0.66193000          1.00000000
  1  0  0  1  1
          0.22901000          1.00000000
  1  0  0  1  1
          0.07411000          1.00000000
  1  1  1  8  2
       1297.70000000          0.00047997          0.00000000
        307.86000000          0.00400670         -0.00000664
         99.09600000          0.02049700         -0.00009881
         36.83700000          0.06981900         -0.00093571
         15.02700000          0.15625000         -0.00431330
          6.36620000          0.21099000         -0.00986480
          2.71100000          0.12665000          0.02233400
          1.01820000          0.00000000          0.18833000
  1  1  1  1  1
          0.38274000          1.00000000
  1  1  1  1  1
          0.12946000          1.00000000
  1  1  1  1  1
          0.04101000          1.00000000
  1  2  2  1  1
          2.52000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.12300000          1.00000000
  1  3  3  1  1
          0.78000000          1.00000000
  1  3  3  1  1
          0.16400000          1.00000000
#  aug-pc-3  EMSL  Basis Set Exchange Library  6/6/08 12:18 AM
# Elements                             References
# --------                             ----------
# :  .
#
# HYDROGEN
H  aug-pc-3
 16
  1  0  0  5  1
        774.69000000          0.00131630
        116.16000000          0.01022600
         26.44900000          0.05362900
          7.50150000          0.22285000
          2.45680000          0.75374000
  1  0  0  1  1
          0.88774000          1.00000000
  1  0  0  1  1
          0.34085000          1.00000000
  1  0  0  1  1
          0.13477000          1.00000000
  1  0  0  1  1
          0.05226300          1.00000000
  1  0  0  1  1
          0.01880000          1.00000000
  1  1  1  1  1
          6.50000000          1.00000000
  1  1  1  1  1
          1.55000000          1.00000000
  1  1  1  1  1
          0.55000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  1  1  1  1
          0.05639900          1.00000000
  1  2  2  1  1
          1.95000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.07519900          1.00000000
  1  3  3  1  1
          2.20000000          1.00000000
  1  3  3  1  1
          0.09399900          1.00000000
# HELIUM
He aug-pc-3
 16
  1  0  0  5  1
       2167.40000000          0.00084153
        324.99000000          0.00652740
         73.99400000          0.03399500
         20.97500000          0.13811000
          6.84520000          0.44195000
  1  0  0  1  1
          2.43940000          1.00000000
  1  0  0  1  1
          0.90251000          1.00000000
  1  0  0  1  1
          0.33313000          1.00000000
  1  0  0  1  1
          0.12413000          1.00000000
  1  0  0  1  1
          0.04304000          1.00000000
  1  1  1  1  1
         10.70000000          1.00000000
  1  1  1  1  1
          2.55000000          1.00000000
  1  1  1  1  1
          0.90000000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          0.12910000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.07000000          1.00000000
  1  2  2  1  1
          0.17220000          1.00000000
  1  3  3  1  1
          3.20000000          1.00000000
  1  3  3  1  1
          0.21520000          1.00000000
# LITHIUM
Li aug-pc-3
 15
  1  0  0 10  2
      13018.00000000          0.00005145          0.00000000
       1950.10000000          0.00039716          0.00000153
        443.84000000          0.00210140         -0.00000310
        125.76000000          0.00864300          0.00005703
         41.09400000          0.03057700         -0.00003847
         14.88200000          0.08539700          0.00143160
          5.80750000          0.19415000          0.00164970
          2.38910000          0.28592000          0.02368500
          1.01840000          0.30530000          0.02024700
          0.44404000          0.00000000          0.10064000
  1  0  0  1  1
          0.19405000          1.00000000
  1  0  0  1  1
          0.08403900          1.00000000
  1  0  0  1  1
          0.03792100          1.00000000
  1  0  0  1  1
          0.01664000          1.00000000
  1  0  0  1  1
          0.00671300          1.00000000
  1  1  1  4  1
         15.40000000          0.00102953
          3.59000000          0.00833218
          1.09000000          0.02929890
          0.35000000          0.11954800
  1  1  1  1  1
          0.13000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  1  1  1  1
          0.02014000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.02685000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.03357000          1.00000000
# BERYLLIUM
Be aug-pc-3
 15
  1  0  0 10  2
      26673.00000000          0.00002197          0.00000000
       3996.30000000          0.00016954          0.00000493
        909.67000000          0.00089757         -0.00000913
        257.77000000          0.00369380          0.00019440
         84.23400000          0.01314100          0.00000956
         30.54500000          0.03717900          0.00570280
         12.02000000          0.08599900          0.01234400
          5.04950000          0.13048000          0.10403000
          2.17190000          0.13871000          0.18882000
          0.93410000          0.00000000          0.42111000
  1  0  0  1  1
          0.38918000          1.00000000
  1  0  0  1  1
          0.17402000          1.00000000
  1  0  0  1  1
          0.07602800          1.00000000
  1  0  0  1  1
          0.03226500          1.00000000
  1  0  0  1  1
          0.01262000          1.00000000
  1  1  1  4  1
         27.80000000          0.00146992
          6.46000000          0.01290300
          1.96000000          0.04633670
          0.63000000          0.18363000
  1  1  1  1  1
          0.24000000          1.00000000
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.03780000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.05040000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
  1  3  3  1  1
          0.06300000          1.00000000
# BORON
B  aug-pc-3
 22
  1  0  0 10  2
      57415.00000000          0.00002984          0.00000000
       8601.50000000          0.00023044          0.00000428
       1957.80000000          0.00121950         -0.00000707
        554.61000000          0.00504630          0.00017669
        181.05000000          0.01812300          0.00013538
         65.49100000          0.05331800          0.00601230
         25.59900000          0.13277000          0.01984700
         10.53200000          0.23069000          0.14467000
          4.44650000          0.25545000          0.39360000
          1.88320000          0.00000000          0.80698000
  1  0  0  1  1
          0.69831000          1.00000000
  1  0  0  1  1
          0.34310000          1.00000000
  1  0  0  1  1
          0.14276000          1.00000000
  1  0  0  1  1
          0.05815700          1.00000000
  1  0  0  1  1
          0.02191000          1.00000000
  1  1  1  5  1
         90.11100000          0.00055817
         21.16500000          0.00455240
          6.56180000          0.02231300
          2.56460000          0.05947100
          1.05100000          0.16256000
  1  1  1  1  1
          0.45193000          1.00000000
  1  1  1  1  1
          0.19468000          1.00000000
  1  1  1  1  1
          0.08321200          1.00000000
  1  1  1  1  1
          0.03329700          1.00000000
  1  1  1  1  1
          0.01234000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.03701000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.52000000          1.00000000
  1  3  3  1  1
          0.04935000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  4  4  1  1
          0.06168000          1.00000000
# CARBON
C  aug-pc-3
 22
  1  0  0 10  2
      87141.00000000          0.00002818          0.00000000
      13052.00000000          0.00021819          0.00000259
       2970.60000000          0.00115110         -0.00000309
        841.46000000          0.00478590          0.00012247
        274.59000000          0.01713400          0.00025494
         99.21500000          0.05112000          0.00512540
         38.69400000          0.12805000          0.02195500
         15.91100000          0.22773000          0.14112000
          6.76680000          0.24758000          0.41303000
          2.89840000          0.00000000          0.82714000
  1  0  0  1  1
          1.12460000          1.00000000
  1  0  0  1  1
          0.51446000          1.00000000
  1  0  0  1  1
          0.21176000          1.00000000
  1  0  0  1  1
          0.08501700          1.00000000
  1  0  0  1  1
          0.03160500          1.00000000
  1  1  1  5  1
        148.24000000          0.00050756
         34.91200000          0.00421260
         10.89400000          0.02133500
          4.19340000          0.06232900
          1.71340000          0.16642000
  1  1  1  1  1
          0.73566000          1.00000000
  1  1  1  1  1
          0.31637000          1.00000000
  1  1  1  1  1
          0.13242000          1.00000000
  1  1  1  1  1
          0.05190100          1.00000000
  1  1  1  1  1
          0.01887300          1.00000000
  1  2  2  1  1
          5.20000000          1.00000000
  1  2  2  1  1
          1.35000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05661900          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          0.07549200          1.00000000
  1  4  4  1  1
          1.40000000          1.00000000
  1  4  4  1  1
          0.09436500          1.00000000
# NITROGEN
N  aug-pc-3
 22
  1  0  0 10  2
     124550.00000000          0.00002667          0.00000000
      18656.00000000          0.00020684          0.00000141
       4245.10000000          0.00108930          0.00000000
       1202.10000000          0.00454630          0.00008144
        392.14000000          0.01623700          0.00032439
        141.58000000          0.04895700          0.00436210
         55.13600000          0.12317000          0.02283800
         22.64300000          0.22425000          0.13462000
          9.65660000          0.23876000          0.42501000
          4.16850000          0.00000000          0.82517000
  1  0  0  1  1
          1.66780000          1.00000000
  1  0  0  1  1
          0.74574000          1.00000000
  1  0  0  1  1
          0.30516000          1.00000000
  1  0  0  1  1
          0.12089000          1.00000000
  1  0  0  1  1
          0.04444400          1.00000000
  1  1  1  5  1
        218.29000000          0.00048281
         51.48800000          0.00404200
         16.13000000          0.02094600
          6.13070000          0.06475700
          2.50520000          0.17042000
  1  1  1  1  1
          1.07300000          1.00000000
  1  1  1  1  1
          0.45838000          1.00000000
  1  1  1  1  1
          0.18948000          1.00000000
  1  1  1  1  1
          0.07335900          1.00000000
  1  1  1  1  1
          0.02638800          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          1.65000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.07916400          1.00000000
  1  3  3  1  1
          1.80000000          1.00000000
  1  3  3  1  1
          0.77000000          1.00000000
  1  3  3  1  1
          0.10555000          1.00000000
  1  4  4  1  1
          1.50000000          1.00000000
  1  4  4  1  1
          0.13194000          1.00000000
# OXYGEN
O  aug-pc-3
 22
  1  0  0 10  2
     164030.00000000          0.00002652          0.00000000
      24567.00000000          0.00020571          0.00000133
       5591.00000000          0.00108270          0.00000000
       1583.60000000          0.00451900          0.00008025
        516.67000000          0.01613500          0.00034512
        186.56000000          0.04871600          0.00444840
         72.69600000          0.12268000          0.02360100
         29.99200000          0.22189000          0.13861000
         12.89900000          0.23904000          0.42872000
          5.61350000          0.00000000          0.84873000
  1  0  0  1  1
          2.29860000          1.00000000
  1  0  0  1  1
          0.99980000          1.00000000
  1  0  0  1  1
          0.40746000          1.00000000
  1  0  0  1  1
          0.15922000          1.00000000
  1  0  0  1  1
          0.05769000          1.00000000
  1  1  1  5  1
        272.02000000          0.00054941
         64.24300000          0.00458340
         20.24900000          0.02357300
          7.64380000          0.07433800
          3.12320000          0.18755000
  1  1  1  1  1
          1.32510000          1.00000000
  1  1  1  1  1
          0.55551000          1.00000000
  1  1  1  1  1
          0.22229000          1.00000000
  1  1  1  1  1
          0.08401000          1.00000000
  1  1  1  1  1
          0.02947700          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.08843100          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.11791000          1.00000000
  1  4  4  1  1
          1.60000000          1.00000000
  1  4  4  1  1
          0.14739000          1.00000000
# FLUORINE
F  aug-pc-3
 22
  1  0  0 10  2
     215660.00000000          0.00002538          0.00000000
      32299.00000000          0.00019693          0.00000102
       7350.40000000          0.00103600          0.00000000
       2081.80000000          0.00432940          0.00006810
        679.09000000          0.01546200          0.00034620
        245.10000000          0.04690300          0.00413970
         95.46200000          0.11881000          0.02307300
         39.42200000          0.21711000          0.13395000
         17.01800000          0.23699000          0.42246000
          7.45250000          0.00000000          0.85999000
  1  0  0  1  1
          3.13290000          1.00000000
  1  0  0  1  1
          1.33950000          1.00000000
  1  0  0  1  1
          0.54218000          1.00000000
  1  0  0  1  1
          0.20904000          1.00000000
  1  0  0  1  1
          0.07492400          1.00000000
  1  1  1  5  1
        351.22000000          0.00055263
         82.97800000          0.00462850
         26.26700000          0.02380200
          9.93070000          0.07626200
          4.06700000          0.18964000
  1  1  1  1  1
          1.72460000          1.00000000
  1  1  1  1  1
          0.71976000          1.00000000
  1  1  1  1  1
          0.28624000          1.00000000
  1  1  1  1  1
          0.10789000          1.00000000
  1  1  1  1  1
          0.03785600          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.11357000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.05000000          1.00000000
  1  3  3  1  1
          0.15142000          1.00000000
  1  4  4  1  1
          1.70000000          1.00000000
  1  4  4  1  1
          0.18928000          1.00000000
# NEON
Ne aug-pc-3
 22
  1  0  0 10  2
     270660.00000000          0.00001247          0.00000000
      40541.00000000          0.00009678          0.00000000
       9226.50000000          0.00050863          0.00000065
       2613.20000000          0.00212860          0.00002741
        852.39000000          0.00759220          0.00018661
        307.61000000          0.02311600          0.00194920
        119.76000000          0.05861400          0.01177300
         49.43700000          0.10807000          0.06614600
         21.36900000          0.11660000          0.21457000
          9.39210000          0.00000000          0.42987000
  1  0  0  1  1
          3.98320000          1.00000000
  1  0  0  1  1
          1.68870000          1.00000000
  1  0  0  1  1
          0.68030000          1.00000000
  1  0  0  1  1
          0.26024000          1.00000000
  1  0  0  1  1
          0.09248000          1.00000000
  1  1  1  5  1
        443.45000000          0.00274680
        104.82000000          0.02308100
         33.25500000          0.11930000
         12.54800000          0.38863000
          5.14210000          0.95790000
  1  1  1  1  1
          2.17830000          1.00000000
  1  1  1  1  1
          0.90645000          1.00000000
  1  1  1  1  1
          0.35994000          1.00000000
  1  1  1  1  1
          0.13515000          1.00000000
  1  1  1  1  1
          0.04721000          1.00000000
  1  2  2  1  1
         10.00000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.15000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.14160000          1.00000000
  1  3  3  1  1
          2.80000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.18880000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  4  4  1  1
          0.23600000          1.00000000
# SODIUM
Na aug-pc-3
 15
  1  0  0 14  3
     421840.00000000          0.00001821          0.00000000          0.00000000
      63188.00000000          0.00014153          0.00000000          0.00000000
      14381.00000000          0.00074380          0.00000000          0.00000000
       4073.70000000          0.00312730         -0.00000659          0.00000000
       1329.10000000          0.01124900         -0.00001064         -0.00000126
        479.99000000          0.03529200         -0.00026565         -0.00001103
        187.36000000          0.09539000         -0.00112860         -0.00007692
         77.77000000          0.21001000         -0.00804960         -0.00043274
         33.79900000          0.34417000         -0.02603700         -0.00169970
         15.12700000          0.32701000         -0.07062200         -0.00435420
          6.93200000          0.12122000         -0.01221700         -0.00178400
          2.76510000          0.00644090          0.26047000          0.02523700
          1.13970000          0.00000000          0.35925000          0.07668600
          0.45213000          0.00000000          0.00000000          0.11132000
  1  0  0  1  1
          0.08260300          1.00000000
  1  0  0  1  1
          0.04151000          1.00000000
  1  0  0  1  1
          0.01861800          1.00000000
  1  0  0  1  1
          0.00765800          1.00000000
  1  1  1  9  1
       1156.80000000          0.00015835
        274.42000000          0.00137160
         89.13900000          0.00740860
         33.25900000          0.03121400
         13.55700000          0.09092000
          5.96240000          0.20137000
          2.68240000          0.30732000
          1.19710000          0.33347000
          0.51789000          0.22947000
  1  1  1  1  1
          0.21331000          1.00000000
  1  1  1  1  1
          0.10000000          1.00000000
  1  1  1  1  1
          0.03700000          1.00000000
  1  1  1  1  1
          0.01233000          1.00000000
  1  2  2  1  1
          0.91000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  2  2  1  1
          0.03063000          1.00000000
  1  3  3  1  1
          0.27000000          1.00000000
  1  3  3  1  1
          0.03829000          1.00000000
# MAGNESIUM
Mg aug-pc-3
 15
  1  0  0 14  3
     564790.00000000          0.00000788          0.00000000          0.00000000
      84589.00000000          0.00006122          0.00000000          0.00000000
      19251.00000000          0.00032179          0.00000000          0.00000000
       5452.80000000          0.00135380         -0.00000299          0.00000000
       1779.10000000          0.00487800         -0.00000639          0.00000380
        642.58000000          0.01537600         -0.00013096          0.00003105
        250.92000000          0.04208100         -0.00060781          0.00022284
        104.19000000          0.09518700         -0.00421360          0.00120920
         45.27500000          0.16414000         -0.01490900          0.00476660
         20.31800000          0.17119000         -0.04186800          0.01026900
          9.33190000          0.07662600         -0.02166700          0.00471000
          3.69780000          0.00637870          0.14599000         -0.01339800
          1.57250000          0.00000000          0.20166000          0.23482000
          0.64949000          0.00000000          0.00000000          0.48791000
  1  0  0  1  1
          0.15901000          1.00000000
  1  0  0  1  1
          0.07166500          1.00000000
  1  0  0  1  1
          0.02994200          1.00000000
  1  0  0  1  1
          0.01155000          1.00000000
  1  1  1  9  1
       1516.90000000          0.00007161
        359.79000000          0.00062314
        116.76000000          0.00341360
         43.58000000          0.01453100
         17.92600000          0.04287000
          7.93560000          0.09778900
          3.60380000          0.15457000
          1.64410000          0.16828000
          0.74112000          0.11333000
  1  1  1  1  1
          0.31666000          1.00000000
  1  1  1  1  1
          0.14900000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  1  1  1  1
          0.01833000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.04619000          1.00000000
  1  3  3  1  1
          0.33000000          1.00000000
  1  3  3  1  1
          0.05774500          1.00000000
# ALUMINUM
Al aug-pc-3
 20
  1  0  0 14  3
     721490.00000000          0.00001419          0.00000000          0.00000000
     108090.00000000          0.00011026          0.00000000          0.00000000
      24605.00000000          0.00057946          0.00000000          0.00000000
       6971.40000000          0.00243790         -0.00000493          0.00000000
       2274.90000000          0.00879450         -0.00000863         -0.00000016
        821.60000000          0.02782100         -0.00020373         -0.00000132
        320.78000000          0.07681600         -0.00091455         -0.00000982
        133.15000000          0.17710000         -0.00657840         -0.00006244
         57.81700000          0.31603000         -0.02395500         -0.00030825
         25.95400000          0.35108000         -0.07103100         -0.00125880
         11.89900000          0.17619000         -0.05045400         -0.00186120
          4.74990000          0.01826800          0.22311000          0.01120900
          2.06880000          0.00000000          0.34708000          0.08354100
          0.87779000          0.00000000          0.00000000          0.13466000
  1  0  0  1  1
          0.24951000          1.00000000
  1  0  0  1  1
          0.11462000          1.00000000
  1  0  0  1  1
          0.04819300          1.00000000
  1  0  0  1  1
          0.01869000          1.00000000
  1  1  1 10  2
       2019.70000000          0.00012156          0.00000000
        478.63000000          0.00106070          0.00005424
        155.02000000          0.00593650         -0.00003765
         57.90400000          0.02538200          0.00089364
         24.14000000          0.07618800         -0.00359030
         10.78900000          0.17997000         -0.00368970
          4.97300000          0.30275000         -0.05406900
          2.31610000          0.34478000         -0.03337300
          1.07910000          0.23763000          0.00454730
          0.49159000          0.00000000          0.87054000
  1  1  1  1  1
          0.20482000          1.00000000
  1  1  1  1  1
          0.07925600          1.00000000
  1  1  1  1  1
          0.02892800          1.00000000
  1  1  1  1  1
          0.00983900          1.00000000
  1  2  2  1  1
          5.60000000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.44000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.02952000          1.00000000
  1  3  3  1  1
          0.96000000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  3  3  1  1
          0.03936000          1.00000000
  1  4  4  1  1
          0.58000000          1.00000000
  1  4  4  1  1
          0.04920000          1.00000000
# SILICON
Si aug-pc-3
 20
  1  0  0 14  3
     877450.00000000          0.00001340          0.00000000          0.00000000
     131450.00000000          0.00010407          0.00000000          0.00000000
      29929.00000000          0.00054678          0.00000000          0.00000000
       8480.20000000          0.00230100         -0.00000422          0.00000000
       2767.20000000          0.00830540         -0.00000634         -0.00000118
        999.40000000          0.02632200         -0.00016910         -0.00001035
        390.14000000          0.07303300         -0.00073715         -0.00007432
        161.91000000          0.17010000         -0.00544610         -0.00043713
         70.30400000          0.30891000         -0.02001000         -0.00193740
         31.57900000          0.35473000         -0.06137300         -0.00585630
         14.48000000          0.18872000         -0.04900200         -0.00683610
          5.83830000          0.02195300          0.17627000          0.02787000
          2.59460000          0.00000000          0.30080000          0.12767000
          1.12500000          0.00000000          0.00000000          0.17422000
  1  0  0  1  1
          0.35356000          1.00000000
  1  0  0  1  1
          0.16160000          1.00000000
  1  0  0  1  1
          0.06726100          1.00000000
  1  0  0  1  1
          0.02610500          1.00000000
  1  1  1 10  2
       2303.10000000          0.00013105          0.00000000
        545.84000000          0.00114650          0.00000612
        177.05000000          0.00636520         -0.00000590
         66.37700000          0.02719700          0.00008645
         27.60100000          0.08192500         -0.00053049
         12.34300000          0.19147000         -0.00089038
          5.68940000          0.31583000         -0.00798250
          2.64060000          0.35183000         -0.00376310
          1.20940000          0.21292000          0.01078700
          0.52013000          0.00000000          0.18186000
  1  1  1  1  1
          0.23256000          1.00000000
  1  1  1  1  1
          0.09814100          1.00000000
  1  1  1  1  1
          0.03836000          1.00000000
  1  1  1  1  1
          0.01456000          1.00000000
  1  2  2  1  1
          6.66000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  2  2  1  1
          0.04368000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.38000000          1.00000000
  1  3  3  1  1
          0.05824000          1.00000000
  1  4  4  1  1
          0.65000000          1.00000000
  1  4  4  1  1
          0.07280000          1.00000000
# PHOSPHOROUS
P  aug-pc-3
 20
  1  0  0 14  3
    1063700.00000000          0.00001251          0.00000000          0.00000000
     160000.00000000          0.00009667          0.00000000          0.00000000
      36513.00000000          0.00050682          0.00000000          0.00000000
      10359.00000000          0.00213100         -0.00000345          0.00000000
       3382.80000000          0.00769250         -0.00000534         -0.00000176
       1222.30000000          0.02442100         -0.00013814         -0.00001580
        477.30000000          0.06812200         -0.00060882         -0.00011353
        198.09000000          0.16069000         -0.00450640         -0.00067329
         85.99400000          0.29867000         -0.01707100         -0.00303140
         38.62700000          0.35878000         -0.05395400         -0.00922920
         17.68800000          0.20616000         -0.05149400         -0.01193600
          7.25510000          0.02738600          0.13758000          0.03572500
          3.26990000          0.00000000          0.27525000          0.15875000
          1.43130000          0.00000000          0.00000000          0.21236000
  1  0  0  1  1
          0.47047000          1.00000000
  1  0  0  1  1
          0.21289000          1.00000000
  1  0  0  1  1
          0.08774200          1.00000000
  1  0  0  1  1
          0.03340800          1.00000000
  1  1  1 10  2
       2762.20000000          0.00012618          0.00000000
        654.78000000          0.00110480          0.00000596
        212.58000000          0.00614830         -0.00000681
         79.89500000          0.02630700          0.00007451
         33.36600000          0.07986600         -0.00060664
         14.98600000          0.18840000         -0.00126040
          6.96800000          0.31362000         -0.00947190
          3.28180000          0.35326000         -0.00440140
          1.52470000          0.21366000          0.01246600
          0.66924000          0.00000000          0.21343000
  1  1  1  1  1
          0.29929000          1.00000000
  1  1  1  1  1
          0.12811000          1.00000000
  1  1  1  1  1
          0.05099200          1.00000000
  1  1  1  1  1
          0.01880000          1.00000000
  1  2  2  1  1
          7.71000000          1.00000000
  1  2  2  1  1
          2.03000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.22000000          1.00000000
  1  2  2  1  1
          0.05639900          1.00000000
  1  3  3  1  1
          1.34000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.07519900          1.00000000
  1  4  4  1  1
          0.72000000          1.00000000
  1  4  4  1  1
          0.09399900          1.00000000
# SULFUR
S  aug-pc-3
 20
  1  0  0 14  3
    1250400.00000000          0.00001202          0.00000000          0.00000000
     188080.00000000          0.00009294          0.00000000          0.00000000
      42918.00000000          0.00048720          0.00000000          0.00000000
      12179.00000000          0.00204790         -0.00000304          0.00000000
       3978.70000000          0.00738970         -0.00000465         -0.00000231
       1438.10000000          0.02348100         -0.00012316         -0.00001956
        561.67000000          0.06568500         -0.00054723         -0.00014386
        233.11000000          0.15597000         -0.00407020         -0.00084419
        101.22000000          0.29322000         -0.01565200         -0.00386210
         45.49300000          0.36011000         -0.05030900         -0.01181300
         20.84700000          0.21506000         -0.05151700         -0.01611400
          8.64920000          0.03078200          0.11823000          0.04149200
          3.94560000          0.00000000          0.25628000          0.18517000
          1.74720000          0.00000000          0.00000000          0.23963000
  1  0  0  1  1
          0.59953000          1.00000000
  1  0  0  1  1
          0.27127000          1.00000000
  1  0  0  1  1
          0.11080000          1.00000000
  1  0  0  1  1
          0.04183700          1.00000000
  1  1  1 10  2
       3285.80000000          0.00012062          0.00000000
        778.93000000          0.00105870          0.00000424
        252.76000000          0.00591910         -0.00000743
         95.10000000          0.02540500          0.00002773
         39.82000000          0.07785900         -0.00065028
         17.92500000          0.18578000         -0.00189330
          8.36990000          0.31347000         -0.01019100
          3.96550000          0.35718000         -0.00762910
          1.85400000          0.21179000          0.02103200
          0.81971000          0.00000000          0.24347000
  1  1  1  1  1
          0.36117000          1.00000000
  1  1  1  1  1
          0.15097000          1.00000000
  1  1  1  1  1
          0.05962000          1.00000000
  1  1  1  1  1
          0.02182000          1.00000000
  1  2  2  1  1
          8.76000000          1.00000000
  1  2  2  1  1
          2.30000000          1.00000000
  1  2  2  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.06546100          1.00000000
  1  3  3  1  1
          1.53000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.08728200          1.00000000
  1  4  4  1  1
          0.79000000          1.00000000
  1  4  4  1  1
          0.10910000          1.00000000
# CHLORINE
Cl aug-pc-3
 20
  1  0  0 14  3
    1461100.00000000          0.00001153          0.00000000          0.00000000
     219590.00000000          0.00008923          0.00000000          0.00000000
      50085.00000000          0.00046811          0.00000000          0.00000000
      14206.00000000          0.00196920         -0.00000271          0.00000000
       4638.90000000          0.00711120         -0.00000432         -0.00000287
       1676.30000000          0.02262500         -0.00010907         -0.00002495
        654.51000000          0.06348800         -0.00048853         -0.00018272
        271.53000000          0.15173000         -0.00363270         -0.00108210
        117.87000000          0.28826000         -0.01414200         -0.00498460
         52.98400000          0.36113000         -0.04616700         -0.01541400
         24.29200000          0.22303000         -0.05010700         -0.02177400
         10.18400000          0.03403100          0.09999900          0.04888100
          4.69280000          0.00000000          0.23750000          0.21808000
          2.09740000          0.00000000          0.00000000          0.27412000
  1  0  0  1  1
          0.74867000          1.00000000
  1  0  0  1  1
          0.33613000          1.00000000
  1  0  0  1  1
          0.13573000          1.00000000
  1  0  0  1  1
          0.05071100          1.00000000
  1  1  1 10  2
       3845.70000000          0.00011653          0.00000000
        911.23000000          0.00102500          0.00000358
        295.64000000          0.00574810         -0.00000778
        111.40000000          0.02470000          0.00000677
         46.76700000          0.07626300         -0.00069394
         21.10600000          0.18343000         -0.00225630
          9.90580000          0.31219000         -0.01101800
          4.73470000          0.35836000         -0.00936630
          2.23640000          0.21176000          0.02517100
          1.00710000          0.00000000          0.25574000
  1  1  1  1  1
          0.44369000          1.00000000
  1  1  1  1  1
          0.18488000          1.00000000
  1  1  1  1  1
          0.07326800          1.00000000
  1  1  1  1  1
          0.02690400          1.00000000
  1  2  2  1  1
          9.81000000          1.00000000
  1  2  2  1  1
          2.58000000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  2  2  1  1
          0.28000000          1.00000000
  1  2  2  1  1
          0.08071100          1.00000000
  1  3  3  1  1
          1.72000000          1.00000000
  1  3  3  1  1
          0.57000000          1.00000000
  1  3  3  1  1
          0.10761000          1.00000000
  1  4  4  1  1
          0.86000000          1.00000000
  1  4  4  1  1
          0.13452000          1.00000000
# ARGON
Ar aug-pc-3
 20
  1  0  0 14  3
    1702200.00000000          0.00000551          0.00000000          0.00000000
     254910.00000000          0.00004283          0.00000000          0.00000000
      58011.00000000          0.00022523          0.00000000          0.00000000
      16431.00000000          0.00094887         -0.00000120          0.00000000
       5360.50000000          0.00343160         -0.00000200         -0.00000162
       1935.40000000          0.01093900         -0.00004943         -0.00001423
        755.09000000          0.03079100         -0.00022448         -0.00010427
        313.08000000          0.07398700         -0.00166520         -0.00062078
        135.88000000          0.14187000         -0.00657890         -0.00288130
         61.09200000          0.18089000         -0.02173400         -0.00902010
         28.02400000          0.11508000         -0.02485100         -0.01322600
         11.86000000          0.01857900          0.04358600          0.02632900
          5.51170000          0.00000000          0.11336000          0.12105000
          2.48220000          0.00000000          0.00000000          0.15170000
  1  0  0  1  1
          0.91761000          1.00000000
  1  0  0  1  1
          0.40703000          1.00000000
  1  0  0  1  1
          0.16238000          1.00000000
  1  0  0  1  1
          0.05999000          1.00000000
  1  1  1 10  2
       4415.50000000          0.00005728          0.00000000
       1046.30000000          0.00050427          0.00000148
        339.54000000          0.00283210         -0.00000423
        128.10000000          0.01218600         -0.00000694
         53.82300000          0.03792400         -0.00037331
         24.30700000          0.09176200         -0.00132140
         11.44000000          0.15656000         -0.00599320
          5.51320000          0.17875000         -0.00517140
          2.63310000          0.10447000          0.01411000
          1.21090000          0.00000000          0.13276000
  1  1  1  1  1
          0.53411000          1.00000000
  1  1  1  1  1
          0.22314000          1.00000000
  1  1  1  1  1
          0.08879200          1.00000000
  1  1  1  1  1
          0.03273000          1.00000000
  1  2  2  1  1
         10.86000000          1.00000000
  1  2  2  1  1
          2.86000000          1.00000000
  1  2  2  1  1
          0.84000000          1.00000000
  1  2  2  1  1
          0.31000000          1.00000000
  1  2  2  1  1
          0.09819000          1.00000000
  1  3  3  1  1
          1.91000000          1.00000000
  1  3  3  1  1
          0.63000000          1.00000000
  1  3  3  1  1
          0.13090000          1.00000000
  1  4  4  1  1
          0.93000000          1.00000000
  1  4  4  1  1
          0.16360000          1.00000000
#  aug-pc-4  EMSL  Basis Set Exchange Library  6/6/08 12:18 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-4
 24
  1  0  0  5  1
       3079.70000000          0.00023473
        461.52000000          0.00182450
        105.06000000          0.00959330
         29.76400000          0.04046100
          9.71830000          0.14607000
  1  0  0  1  1
          3.51790000          1.00000000
  1  0  0  1  1
          1.37700000          1.00000000
  1  0  0  1  1
          0.56831000          1.00000000
  1  0  0  1  1
          0.24341000          1.00000000
  1  0  0  1  1
          0.10505000          1.00000000
  1  0  0  1  1
          0.04419800          1.00000000
  1  0  0  1  1
          0.01713100          1.00000000
  1  1  1  1  1
         30.00000000          1.00000000
  1  1  1  1  1
          6.60000000          1.00000000
  1  1  1  1  1
          2.10000000          1.00000000
  1  1  1  1  1
          0.95000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.05139300          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.06852400          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.08565600          1.00000000
  1  4  4  1  1
          3.20000000          1.00000000
  1  4  4  1  1
          0.10279000          1.00000000
# HELIUM
He aug-pc-4
 24
  1  0  0  5  1
       8780.20000000          0.00146640
       1315.60000000          0.01139500
        299.46000000          0.05981900
         84.83300000          0.25089000
         27.69100000          0.89135000
  1  0  0  1  1
         10.00800000          1.00000000
  1  0  0  1  1
          3.89240000          1.00000000
  1  0  0  1  1
          1.58190000          1.00000000
  1  0  0  1  1
          0.65698000          1.00000000
  1  0  0  1  1
          0.26459000          1.00000000
  1  0  0  1  1
          0.10585000          1.00000000
  1  0  0  1  1
          0.03920000          1.00000000
  1  1  1  1  1
         40.50000000          1.00000000
  1  1  1  1  1
          8.90000000          1.00000000
  1  1  1  1  1
          2.85000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
  1  1  1  1  1
          0.60000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  1  1  1  1
          0.11760000          1.00000000
  1  2  2  1  1
          3.70000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.15680000          1.00000000
  1  3  3  1  1
          4.10000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.19600000          1.00000000
  1  4  4  1  1
          4.65000000          1.00000000
  1  4  4  1  1
          0.23520000          1.00000000
# LITHIUM
Li aug-pc-4
 22
  1  0  0 13  2
      70681.00000000          0.00000544          0.00000000
      13594.00000000          0.00003328         -0.00000011
       3100.40000000          0.00019175          0.00000017
        826.46000000          0.00089686         -0.00000357
        253.76000000          0.00344770          0.00000859
         88.45100000          0.01143500         -0.00005557
         34.49300000          0.03095700          0.00028213
         14.83100000          0.07323700         -0.00045594
          6.92990000          0.12668000          0.00524910
          3.46780000          0.21423000         -0.00487050
          1.83160000          0.17857000          0.04683100
          1.00630000          0.28492000         -0.03228200
          0.56678000          0.00000000          0.10296000
  1  0  0  1  1
          0.32254000          1.00000000
  1  0  0  1  1
          0.18277000          1.00000000
  1  0  0  1  1
          0.10164000          1.00000000
  1  0  0  1  1
          0.05466600          1.00000000
  1  0  0  1  1
          0.02802500          1.00000000
  1  0  0  1  1
          0.01349700          1.00000000
  1  0  0  1  1
          0.00593000          1.00000000
  1  1  1  5  1
         28.50000000          0.00036754
          6.64000000          0.00322359
          1.92000000          0.01432120
          0.77000000          0.03648140
          0.32000000          0.07577460
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06600000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  1  1  1  1
          0.00830000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  2  2  1  1
          0.02372000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          0.02965000          1.00000000
  1  4  4  1  1
          0.55000000          1.00000000
  1  4  4  1  1
          0.03558000          1.00000000
# BERYLLIUM
Be aug-pc-4
 22
  1  0  0 13  2
     139330.00000000          0.00000244          0.00000000
      26774.00000000          0.00001494         -0.00000040
       6112.00000000          0.00008580          0.00000060
       1632.90000000          0.00040022         -0.00001224
        503.03000000          0.00152890          0.00003235
        176.03000000          0.00505860         -0.00017006
         68.93900000          0.01364400          0.00113620
         29.76800000          0.03273000         -0.00064192
         13.96300000          0.05754600          0.02159000
          7.00900000          0.10067000          0.00042561
          3.70940000          0.08634800          0.18149000
          2.03920000          0.12653000          0.01235200
          1.14720000          0.00000000          0.38475000
  1  0  0  1  1
          0.65070000          1.00000000
  1  0  0  1  1
          0.36659000          1.00000000
  1  0  0  1  1
          0.20211000          1.00000000
  1  0  0  1  1
          0.10742000          1.00000000
  1  0  0  1  1
          0.05423100          1.00000000
  1  0  0  1  1
          0.02561900          1.00000000
  1  0  0  1  1
          0.01106000          1.00000000
  1  1  1  5  1
         45.70000000          0.00065877
         10.60000000          0.00573382
          3.08000000          0.02784590
          1.23000000          0.05643490
          0.51000000          0.17616700
  1  1  1  1  1
          0.23000000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  1  1  1  1
          0.04000000          1.00000000
  1  1  1  1  1
          0.01333000          1.00000000
  1  2  2  1  1
          3.35000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  2  2  1  1
          0.04424000          1.00000000
  1  3  3  1  1
          0.75000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.05530000          1.00000000
  1  4  4  1  1
          0.80000000          1.00000000
  1  4  4  1  1
          0.06636000          1.00000000
# BORON
B  aug-pc-4
 32
  1  0  0 12  2
     742500.00000000          0.00000122          0.00000000
     110930.00000000          0.00000944          0.00000000
      25203.00000000          0.00005028          0.00000000
       7129.30000000          0.00020962          0.00000231
       2324.70000000          0.00077739         -0.00000366
        839.05000000          0.00247190          0.00004948
        327.79000000          0.00746650          0.00001943
        136.72000000          0.01909500          0.00110270
         60.29400000          0.04670600          0.00268300
         27.73100000          0.08501500          0.02218600
         12.99200000          0.14297000          0.06084500
          6.25510000          0.00000000          0.28114000
  1  0  0  1  1
          3.14720000          1.00000000
  1  0  0  1  1
          1.56270000          1.00000000
  1  0  0  1  1
          0.74066000          1.00000000
  1  0  0  1  1
          0.31290000          1.00000000
  1  0  0  1  1
          0.13142000          1.00000000
  1  0  0  1  1
          0.05470700          1.00000000
  1  0  0  1  1
          0.02103000          1.00000000
  1  1  1  5  1
        227.84000000          0.00112430
         53.92200000          0.00973930
         17.04800000          0.05453600
          6.00200000          0.23171000
          2.60660000          0.49931000
  1  1  1  1  1
          1.19620000          1.00000000
  1  1  1  1  1
          0.56967000          1.00000000
  1  1  1  1  1
          0.27377000          1.00000000
  1  1  1  1  1
          0.12880000          1.00000000
  1  1  1  1  1
          0.05965300          1.00000000
  1  1  1  1  1
          0.02619000          1.00000000
  1  1  1  1  1
          0.01057000          1.00000000
  1  2  2  1  1
          5.30000000          1.00000000
  1  2  2  1  1
          1.90000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  2  2  1  1
          0.03000000          1.00000000
  1  3  3  1  1
          1.90000000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.04228000          1.00000000
  1  4  4  1  1
          1.65000000          1.00000000
  1  4  4  1  1
          0.70000000          1.00000000
  1  4  4  1  1
          0.05285000          1.00000000
  1  5  5  1  1
          1.75000000          1.00000000
  1  5  5  1  1
          0.06341000          1.00000000
# CARBON
C  aug-pc-4
 32
  1  0  0 12  2
     527780.00000000          0.00000297          0.00000000
      79105.00000000          0.00002316          0.00000000
      18006.00000000          0.00012089          0.00000036
       5100.80000000          0.00051490         -0.00000359
       1664.70000000          0.00184580          0.00001809
        601.66000000          0.00602860          0.00000125
        235.40000000          0.01702300          0.00071075
         98.26300000          0.04407700          0.00253460
         43.26900000          0.08906100          0.01993400
         19.85800000          0.14817000          0.06504700
          9.56920000          0.06143600          0.27000000
          4.93730000          0.00000000          0.32854000
  1  0  0  1  1
          2.66870000          1.00000000
  1  0  0  1  1
          1.46740000          1.00000000
  1  0  0  1  1
          0.63863000          1.00000000
  1  0  0  1  1
          0.30240000          1.00000000
  1  0  0  1  1
          0.14116000          1.00000000
  1  0  0  1  1
          0.06374900          1.00000000
  1  0  0  1  1
          0.02645200          1.00000000
  1  1  1  5  1
        382.21000000          0.00098484
         90.48900000          0.00858470
         28.87100000          0.04827200
         10.38500000          0.20454000
          4.49720000          0.49867000
  1  1  1  1  1
          2.02740000          1.00000000
  1  1  1  1  1
          0.95154000          1.00000000
  1  1  1  1  1
          0.44815000          1.00000000
  1  1  1  1  1
          0.20721000          1.00000000
  1  1  1  1  1
          0.09487000          1.00000000
  1  1  1  1  1
          0.04084300          1.00000000
  1  1  1  1  1
          0.01620700          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  2  2  1  1
          0.04862200          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.40000000          1.00000000
  1  3  3  1  1
          0.06483000          1.00000000
  1  4  4  1  1
          2.10000000          1.00000000
  1  4  4  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          0.08103700          1.00000000
  1  5  5  1  1
          1.85000000          1.00000000
  1  5  5  1  1
          0.09724400          1.00000000
# NITROGEN
N  aug-pc-4
 32
  1  0  0 12  2
     894760.00000000          0.00000226          0.00000000
     134830.00000000          0.00001754          0.00000000
      30808.00000000          0.00009117          0.00000000
       8751.50000000          0.00038740         -0.00000321
       2862.00000000          0.00138700          0.00001370
       1035.30000000          0.00455030         -0.00001486
        404.73000000          0.01300900          0.00048102
        168.33000000          0.03469600          0.00153840
         73.69500000          0.07480400          0.01355500
         33.75300000          0.13457000          0.04731100
         16.15700000          0.11672000          0.20160000
          7.96880000          0.00000000          0.40713000
  1  0  0  1  1
          3.95210000          1.00000000
  1  0  0  1  1
          1.94540000          1.00000000
  1  0  0  1  1
          0.92929000          1.00000000
  1  0  0  1  1
          0.44085000          1.00000000
  1  0  0  1  1
          0.20340000          1.00000000
  1  0  0  1  1
          0.09122600          1.00000000
  1  0  0  1  1
          0.03754200          1.00000000
  1  1  1  5  1
        566.23000000          0.00092433
        134.10000000          0.00808980
         43.01300000          0.04546300
         15.61200000          0.19622000
          6.64270000          0.51754000
  1  1  1  1  1
          2.97480000          1.00000000
  1  1  1  1  1
          1.38850000          1.00000000
  1  1  1  1  1
          0.65012000          1.00000000
  1  1  1  1  1
          0.30028000          1.00000000
  1  1  1  1  1
          0.13620000          1.00000000
  1  1  1  1  1
          0.05784500          1.00000000
  1  1  1  1  1
          0.02268400          1.00000000
  1  2  2  1  1
         12.80000000          1.00000000
  1  2  2  1  1
          4.40000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.37000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.06805300          1.00000000
  1  3  3  1  1
          2.30000000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.09073700          1.00000000
  1  4  4  1  1
          2.55000000          1.00000000
  1  4  4  1  1
          1.10000000          1.00000000
  1  4  4  1  1
          0.11342000          1.00000000
  1  5  5  1  1
          1.95000000          1.00000000
  1  5  5  1  1
          0.13611000          1.00000000
# OXYGEN
O  aug-pc-4
 32
  1  0  0 12  2
    1259700.00000000          0.00000207          0.00000000
     190110.00000000          0.00001596          0.00000000
      43449.00000000          0.00008333          0.00000000
      12342.00000000          0.00035212         -0.00000088
       4035.00000000          0.00127090          0.00000749
       1459.70000000          0.00413240          0.00001892
        570.66000000          0.01197000          0.00035166
        237.50000000          0.03156100          0.00170470
        104.11000000          0.06996000          0.01141200
         47.58100000          0.12702000          0.04602500
         22.54600000          0.11899000          0.19140000
         11.09300000          0.00000000          0.40260000
  1  0  0  1  1
          5.54090000          1.00000000
  1  0  0  1  1
          2.77940000          1.00000000
  1  0  0  1  1
          1.28370000          1.00000000
  1  0  0  1  1
          0.59649000          1.00000000
  1  0  0  1  1
          0.27057000          1.00000000
  1  0  0  1  1
          0.12028000          1.00000000
  1  0  0  1  1
          0.04909400          1.00000000
  1  1  1  5  1
        708.61000000          0.00104560
        167.86000000          0.00912920
         53.96700000          0.05097700
         19.80700000          0.21599000
          8.38320000          0.58777000
  1  1  1  1  1
          3.74470000          1.00000000
  1  1  1  1  1
          1.73220000          1.00000000
  1  1  1  1  1
          0.79977000          1.00000000
  1  1  1  1  1
          0.36323000          1.00000000
  1  1  1  1  1
          0.15963000          1.00000000
  1  1  1  1  1
          0.06566400          1.00000000
  1  1  1  1  1
          0.02496700          1.00000000
  1  2  2  1  1
         18.20000000          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.07490200          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.09987000          1.00000000
  1  4  4  1  1
          3.05000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  4  4  1  1
          0.12484000          1.00000000
  1  5  5  1  1
          2.05000000          1.00000000
  1  5  5  1  1
          0.14980000          1.00000000
# FLUORINE
F  aug-pc-4
 32
  1  0  0 12  2
    1856000.00000000          0.00000172          0.00000000
     280070.00000000          0.00001324          0.00000000
      64078.00000000          0.00006902          0.00000000
      18216.00000000          0.00029162         -0.00000081
       5957.80000000          0.00105220          0.00000585
       2155.00000000          0.00343010          0.00001118
        841.96000000          0.00997250          0.00026452
        349.82000000          0.02662500          0.00124470
        152.79000000          0.06039700          0.00880460
         69.36700000          0.11468000          0.03666600
         32.57400000          0.11487000          0.16212000
         15.88900000          0.00000000          0.37403000
  1  0  0  1  1
          7.86510000          1.00000000
  1  0  0  1  1
          3.91990000          1.00000000
  1  0  0  1  1
          1.78610000          1.00000000
  1  0  0  1  1
          0.82065000          1.00000000
  1  0  0  1  1
          0.36937000          1.00000000
  1  0  0  1  1
          0.16198000          1.00000000
  1  0  0  1  1
          0.06531300          1.00000000
  1  1  1  5  1
        917.89000000          0.00104500
        217.41000000          0.00914290
         69.93900000          0.05122700
         25.83100000          0.21558000
         10.96900000          0.59660000
  1  1  1  1  1
          4.92150000          1.00000000
  1  1  1  1  1
          2.28390000          1.00000000
  1  1  1  1  1
          1.05790000          1.00000000
  1  1  1  1  1
          0.48135000          1.00000000
  1  1  1  1  1
          0.20902000          1.00000000
  1  1  1  1  1
          0.08555600          1.00000000
  1  1  1  1  1
          0.03240800          1.00000000
  1  2  2  1  1
         25.50000000          1.00000000
  1  2  2  1  1
          8.00000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.45000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.09722300          1.00000000
  1  3  3  1  1
          3.10000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  3  3  1  1
          0.12963000          1.00000000
  1  4  4  1  1
          3.60000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.16204000          1.00000000
  1  5  5  1  1
          2.15000000          1.00000000
  1  5  5  1  1
          0.19445000          1.00000000
# NEON
Ne aug-pc-4
 32
  1  0  0 12  2
    2522600.00000000          0.00000767          0.00000000
     377060.00000000          0.00005983          0.00000000
      85713.00000000          0.00031441          0.00000000
      24261.00000000          0.00133260         -0.00000020
       7911.70000000          0.00483320          0.00000212
       2855.50000000          0.01576300          0.00000758
       1113.60000000          0.04612300          0.00011055
        461.89000000          0.12339000          0.00058283
        201.35000000          0.28428000          0.00387530
         91.19800000          0.54569000          0.01708600
         42.68000000          0.58141000          0.07497800
         20.74200000          0.00000000          0.18391000
  1  0  0  1  1
         10.24900000          1.00000000
  1  0  0  1  1
          5.10130000          1.00000000
  1  0  0  1  1
          2.30310000          1.00000000
  1  0  0  1  1
          1.05310000          1.00000000
  1  0  0  1  1
          0.47222000          1.00000000
  1  0  0  1  1
          0.20466000          1.00000000
  1  0  0  1  1
          0.08164000          1.00000000
  1  1  1  5  1
       1169.90000000          0.00051064
        277.11000000          0.00447380
         89.26400000          0.02511000
         33.10000000          0.10593000
         14.03100000          0.29958000
  1  1  1  1  1
          6.29850000          1.00000000
  1  1  1  1  1
          2.92340000          1.00000000
  1  1  1  1  1
          1.35370000          1.00000000
  1  1  1  1  1
          0.61362000          1.00000000
  1  1  1  1  1
          0.26362000          1.00000000
  1  1  1  1  1
          0.10755000          1.00000000
  1  1  1  1  1
          0.04057000          1.00000000
  1  2  2  1  1
         32.00000000          1.00000000
  1  2  2  1  1
         10.10000000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.85000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.12710000          1.00000000
  1  3  3  1  1
          3.60000000          1.00000000
  1  3  3  1  1
          1.55000000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  3  3  1  1
          0.16230000          1.00000000
  1  4  4  1  1
          4.20000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  4  4  1  1
          0.20280000          1.00000000
  1  5  5  1  1
          2.25000000          1.00000000
  1  5  5  1  1
          0.24340000          1.00000000
# SODIUM
Na aug-pc-4
 21
  1  0  0 17  3
    1918700.00000000          0.00000274          0.00000000          0.00000000
     287270.00000000          0.00002133          0.00000000          0.00000000
      65382.00000000          0.00011221          0.00000000          0.00000000
      18523.00000000          0.00047369          0.00000000          0.00000000
       6045.40000000          0.00172350          0.00000000         -0.00000144
       2184.20000000          0.00559140         -0.00001790         -0.00001306
        853.11000000          0.01646100         -0.00006498         -0.00009742
        354.69000000          0.04377600         -0.00060909         -0.00063787
        155.33000000          0.10266000         -0.00260940         -0.00333940
         71.23400000          0.20074000         -0.01329500         -0.01514500
         33.83500000          0.30952000         -0.03986700         -0.04907900
         16.34900000          0.30826000         -0.09610800         -0.10865000
          8.00820000          0.14855000         -0.07047900         -0.08852700
          3.67130000          0.01711300          0.24565000          0.29366000
          1.71180000         -0.00155410          0.55362000          0.47915000
          0.79147000          0.00000000          0.45869000          0.15680000
          0.35479000          0.00000000          0.00000000         -0.57853000
  1  0  0  1  1
          0.09066400          1.00000000
  1  0  0  1  1
          0.04431300          1.00000000
  1  0  0  1  1
          0.02194800          1.00000000
  1  0  0  1  1
          0.01082100          1.00000000
  1  0  0  1  1
          0.00485700          1.00000000
  1  1  1 11  1
       3044.20000000          0.00002935
        720.02000000          0.00026100
        234.42000000          0.00148190
         89.66600000          0.00648150
         36.69500000          0.02480300
         16.25600000          0.06595400
          7.65930000          0.14794000
          3.71250000          0.24400000
          1.79920000          0.30244000
          0.86288000          0.27557000
          0.40104000          0.16219000
  1  1  1  1  1
          0.17759000          1.00000000
  1  1  1  1  1
          0.08070000          1.00000000
  1  1  1  1  1
          0.03670000          1.00000000
  1  1  1  1  1
          0.01670000          1.00000000
  1  1  1  1  1
          0.00697000          1.00000000
  1  2  2  1  1
          2.35000000          1.00000000
  1  2  2  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.01943000          1.00000000
  1  3  3  1  1
          1.08000000          1.00000000
  1  3  3  1  1
          0.24000000          1.00000000
  1  3  3  1  1
          0.02428000          1.00000000
  1  4  4  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.02914000          1.00000000
# MAGNESIUM
Mg aug-pc-4
 21
  1  0  0 17  3
    3199100.00000000          0.00000090          0.00000000          0.00000000
     479000.00000000          0.00000701          0.00000000          0.00000000
     109010.00000000          0.00003689          0.00000000          0.00000000
      30878.00000000          0.00015584          0.00000000          0.00000000
      10075.00000000          0.00056784          0.00000000          0.00000000
       3637.90000000          0.00184930         -0.00000336          0.00000000
       1419.50000000          0.00548860         -0.00001119          0.00000139
        589.35000000          0.01487100         -0.00011126          0.00001097
        257.53000000          0.03631500         -0.00050000          0.00005638
        117.17000000          0.07751300         -0.00266410          0.00026010
         54.76200000          0.13593000         -0.00983480          0.00092696
         26.28800000          0.16490000         -0.02596400          0.00140020
         12.86000000          0.11240000         -0.03988900          0.00021032
          6.26040000          0.02650100          0.02928600         -0.00139360
          2.85140000          0.00006822          0.16700000          0.06338500
          1.30580000          0.00000000          0.15689000          0.35178000
          0.58331000          0.00000000          0.00000000          0.45980000
  1  0  0  1  1
          0.16849000          1.00000000
  1  0  0  1  1
          0.08564600          1.00000000
  1  0  0  1  1
          0.04507700          1.00000000
  1  0  0  1  1
          0.02193400          1.00000000
  1  0  0  1  1
          0.00972700          1.00000000
  1  1  1 11  1
       4157.80000000          0.00001234
        984.53000000          0.00010978
        320.09000000          0.00063086
        121.73000000          0.00283310
         49.89200000          0.01077300
         22.54200000          0.02877200
         10.74900000          0.06653700
          5.28990000          0.11557000
          2.59960000          0.15417000
          1.25180000          0.14665000
          0.59246000          0.08190400
  1  1  1  1  1
          0.26941000          1.00000000
  1  1  1  1  1
          0.12250000          1.00000000
  1  1  1  1  1
          0.05570000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  1  1  1  1
          0.01054000          1.00000000
  1  2  2  1  1
          3.36000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.03891000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.04864000          1.00000000
  1  4  4  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          0.05836000          1.00000000
# ALUMINUM
Al aug-pc-4
 28
  1  0  0 17  3
    3845200.00000000          0.00000175          0.00000000          0.00000000
     575260.00000000          0.00001365          0.00000000          0.00000000
     130860.00000000          0.00007187          0.00000000          0.00000000
      37063.00000000          0.00030355          0.00000000          0.00000000
      12094.00000000          0.00110600          0.00000000         -0.00000109
       4366.80000000          0.00360350         -0.00001133         -0.00001050
       1703.60000000          0.01070200         -0.00006005         -0.00007868
        707.13000000          0.02903600         -0.00046344         -0.00052023
        308.97000000          0.07104500         -0.00237800         -0.00291520
        140.71000000          0.15195000         -0.01184200         -0.01384800
         65.91700000          0.26792000         -0.04567500         -0.05496800
         31.73000000          0.32914000         -0.11864000         -0.13850000
         15.58700000          0.22998000         -0.19088000         -0.22663000
          7.63820000          0.05743300          0.12421000          0.15454000
          3.54540000          0.00040260          0.72353000          0.75844000
          1.66790000          0.00000000          0.75665000          0.53134000
          0.76939000          0.00000000          0.00000000         -0.50362000
  1  0  0  1  1
          0.27917000          1.00000000
  1  0  0  1  1
          0.14016000          1.00000000
  1  0  0  1  1
          0.07033600          1.00000000
  1  0  0  1  1
          0.03366000          1.00000000
  1  0  0  1  1
          0.01470000          1.00000000
  1  1  1 12  2
       5687.30000000          0.00001998          0.00000000
       1345.20000000          0.00017728          0.00001010
        436.38000000          0.00103710          0.00000000
        165.45000000          0.00470060          0.00022858
         68.61900000          0.01742700         -0.00026528
         31.87500000          0.04664300          0.00155100
         15.43200000          0.11224000         -0.00904470
          7.75700000          0.20457000         -0.00361670
          3.92560000          0.29828000         -0.07048600
          1.97640000          0.30142000         -0.01171600
          0.99918000          0.18905000          0.04407300
          0.50630000          0.00000000          0.55310000
  1  1  1  1  1
          0.25847000          1.00000000
  1  1  1  1  1
          0.11566000          1.00000000
  1  1  1  1  1
          0.05104800          1.00000000
  1  1  1  1  1
          0.02120000          1.00000000
  1  1  1  1  1
          0.00812900          1.00000000
  1  2  2  1  1
         17.81000000          1.00000000
  1  2  2  1  1
          5.09000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.63000000          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  2  2  1  1
          0.02439000          1.00000000
  1  3  3  1  1
          2.17000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.03252000          1.00000000
  1  4  4  1  1
          1.14000000          1.00000000
  1  4  4  1  1
          0.38000000          1.00000000
  1  4  4  1  1
          0.04064000          1.00000000
  1  5  5  1  1
          0.69000000          1.00000000
  1  5  5  1  1
          0.04877000          1.00000000
# SILICON
Si aug-pc-4
 28
  1  0  0 17  3
    4615800.00000000          0.00000166          0.00000000          0.00000000
     719010.00000000          0.00001213          0.00000000          0.00000000
     169990.00000000          0.00006097          0.00000000          0.00000000
      49400.00000000          0.00025124          0.00000000          0.00000000
      16385.00000000          0.00090088         -0.00000095          0.00000000
       5985.40000000          0.00290390         -0.00000194         -0.00000381
       2354.10000000          0.00858520         -0.00004218         -0.00002900
        981.40000000          0.02342100         -0.00020469         -0.00018868
        428.90000000          0.05842200         -0.00142610         -0.00109670
        194.54000000          0.12977000         -0.00637950         -0.00533750
         90.77700000          0.24037000         -0.02866400         -0.02274900
         43.71500000          0.32480000         -0.07569500         -0.06293600
         21.49100000          0.26684000         -0.15473000         -0.12525000
         10.66900000          0.09132400          0.01591300          0.00521670
          4.88820000          0.00534240          0.46344000          0.43080000
          2.33610000          0.00000000          0.60218000          0.71833000
          1.09670000          0.00000000          0.00000000          0.38360000
  1  0  0  1  1
          0.42312000          1.00000000
  1  0  0  1  1
          0.24276000          1.00000000
  1  0  0  1  1
          0.11703000          1.00000000
  1  0  0  1  1
          0.05286100          1.00000000
  1  0  0  1  1
          0.02189700          1.00000000
  1  1  1 12  2
       6453.30000000          0.00002165          0.00000000
       1533.90000000          0.00019162          0.00000096
        498.38000000          0.00111430         -0.00000017
        188.98000000          0.00508300          0.00001992
         77.88700000          0.01926900         -0.00003897
         35.51400000          0.05309100          0.00006333
         17.01600000          0.12639000         -0.00140570
          8.49770000          0.22312000         -0.00120800
          4.35440000          0.29854000         -0.01139000
          2.25750000          0.28651000          0.00460790
          1.15970000          0.17168000         -0.00057688
          0.59343000          0.00000000          0.13174000
  1  1  1  1  1
          0.29012000          1.00000000
  1  1  1  1  1
          0.13825000          1.00000000
  1  1  1  1  1
          0.06459400          1.00000000
  1  1  1  1  1
          0.02835400          1.00000000
  1  1  1  1  1
          0.01144200          1.00000000
  1  2  2  1  1
         19.52000000          1.00000000
  1  2  2  1  1
          5.58000000          1.00000000
  1  2  2  1  1
          1.92000000          1.00000000
  1  2  2  1  1
          0.69000000          1.00000000
  1  2  2  1  1
          0.29900000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  2  2  1  1
          0.03432600          1.00000000
  1  3  3  1  1
          2.64000000          1.00000000
  1  3  3  1  1
          0.62000000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  3  3  1  1
          0.04576800          1.00000000
  1  4  4  1  1
          1.35000000          1.00000000
  1  4  4  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          0.05721100          1.00000000
  1  5  5  1  1
          0.78000000          1.00000000
  1  5  5  1  1
          0.06865300          1.00000000
# PHOSPHOROUS
P  aug-pc-4
 28
  1  0  0 17  3
    5262500.00000000          0.00000167          0.00000000          0.00000000
     822130.00000000          0.00001221          0.00000000          0.00000000
     194250.00000000          0.00006144          0.00000000          0.00000000
      56424.00000000          0.00025322          0.00000000          0.00000000
      18716.00000000          0.00090752         -0.00000088          0.00000000
       6839.30000000          0.00292300         -0.00000120         -0.00000486
       2693.10000000          0.00861380         -0.00003678         -0.00003786
       1126.50000000          0.02332900         -0.00016467         -0.00024017
        495.21000000          0.05764100         -0.00118610         -0.00138650
        226.38000000          0.12694000         -0.00509360         -0.00661190
        106.62000000          0.23408000         -0.02293900         -0.02784700
         51.90500000          0.31805000         -0.05950300         -0.07656600
         25.85100000          0.27002000         -0.12532000         -0.15527000
         13.02200000          0.10197000         -0.00340880         -0.01712400
          6.05680000          0.00808990          0.33461000          0.48842000
          2.95740000          0.00000000          0.50380000          0.90895000
          1.40780000          0.00000000          0.00000000          0.53649000
  1  0  0  1  1
          0.57187000          1.00000000
  1  0  0  1  1
          0.31078000          1.00000000
  1  0  0  1  1
          0.14947000          1.00000000
  1  0  0  1  1
          0.06831300          1.00000000
  1  0  0  1  1
          0.02860700          1.00000000
  1  1  1 12  2
       7748.60000000          0.00002087          0.00000000
       1833.60000000          0.00018596          0.00000082
        595.55000000          0.00107990         -0.00000028
        226.61000000          0.00489460          0.00001597
         94.19100000          0.01832000         -0.00004740
         43.33200000          0.05066900          0.00000117
         20.90700000          0.12156000         -0.00158320
         10.50200000          0.21931000         -0.00181170
          5.42550000          0.29640000         -0.01346500
          2.88180000          0.28179000          0.00615030
          1.52840000          0.17853000         -0.00714440
          0.81081000          0.00000000          0.14315000
  1  1  1  1  1
          0.39028000          1.00000000
  1  1  1  1  1
          0.18645000          1.00000000
  1  1  1  1  1
          0.08756700          1.00000000
  1  1  1  1  1
          0.03867300          1.00000000
  1  1  1  1  1
          0.01569300          1.00000000
  1  2  2  1  1
         21.23000000          1.00000000
  1  2  2  1  1
          6.07000000          1.00000000
  1  2  2  1  1
          2.09000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  2  2  1  1
          0.04708000          1.00000000
  1  3  3  1  1
          3.12000000          1.00000000
  1  3  3  1  1
          0.73000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.06277400          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.52000000          1.00000000
  1  4  4  1  1
          0.07846700          1.00000000
  1  5  5  1  1
          0.87000000          1.00000000
  1  5  5  1  1
          0.09416100          1.00000000
# SULFUR
S  aug-pc-4
 28
  1  0  0 17  3
    6359200.00000000          0.00000156          0.00000000          0.00000000
     983890.00000000          0.00001156          0.00000000          0.00000000
     229770.00000000          0.00005902          0.00000000          0.00000000
      66276.00000000          0.00024474          0.00000000          0.00000000
      21884.00000000          0.00088159         -0.00000082          0.00000000
       7969.60000000          0.00284940         -0.00000103         -0.00000282
       3129.90000000          0.00842730         -0.00003412         -0.00002108
       1305.20000000          0.02295100         -0.00015187         -0.00013709
        571.70000000          0.05703800         -0.00110930         -0.00078935
        260.58000000          0.12616000         -0.00479670         -0.00382300
        122.48000000          0.23373000         -0.02168200         -0.01607200
         59.51800000          0.31883000         -0.05690800         -0.04492200
         29.62700000          0.27098000         -0.11915000         -0.09013700
         14.94300000          0.10217000         -0.00271680         -0.01063100
          7.04790000          0.00813260          0.30365000          0.27687000
          3.50400000          0.00000000          0.47588000          0.51960000
          1.69970000          0.00000000          0.00000000          0.30991000
  1  0  0  1  1
          0.73101000          1.00000000
  1  0  0  1  1
          0.37948000          1.00000000
  1  0  0  1  1
          0.18185000          1.00000000
  1  0  0  1  1
          0.08396100          1.00000000
  1  0  0  1  1
          0.03548700          1.00000000
  1  1  1 12  2
       9341.40000000          0.00001949          0.00000000
       2208.60000000          0.00017432          0.00000061
        716.27000000          0.00101610         -0.00000034
        272.51000000          0.00461720          0.00001063
        113.77000000          0.01716300         -0.00005018
         52.57100000          0.04813200         -0.00007805
         25.39700000          0.11704000         -0.00161880
         12.77000000          0.21602000         -0.00265510
          6.62240000          0.29528000         -0.01377700
          3.53880000          0.28825000          0.00242460
          1.87560000          0.17982000          0.00058572
          0.99018000          0.00000000          0.16518000
  1  1  1  1  1
          0.47723000          1.00000000
  1  1  1  1  1
          0.22692000          1.00000000
  1  1  1  1  1
          0.10473000          1.00000000
  1  1  1  1  1
          0.04530300          1.00000000
  1  1  1  1  1
          0.01803600          1.00000000
  1  2  2  1  1
         22.93000000          1.00000000
  1  2  2  1  1
          6.55000000          1.00000000
  1  2  2  1  1
          2.26000000          1.00000000
  1  2  2  1  1
          0.81000000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  2  2  1  1
          0.14600000          1.00000000
  1  2  2  1  1
          0.05410700          1.00000000
  1  3  3  1  1
          3.59000000          1.00000000
  1  3  3  1  1
          0.84000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.07214200          1.00000000
  1  4  4  1  1
          1.76000000          1.00000000
  1  4  4  1  1
          0.59000000          1.00000000
  1  4  4  1  1
          0.09017800          1.00000000
  1  5  5  1  1
          0.95000000          1.00000000
  1  5  5  1  1
          0.10821000          1.00000000
# CHLORINE
Cl aug-pc-4
 28
  1  0  0 17  3
    7421200.00000000          0.00000150          0.00000000          0.00000000
    1141100.00000000          0.00001124          0.00000000          0.00000000
     264430.00000000          0.00005800          0.00000000          0.00000000
      75791.00000000          0.00024215          0.00000000          0.00000000
      24925.00000000          0.00087550         -0.00000134          0.00000000
       9052.60000000          0.00283760         -0.00000184         -0.00000371
       3548.10000000          0.00840860         -0.00005817         -0.00002924
       1478.00000000          0.02290600         -0.00026634         -0.00018902
        647.35000000          0.05689500         -0.00191720         -0.00109400
        295.33000000          0.12569000         -0.00835970         -0.00529080
        138.98000000          0.23327000         -0.03750200         -0.02220500
         67.54900000          0.31894000         -0.09949500         -0.06245500
         33.66100000          0.27117000         -0.20640000         -0.12439000
         17.02700000          0.10247000         -0.00520630         -0.01497300
          8.15040000          0.00830670          0.50048000          0.36440000
          4.13190000          0.00000000          0.83332000          0.68717000
          2.04570000          0.00000000          0.00000000          0.39343000
  1  0  0  1  1
          0.94029000          1.00000000
  1  0  0  1  1
          0.46901000          1.00000000
  1  0  0  1  1
          0.22219000          1.00000000
  1  0  0  1  1
          0.10220000          1.00000000
  1  0  0  1  1
          0.04304600          1.00000000
  1  1  1 12  2
      11035.00000000          0.00001851          0.00000000
       2611.50000000          0.00016527          0.00000056
        848.02000000          0.00096233         -0.00000035
        323.00000000          0.00437770          0.00000920
        135.33000000          0.01621800         -0.00005112
         62.68400000          0.04610400         -0.00010597
         30.29800000          0.11348000         -0.00166890
         15.24000000          0.21353000         -0.00309980
          7.92590000          0.29438000         -0.01462800
          4.28530000          0.28778000          0.00123450
          2.30430000          0.18269000          0.00153150
          1.23570000          0.00000000          0.16993000
  1  1  1  1  1
          0.60021000          1.00000000
  1  1  1  1  1
          0.28739000          1.00000000
  1  1  1  1  1
          0.13185000          1.00000000
  1  1  1  1  1
          0.05697000          1.00000000
  1  1  1  1  1
          0.02265700          1.00000000
  1  2  2  1  1
         24.63000000          1.00000000
  1  2  2  1  1
          7.04000000          1.00000000
  1  2  2  1  1
          2.43000000          1.00000000
  1  2  2  1  1
          0.87000000          1.00000000
  1  2  2  1  1
          0.37700000          1.00000000
  1  2  2  1  1
          0.15700000          1.00000000
  1  2  2  1  1
          0.06797200          1.00000000
  1  3  3  1  1
          4.06000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.39000000          1.00000000
  1  3  3  1  1
          0.09062900          1.00000000
  1  4  4  1  1
          1.97000000          1.00000000
  1  4  4  1  1
          0.66000000          1.00000000
  1  4  4  1  1
          0.11329000          1.00000000
  1  5  5  1  1
          1.04000000          1.00000000
  1  5  5  1  1
          0.13594000          1.00000000
# ARGON
Ar aug-pc-4
 28
  1  0  0 17  3
    9445100.00000000          0.00000065          0.00000000          0.00000000
    1414100.00000000          0.00000503          0.00000000          0.00000000
     321810.00000000          0.00002648          0.00000000          0.00000000
      91158.00000000          0.00011190          0.00000000          0.00000000
      29743.00000000          0.00040791         -0.00000056          0.00000000
      10740.00000000          0.00133090         -0.00000040         -0.00000430
       4190.00000000          0.00396580         -0.00002366         -0.00003226
       1738.90000000          0.01086300         -0.00010267         -0.00021559
        759.29000000          0.02715900         -0.00077891         -0.00124380
        345.50000000          0.06051400         -0.00337400         -0.00612440
        162.36000000          0.11351000         -0.01548200         -0.02587800
         78.88800000          0.15827000         -0.04168700         -0.07483000
         39.32100000          0.13900000         -0.08942400         -0.15278000
         19.91800000          0.05564500         -0.01062200         -0.03707900
          9.57640000          0.00513770          0.20099000          0.43524000
          4.91610000          0.00000000          0.36722000          0.88582000
          2.46480000          0.00000000          0.00000000          0.60951000
  1  0  0  1  1
          1.18300000          1.00000000
  1  0  0  1  1
          0.57521000          1.00000000
  1  0  0  1  1
          0.27041000          1.00000000
  1  0  0  1  1
          0.12312000          1.00000000
  1  0  0  1  1
          0.05138000          1.00000000
  1  1  1 12  2
      13006.00000000          0.00000869          0.00000000
       3078.10000000          0.00007761          0.00000276
        999.56000000          0.00045249         -0.00000183
        380.97000000          0.00205950          0.00004540
        160.28000000          0.00758720         -0.00025551
         74.49400000          0.02182200         -0.00054968
         36.06500000          0.05433200         -0.00835420
         18.16400000          0.10442000         -0.01650400
          9.46650000          0.14645000         -0.07654200
          5.16300000          0.14426000          0.00166060
          2.80850000          0.09437900          0.00120150
          1.52350000          0.00000000          0.85169000
  1  1  1  1  1
          0.74379000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16221000          1.00000000
  1  1  1  1  1
          0.06995600          1.00000000
  1  1  1  1  1
          0.02777000          1.00000000
  1  2  2  1  1
         26.33000000          1.00000000
  1  2  2  1  1
          7.53000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.93000000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  2  2  1  1
          0.08331000          1.00000000
  1  3  3  1  1
          4.53000000          1.00000000
  1  3  3  1  1
          1.06000000          1.00000000
  1  3  3  1  1
          0.44000000          1.00000000
  1  3  3  1  1
          0.11110000          1.00000000
  1  4  4  1  1
          2.18000000          1.00000000
  1  4  4  1  1
          0.73000000          1.00000000
  1  4  4  1  1
          0.13890000          1.00000000
  1  5  5  1  1
          1.12000000          1.00000000
  1  5  5  1  1
          0.16660000          1.00000000
# BASIS="Ahlrichs VDZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#
# HYDROGEN    (4s) -> [2s]
H  Ahlrichs-VDZ
  2
  1  0  0  3  1
         13.01070100          0.01968216
          1.96225720          0.13796524
          0.44453796          0.47831935
  1  0  0  1  1
          0.12194962          1.00000000
# HELIUM      (4s) -> [2s]
HE Ahlrichs-VDZ
  2
  1  0  0  3  1
         38.35493674          0.02381429
          5.76890815          0.15490907
          1.23994070          0.46998097
  1  0  0  1  1
          0.29757816          1.00000000
# LITHIUM     (7s) -> [3s]
LI Ahlrichs-VDZ
  3
  1  0  0  5  1
        266.27785516          0.00649202
         40.06978345          0.04774786
          9.05599444          0.20268796
          2.45030091          0.48606575
          0.72209572          0.43626978
  1  0  0  1  1
          0.05281088          1.00000000
  1  0  0  1  1
          0.02096095          1.00000000
# BERYLLIUM   (7s) -> [3s]
BE Ahlrichs-VDZ
  3
  1  0  0  5  1
        515.18616125          0.00556153
         77.51103760          0.04119007
         17.55248169          0.17913378
          4.80289406          0.44736716
          1.45162143          0.42009582
  1  0  0  1  1
          0.13281634          1.00000000
  1  0  0  1  1
          0.04583737          1.00000000
# BORON       (7s,4p) -> [3s,2p]
B  Ahlrichs-VDZ
  5
  1  0  0  5  1
        839.31830086         -0.00559292
        126.26464843         -0.04156552
         28.62060076         -0.18299817
          7.87937227         -0.46540392
          2.40888572         -0.44173885
  1  0  0  1  1
          0.25105109          1.00000000
  1  0  0  1  1
          0.08364887          1.00000000
  1  1  1  3  1
          6.03322236         -0.03560367
          1.24991579         -0.19895776
          0.33871676         -0.50850203
  1  1  1  1  1
          0.09641563          1.00000000
# CARBON      (7s,4p) -> [3s,2p]
C  Ahlrichs-VDZ
  5
  1  0  0  5  1
       1238.40169380          0.00545688
        186.29004992          0.04063841
         42.25117635          0.18025594
         11.67655793          0.46315122
          3.59305065          0.44087173
  1  0  0  1  1
          0.40245147          1.00000000
  1  0  0  1  1
          0.13090183          1.00000000
  1  1  1  3  1
          9.46809706          0.03838787
          2.01035451          0.21117025
          0.54771005          0.51328172
  1  1  1  1  1
          0.15268614          1.00000000
# NITROGEN    (7s,4p) -> [3s,2p]
N  Ahlrichs-VDZ
  5
  1  0  0  5  1
       1712.84158530         -0.00539341
        257.64812677         -0.04022158
         58.45824585         -0.17931145
         16.19836791         -0.46376318
          5.00526008         -0.44171423
  1  0  0  1  1
          0.58731857          1.00000000
  1  0  0  1  1
          0.18764592          1.00000000
  1  1  1  3  1
         13.57147023         -0.04007240
          2.92573729         -0.21807045
          0.79927751         -0.51294466
  1  1  1  1  1
          0.21954348          1.00000000
# OXYGEN      (7s,4p) -> [3s,2p]
O  Ahlrichs-VDZ
  5
  1  0  0  5  1
       2266.17677850         -0.00534318
        340.87010191         -0.03989004
         77.36313517         -0.17853912
         21.47964494         -0.46427685
          6.65894331         -0.44309745
  1  0  0  1  1
          0.80975976          1.00000000
  1  0  0  1  1
          0.25530772          1.00000000
  1  1  1  3  1
         17.72150432          0.04339457
          3.86355054          0.23094121
          1.04809209          0.51375311
  1  1  1  1  1
          0.27641544          1.00000000
# FLUORINE    (7s,4p) -> [3s,2p]
F  Ahlrichs-VDZ
  5
  1  0  0  5  1
       2894.83259900         -0.00534083
        435.41939120         -0.03990426
         98.84332887         -0.17912768
         27.48519800         -0.46758091
          8.54054982         -0.44653131
  1  0  0  1  1
          1.06545780          1.00000000
  1  0  0  1  1
          0.33247347          1.00000000
  1  1  1  3  1
         22.69663392         -0.04521287
          4.98723393         -0.23754317
          1.34916140         -0.51287354
  1  1  1  1  1
          0.34829882          1.00000000
# NEON        (7s,4p) -> [3s,2p]
NE Ahlrichs-VDZ
  5
  1  0  0  5  1
       3598.97366250         -0.00532593
        541.32073112         -0.03981742
        122.90450062         -0.17914358
         34.21661702         -0.46893583
         10.65058412         -0.44782538
  1  0  0  1  1
          1.35459540          1.00000000
  1  0  0  1  1
          0.41919363          1.00000000
  1  1  1  3  1
         28.42405379         -0.04603194
          6.28225110         -0.23993183
          1.69787151         -0.50871725
  1  1  1  1  1
          0.43300700          1.00000000
# SODIUM      (10s,5p) -> [4s,1p]
NA Ahlrichs-VDZ
  5
  1  0  0  5  1
       4098.20039080         -0.00585359
        616.49374031         -0.04364716
        139.96644001         -0.19431466
         39.07344105         -0.48685066
         11.92984721         -0.41881705
  1  0  0  3  1
         20.65996603          0.08594969
          1.98388610         -0.56359144
          0.64836324         -0.51954009
  1  0  0  1  1
          0.05244397          1.00000000
  1  0  0  1  1
          0.02804816          1.00000000
  1  1  1  5  1
         75.40186202          0.01543536
         17.27481898          0.09973829
          5.18423474          0.31209594
          1.66012120          0.49295675
          0.51232529          0.32420398
# MAGNESIUM   (10s,5p) -> [4s,1p]
MG Ahlrichs-VDZ
  5
  1  0  0  5  1
       4953.83391960         -0.00577790
        745.18044154         -0.04312476
        169.21604972         -0.19268217
         47.30067202         -0.48641439
         14.46133697         -0.42550894
  1  0  0  3  1
         24.76817479          0.08795697
          2.49409453         -0.55165058
          0.87807585         -0.53443295
  1  0  0  1  1
          0.08721278          1.00000000
  1  0  0  1  1
          0.03359929          1.00000000
  1  1  1  5  1
         98.05301049         -0.01448056
         22.58693228         -0.09549575
          6.83915098         -0.30787673
          2.23328438         -0.49936293
          0.71606599         -0.31503476
# ALUMINUM    (10s,7p) -> [4s,3p]
AL Ahlrichs-VDZ
  7
  1  0  0  5  1
       5887.57270300          0.00134833
        885.61225996          0.01007158
        201.13604899          0.04513245
         56.28497467          0.11461268
         17.22955124          0.10159609
  1  0  0  3  1
         29.34024992          0.06934745
          3.04396304         -0.42528118
          1.12855395         -0.41449832
  1  0  0  1  1
          0.14234175          1.00000000
  1  0  0  1  1
          0.05440019          1.00000000
  1  1  1  5  1
        145.11918809          0.00639634
         33.71789483          0.04418936
         10.36986308          0.15581576
          3.51356160          0.28635287
          1.19800503          0.22921423
  1  1  1  1  1
          0.26583006          1.00000000
  1  1  1  1  1
          0.07100336          1.00000000
# SILICON     (10s,7p) -> [4s,3p]
SI Ahlrichs-VDZ
  7
  1  0  0  5  1
       6903.71186860          0.00133740
       1038.43464190          0.00999665
        235.87581480          0.04491017
         66.06938517          0.11463639
         20.24794576          0.10280064
  1  0  0  3  1
         34.35348173          0.07083729
          3.63707882         -0.43028836
          1.40020486         -0.41382775
  1  0  0  1  1
          0.20484415          1.00000000
  1  0  0  1  1
          0.07799410          1.00000000
  1  1  1  5  1
        179.83907373          0.00619167
         41.90725885          0.04339943
         12.95529437          0.15632019
          4.43832674          0.29419997
          1.54622479          0.23536824
  1  1  1  1  1
          0.35607612          1.00000000
  1  1  1  1  1
          0.10008514          1.00000000
# PHOSPHORUS  (10s,7p) -> [4s,3p]
P  Ahlrichs-VDZ
  7
  1  0  0  5  1
       8002.47951060          0.00575035
       1203.68135900          0.04300763
        273.44227031          0.19363986
         76.65554152          0.49651693
         23.51692744          0.44983262
  1  0  0  3  1
         39.79168344          0.09518813
          4.27703433         -0.57649840
          1.69402569         -0.54239584
  1  0  0  1  1
          0.27567675          1.00000000
  1  0  0  1  1
          0.10495590          1.00000000
  1  1  1  5  1
        219.50755823          0.00921006
         51.27415503          0.06540977
         15.92159589          0.24033730
          5.50699135          0.46318322
          1.95377194          0.37392563
  1  1  1  1  1
          0.47803398          1.00000000
  1  1  1  1  1
          0.13657953          1.00000000
# SULFUR      (10s,7p) -> [4s,3p]
S  Ahlrichs-VDZ
  7
  1  0  0  5  1
       9184.93030100         -0.00222944
       1381.51055030         -0.01668303
        313.87147580         -0.07526244
         88.05387062         -0.19376827
         27.03991491         -0.17718021
  1  0  0  3  1
         45.64873130         -0.10736063
          4.96645223          0.65066293
          2.01162420          0.59712155
  1  0  0  1  1
          0.35661077          1.00000000
  1  0  0  1  1
          0.13507221          1.00000000
  1  1  1  5  1
        261.98233439         -0.00927299
         61.30689474         -0.06654767
         19.10372989         -0.24828596
          6.65677204         -0.48703847
          2.39596352         -0.39337850
  1  1  1  1  1
          0.61776162          1.00000000
  1  1  1  1  1
          0.16993377          1.00000000
# CHLORINE    (10s,7p) -> [4s,3p]
CL Ahlrichs-VDZ
  7
  1  0  0  5  1
      10449.82756600          0.00197084
       1571.73652210          0.01475473
        357.12065523          0.06667911
        100.25185935          0.17228924
         30.81272755          0.15883786
  1  0  0  3  1
         51.92378943         -0.10009299
          5.70457610          0.60841753
          2.35083768          0.54352153
  1  0  0  1  1
          0.44605125          1.00000000
  1  0  0  1  1
          0.16848856          1.00000000
  1  1  1  5  1
        307.66790569         -0.00878015
         72.10201551         -0.06356336
         22.53268026         -0.24016428
          7.89917654         -0.47798867
          2.87672683         -0.38515850
  1  1  1  1  1
          0.77459364          1.00000000
  1  1  1  1  1
          0.21037700          1.00000000
# ARGON       (10s,7p) -> [4s,3p]
AR Ahlrichs-VDZ
  7
  1  0  0  5  1
      11797.11976500          0.00202145
       1774.35227530          0.01513985
        403.18875733          0.06852540
        113.24933999          0.17762929
         34.83529819          0.16496495
  1  0  0  3  1
         58.61477504         -0.10343394
          6.49220451          0.63133366
          2.71170144          0.54887572
  1  0  0  1  1
          0.54412975          1.00000000
  1  0  0  1  1
          0.20517411          1.00000000
  1  1  1  5  1
        356.28707256         -0.00873218
         83.59313287         -0.06368032
         26.18670403         -0.24311907
          9.22572759         -0.48956070
          3.39227550         -0.39229190
  1  1  1  1  1
          0.94740534          1.00000000
  1  1  1  1  1
          0.25659135          1.00000000
# POTASSIUM   (14s,8p) -> [5s,2p]
K  Ahlrichs-VDZ
  7
  1  0  0  6  1
      31478.74676400          0.00398387
       4726.88760660          0.03050176
       1075.43453530          0.15073753
        303.39811023          0.51912940
         98.32711283          1.03669570
         33.63622218          0.76398963
  1  0  0  3  1
         65.63920996         -0.28242617
          7.31625922          1.69149359
          2.89025801          1.29653320
  1  0  0  3  1
          4.54597490         -0.00763436
          0.70404124          0.02563572
          0.28266889          0.01660686
  1  0  0  1  1
          0.02905816          1.00000000
  1  0  0  1  1
          0.01211164          1.00000000
  1  1  1  5  1
        361.22492154          0.02090648
         84.67022217          0.15043642
         26.46908824          0.55440061
          9.26580776          1.04090100
          3.34233883          0.67825341
  1  1  1  3  1
          1.51008761          0.75248191
          0.56568375          1.37085850
          0.20817008          0.66047633
# CALCIUM     (14s,8p) -> [5s,2p]
CA Ahlrichs-VDZ
  7
  1  0  0  6  1
      35138.71392900          0.00394825
       5276.41113480          0.03023424
       1200.46925890          0.14952020
        338.71810542          0.51597346
        109.85385922          1.03395103
         37.60888030          0.76937934
  1  0  0  3  1
         73.10797755         -0.28268525
          8.24077057          1.67960921
          3.29598130          1.28037660
  1  0  0  3  1
          5.23418009         -0.00768686
          0.84187221          0.02538238
          0.36510294          0.01651217
  1  0  0  1  1
          0.05122240          1.00000000
  1  0  0  1  1
          0.01982511          1.00000000
  1  1  1  5  1
        413.11313893          0.02032714
         96.93578622          0.14730276
         30.37215466          0.54887167
         10.68477683          1.04406598
          3.88212583          0.68653491
  1  1  1  3  1
          1.79930163          0.75410247
          0.69189057          1.34092966
          0.26364024          0.56391989
# SCANDIUM    (14s,8p,5d) -> [5s,2p,2d]
SC Ahlrichs-VDZ
  9
  1  0  0  6  1
      38956.08180400          0.00392932
       5849.57336370          0.03009322
       1330.88131540          0.14890371
        375.55534165          0.51464283
        121.87261370          1.03377081
         41.76024373          0.77436852
  1  0  0  3  1
         81.06063395         -0.28318552
          9.20598240          1.67708070
          3.70632157          1.25947337
  1  0  0  3  1
          5.98889100         -0.00778214
          0.97363432          0.02549969
          0.42041019          0.01619156
  1  0  0  1  1
          0.05944055          1.00000000
  1  0  0  1  1
          0.02289781          1.00000000
  1  1  1  5  1
        466.31481262          0.01998430
        109.51217097          0.14561043
         34.37592183          0.54687466
         12.14209696          1.04790060
          4.43367677          0.68894890
  1  1  1  3  1
          2.09712919          0.75619215
          0.80977607          1.31782122
          0.30834047          0.54312268
  1  2  2  4  1
         19.24033493          0.02703908
          5.11789959          0.13803685
          1.65542788          0.34869086
          0.54016356          0.48594186
  1  2  2  1  1
          0.16211215          1.00000000
# TITANIUM    (14s,8p,5d) -> [5s,2p,2d]
TI Ahlrichs-VDZ
  9
  1  0  0  6  1
      42961.51218500          0.00391276
       6450.97591690          0.02996982
       1467.72109150          0.14836353
        414.20997355          0.51347285
        134.48715840          1.03353655
         46.12220980          0.77854234
  1  0  0  3  1
         89.44776254         -0.28385401
         10.22334606          1.67727853
          4.13537743          1.24119285
  1  0  0  3  1
          6.78961815         -0.00784000
          1.11067307          0.02549549
          0.47565976          0.01606117
  1  0  0  1  1
          0.06598696          1.00000000
  1  0  0  1  1
          0.02521034          1.00000000
  1  1  1  5  1
        522.03684782          0.01975418
        122.68649489          0.14460678
         38.57290361          0.54669004
         13.67216932          1.05316475
          5.01185294          0.69111213
  1  1  1  3  1
          2.41319283          0.75803437
          0.93252270          1.30362414
          0.35429058          0.53638653
  1  2  2  4  1
         23.46512596          0.02653638
          6.33325938          0.13796454
          2.07664899          0.35312644
          0.69027362          0.48647124
  1  2  2  1  1
          0.21088739          0.33026314
# VANADIUM    (14s,8p,5d) -> [5s,2p,2d]
V  Ahlrichs-VDZ
  9
  1  0  0  6  1
      47160.37606000          0.00144987
       7081.41108710          0.01110644
       1611.16212230          0.05500542
        454.72940551          0.19060253
        147.71321208          0.38435023
         50.69953895          0.29095547
  1  0  0  3  1
         98.26249267         -0.10942338
         11.29429310          0.64539490
          4.58533601          0.47117881
  1  0  0  3  1
          7.63596896         -0.22454949
          1.25398367          0.72594853
          0.53271935          0.45560583
  1  0  0  1  1
          0.07224624          1.00000000
  1  0  0  1  1
          0.02735809          1.00000000
  1  1  1  5  1
        580.55044988          0.00973151
        136.52341127          0.07153124
         42.98395882          0.27197688
         15.28279876          0.52618989
          5.62024952          0.34452533
  1  1  1  3  1
          2.74853864          0.34040396
          1.06185501          0.57983996
          0.40235519          0.23911643
  1  2  2  4  1
         27.35843402          0.02664193
          7.45406043          0.13995312
          2.46339178          0.35751067
          0.82480925          0.48488354
  1  2  2  1  1
          0.25257905          0.32332845
# CHROMIUM    (14s,8p,5d) -> [5s,2p,2d]
CR Ahlrichs-VDZ
  9
  1  0  0  6  1
      51528.08634900          0.00144058
       7737.21034870          0.01103620
       1760.37484700          0.05467665
        496.87706544          0.18965038
        161.46520598          0.38295413
         55.46635227          0.29090051
  1  0  0  3  1
        107.54732999         -0.10932281
         12.40867190          0.64472599
          5.04236288          0.46262713
  1  0  0  3  1
          8.54616402         -0.22711013
          1.39004412          0.73301528
          0.56066603          0.44225565
  1  0  0  1  1
          0.07148371          1.00000000
  1  0  0  1  1
          0.02825069          1.00000000
  1  1  1  5  1
        640.48536096          0.00961267
        150.69711194          0.07088983
         47.50375530          0.27065259
         16.93412017          0.52437343
          6.24096806          0.34107995
  1  1  1  3  1
          3.08854632          0.33973987
          1.17910478          0.57272063
          0.43369774          0.24582728
  1  2  2  4  1
         27.55947943          0.03061249
          7.46870203          0.15593271
          2.43459036          0.36984421
          0.78244755          0.47071118
  1  2  2  1  1
          0.21995774          0.33941650
# MANGANESE   (14s,8p,5d) -> [5s,2p,2d]
MN Ahlrichs-VDZ
  9
  1  0  0  6  1
      56137.00903700          0.00143213
       8429.20639430          0.01097251
       1917.82772330          0.05438247
        541.36230198          0.18884335
        176.00069142          0.38198025
         60.50047701          0.29156773
  1  0  0  3  1
        117.17282882         -0.10933661
         13.59697337          0.64305039
          5.54839963          0.45848971
  1  0  0  3  1
          9.46628535         -0.22538977
          1.55950061          0.72307759
          0.65230206          0.45300722
  1  0  0  1  1
          0.08400373          1.00000000
  1  0  0  1  1
          0.03125610          1.00000000
  1  1  1  5  1
        706.00497535          0.00950555
        166.19728820          0.07035627
         52.45206191          0.27005557
         18.74693286          0.52574345
          6.92829916          0.34254033
  1  1  1  3  1
          3.47722049          0.33994074
          1.34069064          0.57203836
          0.50498803          0.23847606
  1  2  2  4  1
         35.42326493          0.02698530
          9.78142215          0.14383459
          3.26734888          0.36418958
          1.10264722          0.48152671
  1  2  2  1  1
          0.33743206          0.31458754
# IRON        (14s,8p,5d) -> [5s,2p,2d]
FE Ahlrichs-VDZ
  9
  1  0  0  6  1
      60923.64064300          0.00143023
       9147.88939820          0.01095879
       2081.35059270          0.05433255
        587.55977067          0.18884995
        191.09043990          0.38253070
         65.73273011          0.29308336
  1  0  0  3  1
        127.25891928         -0.10964565
         14.83091301          0.64387631
          6.06533074          0.45472347
  1  0  0  3  1
         10.44994371         -0.22539640
          1.72452280          0.72164398
          0.71772177          0.44985493
  1  0  0  1  1
          0.09144983          1.00000000
  1  0  0  1  1
          0.03370669          1.00000000
  1  1  1  5  1
        773.43750995          0.00943257
        182.15149714          0.07002962
         57.54727276          0.26993652
         20.61498894          0.52700011
          7.63485579          0.34284148
  1  1  1  3  1
          3.87193280          0.33974403
          1.49247241          0.56842594
          0.56061285          0.23649366
  1  2  2  4  1
         38.96813342          0.02787966
         10.80006708          0.14858320
          3.61364580          0.36905479
          1.21299679          0.47745101
  1  2  2  1  1
          0.36524393          0.31418142
# COBALT      (14s,8p,5d) -> [5s,2p,2d]
CO Ahlrichs-VDZ
  9
  1  0  0  6  1
      65902.20825700          0.00142846
       9895.38960270          0.01094607
       2251.43057890          0.05428595
        635.61097084          0.18885179
        206.78820681          0.38301635
         71.17924297          0.29443551
  1  0  0  3  1
        137.77268040         -0.10990222
         16.11807924          0.64455537
          6.60303277          0.45116788
  1  0  0  3  1
         11.47991579         -0.22593847
          1.89564263          0.72231409
          0.78466232          0.44903812
  1  0  0  1  1
          0.09842577          1.00000000
  1  0  0  1  1
          0.03594574          1.00000000
  1  1  1  5  1
        843.64358575          0.00938661
        198.76386994          0.06988021
         62.85496310          0.27037070
         22.56284228          0.52904787
          8.37132091          0.34357030
  1  1  1  3  1
          4.28587198          0.34027999
          1.65080418          0.56693392
          0.61834231          0.23617980
  1  2  2  4  1
         42.92786761          0.02848779
         11.94253305          0.15206951
          4.00464957          0.37310914
          1.34131938          0.47549838
  1  2  2  1  1
          0.40015010          0.31346831
# NICKEL      (14s,8p,5d) -> [5s,2p,2d]
NI Ahlrichs-VDZ
  9
  1  0  0  6  1
      71074.80321100          0.00142604
      10672.02094100          0.01092824
       2428.13890070          0.05421263
        685.53595148          0.18874769
        223.10072863          0.38324617
         76.84201404          0.29550637
  1  0  0  3  1
        148.71122016         -0.11014443
         17.45915499          0.64521427
          7.16252807          0.44797838
  1  0  0  3  1
         12.55613713         -0.22645403
          2.07357405          0.72320959
          0.85382641          0.44868026
  1  0  0  1  1
          0.10536766          1.00000000
  1  0  0  1  1
          0.03813409          1.00000000
  1  1  1  5  1
        916.73608662          0.00934396
        216.06139913          0.06973737
         68.38391482          0.27073495
         24.59384395          0.53078302
          9.13929602          0.34410229
  1  1  1  3  1
          4.71933717          0.34076082
          1.81618492          0.56580170
          0.67840751          0.23616717
  1  2  2  4  1
         47.09383211          0.02898232
         13.14646397          0.15494996
          4.41705489          0.37633115
          1.47715651          0.47365096
  1  2  2  1  1
          0.43735922          0.31247838
# COPPER      (14s,8p,5d) -> [5s,2p,2d]
CU Ahlrichs-VDZ
  9
  1  0  0  6  1
      76381.34805600          0.00143361
      11468.77749900          0.01098675
       2609.42464950          0.05451365
        736.75033098          0.18990128
        239.82419958          0.38581959
         82.65682925          0.29790607
  1  0  0  3  1
        160.13544196         -0.11146779
         18.83417770          0.65349301
          7.71765957          0.44770534
  1  0  0  3  1
         13.71084672         -0.22870911
          2.23498957          0.73464423
          0.87818360          0.43273071
  1  0  0  1  1
          0.08718746          1.00000000
  1  0  0  1  1
          0.03296911          1.00000000
  1  1  1  5  1
        991.24075782          0.00938785
        233.69376116          0.07020828
         74.02093093          0.27323522
         26.66496745          0.53580793
          9.91920875          0.34575795
  1  1  1  3  1
          5.15195539          0.34229108
          1.96382058          0.56456592
          0.71560097          0.24078584
  1  2  2  4  1
         47.33504959          0.03237555
         13.16166608          0.16810219
          4.36937772          0.38477708
          1.41329251          0.46147880
  1  2  2  1  1
          0.38878001          0.32388873
# ZINC        (13s,8p,5d) -> [5s,2p,2d]
ZN Ahlrichs-VDZ
  9
  1  0  0  6  1
      82000.71162900          0.00142108
      12312.47177700          0.01089150
       2801.39441930          0.05405719
        790.99424302          0.18847464
        257.56551079          0.38346549
         88.81493340          0.29723794
  1  0  0  3  1
        171.86353716         -0.11051850
         20.30253478          0.64607717
          8.34641231          0.44220117
  1  0  0  3  1
         14.84753694         -0.22705309
          2.44950295          0.72433218
          0.99845822          0.44836496
  1  0  0  1  1
          0.11891308          1.00000000
  1  0  0  1  1
          0.04229743          1.00000000
  1  1  1  5  1
       1071.51853720          0.00927678
        252.69712152          0.06954115
         80.10082913          0.27156773
         28.90339317          0.53401356
         10.76889988          0.34501323
  1  1  1  3  1
          5.64462125          0.34129600
          2.16782913          0.56390522
          0.80540898          0.23676110
  1  2  2  4  1
         56.08893919          0.02958887
         15.75190892          0.15872571
          5.31158124          0.37976229
          1.77379049          0.46898959
  1  2  2  1  1
          0.51975584          0.30907149
# GALLIUM     (14s,10p,5d) -> [5s,4p,2d]
GA Ahlrichs-VDZ
 11
  1  0  0  6  1
      87842.12629600          0.00142716
      13189.49640200          0.01093889
       3000.94821410          0.05430820
        847.38425966          0.18951056
        276.00980642          0.38615186
         95.21667207          0.30051083
  1  0  0  3  1
        184.00703968         -0.11124462
         21.82705143          0.64831323
          9.00269638          0.44358384
  1  0  0  3  1
         16.03317694         -0.23014300
          2.67077249          0.72946862
          1.12528342          0.46214977
  1  0  0  1  1
          0.15967609          1.00000000
  1  0  0  1  1
          0.05764304          1.00000000
  1  1  1  5  1
       1167.26658440          0.00909740
        275.38062789          0.06845627
         87.37507307          0.26922294
         31.59725467          0.53507898
         11.82412280          0.35279063
  1  1  1  3  1
          6.28818451          0.33938245
          2.51998532          0.56871948
          1.01697263          0.27717695
  1  1  1  1  1
          0.24748374          1.00000000
  1  1  1  1  1
          0.06668529          1.00000000
  1  2  2  4  1
         65.35423767          0.02737015
         18.50465675          0.15099464
          6.31796206          0.37485329
          2.16413894          0.47510607
  1  2  2  1  1
          0.66693093          0.29843287
# GERMANIUM   (14s,10p,5d) -> [5s,4p,2d]
GE Ahlrichs-VDZ
 11
  1  0  0  6  1
      93889.83664200          0.00142340
      14097.49752800          0.01091080
       3207.54773090          0.05418371
        905.76727269          0.18922820
        295.11014693          0.38612847
        101.84713141          0.30164051
  1  0  0  3  1
        196.56719662         -0.11118771
         23.40529252          0.64616007
          9.68391167          0.44188905
  1  0  0  3  1
         17.26973654         -0.23027421
          2.89646222          0.73017169
          1.25536214          0.46197222
  1  0  0  1  1
          0.20213081          1.00000000
  1  0  0  1  1
          0.07386791          1.00000000
  1  1  1  5  1
       1259.20859950          0.00901155
        297.15626382          0.06798684
         94.35338752          0.26853856
         34.17632968          0.53659649
         12.81613962          0.35633515
  1  1  1  3  1
          6.84710298          0.33900693
          2.77173639          0.56809365
          1.14584182          0.27246540
  1  1  1  1  1
          0.30679632          1.00000000
  1  1  1  1  1
          0.08928364          1.00000000
  1  2  2  4  1
         74.78216818          0.02575586
         21.31084976          0.14536816
          7.34647924          0.37134210
          2.56562714          0.48002998
  1  2  2  1  1
          0.81981773          0.28978791
# ARSENIC     (14s,10p,5d) -> [5s,4p,2d]
AS Ahlrichs-VDZ
 11
  1  0  0  6  1
     100146.52554000          0.00142583
      15036.86171100          0.01093018
       3421.29028330          0.05429417
        966.16965717          0.18976078
        314.87394026          0.38775195
        108.70823790          0.30402812
  1  0  0  3  1
        209.54238950         -0.11162094
         25.03822114          0.64697608
         10.39096434          0.44223609
  1  0  0  3  1
         18.55509009         -0.22994191
          3.12812174          0.73319108
          1.38848851          0.45533654
  1  0  0  1  1
          0.24714362          1.00000000
  1  0  0  1  1
          0.09142943          1.00000000
  1  1  1  5  1
       1355.64435070          0.00891825
        319.99929270          0.06745475
        101.67734092          0.26759772
         36.88632384          0.53776845
         13.86111591          0.35992570
  1  1  1  3  1
          7.42606669          0.34036850
          3.03162472          0.57030149
          1.27830783          0.26606170
  1  1  1  1  1
          0.37568503          1.00000000
  1  1  1  1  1
          0.11394805          1.00000000
  1  2  2  4  1
         84.44551454          0.02451840
         24.19041610          0.14107455
          8.40450151          0.36875229
          2.98089707          0.48409561
  1  2  2  1  1
          0.97909243          0.28250269
# SELENIUM    (14s,10p,5d) -> [5s,4p,2d]
SE Ahlrichs-VDZ
 11
  1  0  0  6  1
     106612.20027000          0.00142749
      16007.60470100          0.01094353
       3642.16997070          0.05437417
       1028.59129930          0.19018093
        335.30298888          0.38913022
        115.80129154          0.30620207
  1  0  0  3  1
        222.93325020         -0.11198808
         26.72625793          0.64752124
         11.12450192          0.44241977
  1  0  0  3  1
         19.88852006         -0.22857228
          3.36684738          0.73591360
          1.52492778          0.44330200
  1  0  0  1  1
          0.29630038          1.00000000
  1  0  0  1  1
          0.11009289          1.00000000
  1  1  1  5  1
       1455.90681200          0.00882036
        343.75101831          0.06687585
        109.29554964          0.26640578
         39.70771102          0.53834928
         14.95018523          0.36303282
  1  1  1  3  1
          8.02089621          0.34153807
          3.29346498          0.57257907
          1.40586024          0.25549813
  1  1  1  1  1
          0.45076123          1.00000000
  1  1  1  1  1
          0.13353413          1.00000000
  1  2  2  4  1
         94.49402404          0.02349010
         27.18818526          0.13747736
          9.50915674          0.36649929
          3.41705169          0.48750990
  1  2  2  1  1
          1.14795901          0.27657943
# BROMINE     (14s,10p,5d) -> [5s,4p,2d]
BR Ahlrichs-VDZ
 11
  1  0  0  6  1
     113286.38776000          0.00142830
      17009.62630300          0.01095042
       3870.18425670          0.05442101
       1093.03572270          0.19047908
        356.39721797          0.39024643
        123.12539643          0.30814433
  1  0  0  3  1
        236.74084007         -0.11228066
         28.46866107          0.64775962
         11.88344372          0.44235576
  1  0  0  3  1
         21.26963331         -0.22642576
          3.61292268          0.73823712
          1.66266490          0.42683869
  1  0  0  1  1
          0.34823793          1.00000000
  1  0  0  1  1
          0.13019031          1.00000000
  1  1  1  5  1
       1560.28018810          0.00871667
        368.47859205          0.06624364
        117.22978849          0.26495610
         42.64890925          0.53839161
         16.08722510          0.36579388
  1  1  1  3  1
          8.63528101          0.34248787
          3.56136655          0.57500678
          1.52926266          0.24330394
  1  1  1  1  1
          0.53064295          1.00000000
  1  1  1  1  1
          0.15702759          1.00000000
  1  2  2  4  1
        104.85518642          0.02265015
         30.28114369          0.13455483
         10.65139427          0.36474455
          3.86994562          0.49044587
  1  2  2  1  1
          1.32408768          0.27137289
# KRYPTON     (14s,10p,5d) -> [5s,4p,2d]
KR Ahlrichs-VDZ
 11
  1  0  0  6  1
     120165.64875000          0.00142942
      18042.50016900          0.01095960
       4105.18003880          0.05447965
       1159.44472480          0.19081239
        378.13810346          0.39140446
        130.67610045          0.31007347
  1  0  0  3  1
        250.96373353         -0.11258604
         30.26593038          0.64816323
         12.66811076          0.44240239
  1  0  0  3  1
         22.69794010         -0.22391965
          3.86730174          0.74060953
          1.80137067          0.40803658
  1  0  0  1  1
          0.40308639          1.00000000
  1  0  0  1  1
          0.15170528          1.00000000
  1  1  1  5  1
       1668.57366230          0.00862150
        394.13862798          0.06566551
        125.46644854          0.26366577
         45.70499273          0.53867659
         17.27013323          0.36865168
  1  1  1  3  1
          9.26994878          0.34346189
          3.83646177          0.57784776
          1.64671633          0.23075615
  1  1  1  1  1
          0.61479686          1.00000000
  1  1  1  1  1
          0.18319467          1.00000000
  1  2  2  4  1
        115.55868603          0.02194549
         33.47798586          0.13211213
         11.83445021          0.36333307
          4.34082549          0.49300484
  1  2  2  1  1
          1.50792732          0.26676859
# BASIS="Ahlrichs VTZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#
# HYDROGEN    (5s) -> [3s]
H  Ahlrichs-VTZ
  3
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
# HELIUM      (5s) -> [3s]
HE Ahlrichs-VTZ
  3
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
# LITHIUM     (10s) -> [6s]
LI Ahlrichs-VTZ
  6
  1  0  0  5  1
       3341.40288120          0.00068826
        500.95159311          0.00532964
        114.01103106          0.02756437
         32.26547306          0.10988243
         10.47205852          0.33943049
  1  0  0  1  1
          3.69782842          1.00000000
  1  0  0  1  1
          1.37120853          1.00000000
  1  0  0  1  1
          0.51908460          1.00000000
  1  0  0  1  1
          0.07453289          1.00000000
  1  0  0  1  1
          0.02823360          1.00000000
# BERYLLIUM   (10s) -> [6s]
BE Ahlrichs-VTZ
  6
  1  0  0  5  1
       6526.14777960          0.00043732
        978.35496417          0.00338821
        222.65865756          0.01756309
         63.01302828          0.07058048
         20.46872018          0.22263836
  1  0  0  1  1
          7.26924874          1.00000000
  1  0  0  1  1
          2.73937011          1.00000000
  1  0  0  1  1
          1.06157911          1.00000000
  1  0  0  1  1
          0.18158440          1.00000000
  1  0  0  1  1
          0.05882682          1.00000000
# BORON       (10s,6p) -> [6s,3p]
B  Ahlrichs-VTZ
  9
  1  0  0  5  1
       5658.49920000          0.00055208
        848.69703000          0.00426514
        193.13656000          0.02185317
         54.58631700          0.08457068
         17.60012600          0.24304764
  1  0  0  1  1
          6.12696180          1.00000000
  1  0  0  1  1
          2.22452700          1.00000000
  1  0  0  1  1
          0.55650352          1.00000000
  1  0  0  1  1
          0.23876229          1.00000000
  1  0  0  1  1
          0.08579396          1.00000000
  1  1  1  4  1
         22.45580200         -0.00502606
          5.10306750         -0.03282698
          1.49840960         -0.13140941
          0.50989073         -0.33125264
  1  1  1  1  1
          0.18191350          1.00000000
  1  1  1  1  1
          0.06482718          1.00000000
# CARBON      (10s,6p) -> [6s,3p]
C  Ahlrichs-VTZ
  9
  1  0  0  5  1
       8506.03840000          0.00053374
       1275.73290000          0.00412502
        290.31187000          0.02117134
         82.05620000          0.08241786
         26.47964100          0.24012858
  1  0  0  1  1
          9.24145850          1.00000000
  1  0  0  1  1
          3.36435300          1.00000000
  1  0  0  1  1
          0.87174164          1.00000000
  1  0  0  1  1
          0.36352352          1.00000000
  1  0  0  1  1
          0.12873135          1.00000000
  1  1  1  4  1
         34.70949600          0.00533010
          7.95908830          0.03586581
          2.37869720          0.14200299
          0.81540065          0.34203105
  1  1  1  1  1
          0.28953785          1.00000000
  1  1  1  1  1
          0.10084754          1.00000000
# NITROGEN    (10s,6p) -> [6s,3p]
N  Ahlrichs-VTZ
  9
  1  0  0  5  1
      11913.41675600         -0.00052297
       1786.72138340         -0.00404284
        406.59012834         -0.02077272
        114.92525065         -0.08118314
         37.10588342         -0.23871497
  1  0  0  1  1
         12.97167620          1.00000000
  1  0  0  1  1
          4.73022912          1.00000000
  1  0  0  1  1
          1.25251843          1.00000000
  1  0  0  1  1
          0.51260071          1.00000000
  1  0  0  1  1
          0.17939714          1.00000000
  1  1  1  4  1
         49.21875839          0.00555270
         11.34893530          0.03805462
          3.42850882          0.14941412
          1.17995126          0.34898187
  1  1  1  1  1
          0.41726123          1.00000000
  1  1  1  1  1
          0.14295131          1.00000000
# OXYGEN      (10s,6p) -> [6s,3p]
O  Ahlrichs-VTZ
  9
  1  0  0  5  1
      15902.64745900          0.00051500
       2384.95378290          0.00398198
        542.71957182          0.02047697
        153.40407874          0.08026237
         49.54571614          0.23766840
  1  0  0  1  1
         17.33964990          1.00000000
  1  0  0  1  1
          6.33033553          1.00000000
  1  0  0  1  1
          1.69958822          1.00000000
  1  0  0  1  1
          0.68954491          1.00000000
  1  0  0  1  1
          0.23936028          1.00000000
  1  1  1  4  1
         63.27052401          0.00607092
         14.62331229          0.04194769
          4.44895180          0.16156884
          1.52815132          0.35682779
  1  1  1  1  1
          0.52997316          1.00000000
  1  1  1  1  1
          0.17509446          1.00000000
# FLUORINE    (10s,6p) -> [6s,3p]
F  Ahlrichs-VTZ
  9
  1  0  0  5  1
      20450.48900000          0.00051103
       3066.95470000          0.00395188
        697.91003000          0.02033455
        197.27020000          0.07987648
         63.72834300          0.23775601
  1  0  0  1  1
         22.32180900          1.00000000
  1  0  0  1  1
          8.15576090          1.00000000
  1  0  0  1  1
          2.21142950          1.00000000
  1  0  0  1  1
          0.89038567          1.00000000
  1  0  0  1  1
          0.30696604          1.00000000
  1  1  1  4  1
         80.21802000          0.00637445
         18.58728100          0.04436019
          5.68445810          0.16880038
          1.95127810          0.36162979
  1  1  1  1  1
          0.67024114          1.00000000
  1  1  1  1  1
          0.21682252          1.00000000
# NEON        (10s,6p) -> [6s,3p]
NE Ahlrichs-VTZ
  9
  1  0  0  5  1
      25558.39832000         -0.00050573
       3832.94048040         -0.00391125
        872.21073777         -0.02013482
        246.53755414         -0.07922343
         79.65839486         -0.23675798
  1  0  0  1  1
         27.91979965          1.00000000
  1  0  0  1  1
         10.20713166          1.00000000
  1  0  0  1  1
          2.78831867          1.00000000
  1  0  0  1  1
          1.11539947          1.00000000
  1  0  0  1  1
          0.38234011          1.00000000
  1  1  1  4  1
         99.76096643          0.00656487
         23.16768895          0.04595815
          7.11338987          0.17349981
          2.44185744          0.36486075
  1  1  1  1  1
          0.83442063          1.00000000
  1  1  1  1  1
          0.26639881          1.00000000
# SODIUM      (12s,6p) -> [7s,2p]
NA Ahlrichs-VTZ
  9
  1  0  0  5  1
      48876.19814700          0.00030496
       7327.28637080          0.00236328
       1667.41946520          0.01226845
        471.58101196          0.04962518
        152.93669811          0.15949592
  1  0  0  1  1
         54.35585547          1.00000000
  1  0  0  2  1
         20.76522281          0.40072046
          8.35994957          0.18337373
  1  0  0  1  1
          2.14809459          1.00000000
  1  0  0  1  1
          0.68819414          1.00000000
  1  0  0  1  1
          0.06047710          1.00000000
  1  0  0  1  1
          0.02713409          1.00000000
  1  1  1  5  1
        137.96254761          0.00592646
         32.20910536          0.04254399
          9.97463791          0.16644535
          3.47809300          0.36814915
          1.22843715          0.45781035
  1  1  1  1  1
          0.41731936          1.00000000
# MAGNESIUM   (12s,6p) -> [7s,2p]
MG Ahlrichs-VTZ
  9
  1  0  0  5  1
      58088.34977800          0.00029218
       8708.11809980          0.00226442
       1981.62241820          0.01175604
        560.43985997          0.04756994
        181.72976108          0.15308048
  1  0  0  1  1
         64.60333573          1.00000000
  1  0  0  2  1
         24.74214467          0.39883561
         10.02466472          0.18188815
  1  0  0  1  1
          2.69474413          1.00000000
  1  0  0  1  1
          0.91145252          1.00000000
  1  0  0  1  1
          0.10689673          1.00000000
  1  0  0  1  1
          0.04009162          1.00000000
  1  1  1  5  1
        179.83372724          0.00538198
         42.11309666          0.03932575
         13.11735377          0.15749044
          4.62294354          0.35940561
          1.66857858          0.45516230
  1  1  1  1  1
          0.58547797          0.21970492
# ALUMINUM    (12s9p) -> [7s5p]
AL Ahlrichs-VTZ
 12
  1  0  0  5  1
      68090.41167700          0.00028413
      10207.54082200          0.00220207
       2322.80458540          0.01143344
        656.88653838          0.04628459
        212.96694104          0.14910566
  1  0  0  1  1
         75.72471659          1.00000000
  1  0  0  2  1
         29.07632002          0.41663518
         11.85962393          0.18978371
  1  0  0  1  1
          3.31621532          1.00000000
  1  0  0  1  1
          1.17547888          1.00000000
  1  0  0  1  1
          0.17520529          1.00000000
  1  0  0  1  1
          0.06475875          1.00000000
  1  1  1  5  1
        442.79182587          0.00163911
        104.75988837          0.01314352
         33.37597945          0.06149771
         12.30538796          0.18825909
          4.86424757          0.36062611
  1  1  1  1  1
          1.96040271          1.00000000
  1  1  1  1  1
          0.78436734          1.00000000
  1  1  1  1  1
          0.19014165          1.00000000
  1  1  1  1  1
          0.05587437          1.00000000
# SILICON     (12s,9p) -> [7s,5p]
SI Ahlrichs-VTZ
 12
  1  0  0  5  1
      79079.43400000          0.00026431
      11855.01000000          0.00204851
       2697.70510000          0.01063724
        762.87227000          0.04308248
        247.28455000          0.13898279
  1  0  0  1  1
         87.93124000          1.00000000
  1  0  0  2  1
         33.82328400          0.44071543
         13.86810800          0.20091165
  1  0  0  1  1
          3.99200170          1.00000000
  1  0  0  1  1
          1.46599250          1.00000000
  1  0  0  1  1
          0.25271086          1.00000000
  1  0  0  1  1
          0.09249167          1.00000000
  1  1  1  5  1
        483.02352000          0.00191615
        114.25081000          0.01530977
         36.38778600          0.07109436
         13.41170400          0.21243244
          5.28840330          0.38976302
  1  1  1  1  1
          2.13742190          1.00000000
  1  1  1  1  1
          0.86468463          1.00000000
  1  1  1  1  1
          0.25489855          1.00000000
  1  1  1  1  1
          0.07939703          1.00000000
# PHOSPHORUS  (12s,9p) -> [7s,5p]
P  Ahlrichs-VTZ
 12
  1  0  0  5  1
      91049.04952500          0.00025380
      13649.24886400          0.00196712
       3105.94320740          0.01021606
        878.25982630          0.04139916
        284.63392907          0.13375415
  1  0  0  1  1
        101.20610005          1.00000000
  1  0  0  2  1
         38.97784142          0.45416113
         16.04849407          0.20742198
  1  0  0  1  1
          4.72253391          1.00000000
  1  0  0  1  1
          1.78252219          1.00000000
  1  0  0  1  1
          0.33962968          1.00000000
  1  0  0  1  1
          0.12333860          1.00000000
  1  1  1  5  1
        528.44389328         -0.00228152
        124.97149951         -0.01818364
         39.79570925         -0.08394070
         14.65754497         -0.24604714
          5.75788928         -0.43655668
  1  1  1  1  1
          2.31232010          1.00000000
  1  1  1  1  1
          0.88993781          1.00000000
  1  1  1  1  1
          0.30467150          1.00000000
  1  1  1  1  1
          0.10078154          1.00000000
# SULFUR      (12s,9p) -> [7s,5p]
S  Ahlrichs-VTZ
 12
  1  0  0  5  1
     103953.95000000          0.00024743
      15583.78600000          0.00191777
       3546.12930000          0.00996100
       1002.68080000          0.04038643
        324.90288000          0.13067523
  1  0  0  1  1
        115.51225000          1.00000000
  1  0  0  2  1
         44.52821000          0.50403551
         18.39789200          0.23068051
  1  0  0  1  1
          5.51006830          1.00000000
  1  0  0  1  1
          2.12598670          1.00000000
  1  0  0  1  1
          0.43691893          1.00000000
  1  0  0  1  1
          0.15730851          1.00000000
  1  1  1  5  1
        606.69367000          0.00232296
        143.50696000          0.01857053
         45.74616000          0.08603274
         16.87291200          0.25248431
          6.63991960          0.44632742
  1  1  1  1  1
          2.67271350          1.00000000
  1  1  1  1  1
          1.00000890          1.00000000
  1  1  1  1  1
          0.35438942          1.00000000
  1  1  1  1  1
          0.11671305          1.00000000
# CHLORINE    (12s,9p) -> [7s,5p]
CL Ahlrichs-VTZ
 12
  1  0  0  5  1
     117805.79000000          0.00024181
      17660.26500000          0.00187427
       4018.59730000          0.00973629
       1136.22310000          0.03949475
        368.12062000          0.12797166
  1  0  0  1  1
        130.86154000          1.00000000
  1  0  0  2  1
         50.47901100          0.42874094
         20.91680500          0.19668493
  1  0  0  1  1
          6.35313880          1.00000000
  1  0  0  1  1
          2.49480140          1.00000000
  1  0  0  1  1
          0.54335948          1.00000000
  1  0  0  1  1
          0.19434366          1.00000000
  1  1  1  5  1
        681.06879000          0.00236589
        161.11359000          0.01894072
         51.38663700          0.08784513
         18.95851200          0.25707435
          3.00351580          0.37152361
  1  1  1  1  1
          7.45652930          1.00000000
  1  1  1  1  1
          1.06093610          1.00000000
  1  1  1  1  1
          0.39452023          1.00000000
  1  1  1  1  1
          0.13323279          1.00000000
# ARGON       (12s,9p) -> [7s,5p]
AR Ahlrichs-VTZ
 12
  1  0  0  5  1
     132594.74255000          0.00025484
      19877.21005100          0.00197533
       4523.05259890          0.01026246
       1278.80310450          0.04164867
        414.25618940          0.13513377
  1  0  0  1  1
        147.24194110          1.00000000
  1  0  0  2  1
         56.82615538          0.45141633
         23.60408598          0.20758832
  1  0  0  1  1
          7.25249520          1.00000000
  1  0  0  1  1
          2.88929799          1.00000000
  1  0  0  1  1
          0.65887983          1.00000000
  1  0  0  1  1
          0.23439561          1.00000000
  1  1  1  5  1
        828.33969804          0.00217730
        196.06510758          0.01759744
         62.68122758          0.08290592
         23.22507784          0.24934103
          9.21678155          0.45327281
  1  1  1  1  1
          3.75955330          1.00000000
  1  1  1  1  1
          1.43167859          1.00000000
  1  1  1  1  1
          0.51298266          1.00000000
  1  1  1  1  1
          0.16821487          1.00000000
# POTASSIUM   (14s,9p) -> [8s,5p]
K  Ahlrichs-VTZ
 13
  1  0  0  6  1
     182594.27324000         -0.00022775
      27369.00498600         -0.00176640
       6229.17379710         -0.00919497
       1764.58234860         -0.03745508
        577.05120588         -0.12204454
        210.24933364         -0.29898972
  1  0  0  2  1
         82.61783064         -0.40514697
         33.23318452         -0.29253151
  1  0  0  1  1
          8.10649021          1.00000000
  1  0  0  1  1
          3.33402588          1.00000000
  1  0  0  1  1
          0.84554422          1.00000000
  1  0  0  1  1
          0.32821627          1.00000000
  1  0  0  1  1
          0.03640353          1.00000000
  1  0  0  1  1
          0.01764629          1.00000000
  1  1  1  3  1
        891.05446872          0.00218429
        211.01581996          0.01758911
         67.67141238          0.08177747
  1  1  1  3  1
         25.27148810          0.24565632
         10.13895897          0.43398377
          4.20186272          0.36237665
  1  1  1  1  1
          1.60294672          1.00000000
  1  1  1  1  1
          0.61461253          1.00000000
  1  1  1  1  1
          0.22199301          1.00000000
# CALCIUM     (14s,9p) -> [8s,5p]
CA Ahlrichs-VTZ
 13
  1  0  0  6  1
     202698.95519000          0.00022296
      30382.46591500          0.00172932
       6915.08331500          0.00900226
       1959.02109840          0.03666989
        640.93602075          0.11940987
        233.97696836          0.29182526
  1  0  0  2  1
         92.28919831          0.40441528
         37.25447991          0.29631289
  1  0  0  1  1
          9.13198433          1.00000000
  1  0  0  1  1
          3.81778579          1.00000000
  1  0  0  1  1
          1.04934751          1.00000000
  1  0  0  1  1
          0.42865992          1.00000000
  1  0  0  1  1
          0.06282264          1.00000000
  1  0  0  1  1
          0.02601624          1.00000000
  1  1  1  3  1
       1019.76076380         -0.00205986
        241.59630759         -0.01665008
         77.63701208         -0.07776460
  1  1  1  3  1
         29.11541943         -0.24180561
         11.76259359         -0.43257799
          4.92289242         -0.36732482
  1  1  1  1  1
          1.92232572          1.00000000
  1  1  1  1  1
          0.75796197          1.00000000
  1  1  1  1  1
          0.28430199          1.00000000
# SCANDIUM    (14s,9p,5d) -> [8s,5p,3d]
SC Ahlrichs-VTZ
 16
  1  0  0  6  1
     224356.94297000          0.00021996
      33628.70606000          0.00170604
       7654.01714830          0.00888153
       2168.43965660          0.03618370
        709.62663857          0.11783927
        259.31731327          0.28791645
  1  0  0  2  1
        102.47803758          0.36705139
         41.44313969          0.27161996
  1  0  0  1  1
         10.20185562          1.00000000
  1  0  0  1  1
          4.30449827          1.00000000
  1  0  0  1  1
          1.22194574          1.00000000
  1  0  0  1  1
          0.49725181          1.00000000
  1  0  0  1  1
          0.07272808          1.00000000
  1  0  0  1  1
          0.02939383          1.00000000
  1  1  1  3  1
       1154.99095920          0.00201027
        273.70496612          0.01630507
         88.06932731          0.07652789
  1  1  1  3  1
         33.11076003          0.23950904
         13.43644075          0.43235380
          5.65809846          0.36969429
  1  1  1  1  1
          2.24367043          1.00000000
  1  1  1  1  1
          0.88798004          1.00000000
  1  1  1  1  1
          0.33282410          1.00000000
  1  2  2  3  1
         19.23852404          0.02705466
          5.11733059          0.13813250
          1.65498839          0.34895303
  1  2  2  1  1
          0.54017605          1.00000000
  1  2  2  1  1
          0.16210625          1.00000000
# TITANIUM    (14s,9p,5d) -> [8s,5p,3d]
TI Ahlrichs-VTZ
 16
  1  0  0  6  1
     247254.20472000         -0.00022396
      37060.74757700         -0.00173712
       8435.17003120         -0.00904390
       2389.82990200         -0.03685082
        782.23119870         -0.12004208
        286.06776406         -0.29336894
  1  0  0  2  1
        113.20644330         -0.39817815
         45.84572039         -0.29713034
  1  0  0  1  1
         11.32852481          1.00000000
  1  0  0  1  1
          4.81252194          1.00000000
  1  0  0  1  1
          1.39576587          1.00000000
  1  0  0  1  1
          0.56327895          1.00000000
  1  0  0  1  1
          0.08051296          1.00000000
  1  0  0  1  1
          0.03192646          1.00000000
  1  1  1  3  1
       1298.41621070          0.00202474
        307.75625781          0.01647259
         99.13123393          0.07766728
  1  1  1  3  1
         37.34530556          0.24328820
         15.21071260          0.44259359
          6.43689814          0.38049636
  1  1  1  1  1
          2.58439289          1.00000000
  1  1  1  1  1
          1.02299933          1.00000000
  1  1  1  1  1
          0.38233959          1.00000000
  1  2  2  3  1
         23.46575100          0.02654283
          6.33323007          0.13802285
          2.07640799          0.35327843
  1  2  2  1  1
          0.69041160          1.00000000
  1  2  2  1  1
          0.21092515          1.00000000
# VANADIUM    (14s,9p,5d) -> [8s,5p,3d]
V  Ahlrichs-VTZ
 16
  1  0  0  6  1
     271348.15944000          0.00021967
      40672.00507800          0.00170386
       9257.07613850          0.00887137
       2622.73287730          0.03615432
        858.59480185          0.11780891
        314.19418650          0.28802536
  1  0  0  2  1
        124.47862127          0.42757917
         50.46939931          0.32144231
  1  0  0  1  1
         12.51384691          1.00000000
  1  0  0  1  1
          5.34477581          1.00000000
  1  0  0  1  1
          1.57556313          1.00000000
  1  0  0  1  1
          0.63069033          1.00000000
  1  0  0  1  1
          0.08795444          1.00000000
  1  0  0  1  1
          0.03429692          1.00000000
  1  1  1  3  1
       1450.03193270         -0.00195174
        343.75049884         -0.01592201
        110.82521708         -0.07538526
  1  1  1  3  1
         41.82246455         -0.23665641
         17.08807371         -0.43346920
          7.26132189         -0.37433001
  1  1  1  1  1
          2.94581453          1.00000000
  1  1  1  1  1
          1.16502097          1.00000000
  1  1  1  1  1
          0.43399378          1.00000000
  1  2  2  3  1
         27.36033586          0.02664427
          7.45427655          0.13999436
          2.46322702          0.35761186
  1  2  2  1  1
          0.82499542          1.00000000
  1  2  2  1  1
          0.25262971          1.00000000
# CHROMIUM    (14s,9p,5d) -> [8s,5p,3d]
CR Ahlrichs-VTZ
 16
  1  0  0  6  1
     296910.38175000          0.00021632
      44503.29798100          0.00167789
      10129.08373100          0.00873677
       2869.81253950          0.03561401
        939.52851828          0.11612082
        343.87667562          0.28429366
  1  0  0  2  1
        136.27242081          0.39618805
         55.27493591          0.29934143
  1  0  0  1  1
         13.75371506          1.00000000
  1  0  0  1  1
          5.88930645          1.00000000
  1  0  0  1  1
          1.73667819          1.00000000
  1  0  0  1  1
          0.67619018          1.00000000
  1  0  0  1  1
          0.09218762          1.00000000
  1  0  0  1  1
          0.03612011          1.00000000
  1  1  1  3  1
       1608.87436700          0.00193645
        381.42987006          0.01583901
        123.01926841          0.07535015
  1  1  1  3  1
         46.44678213          0.23949451
         19.00349476          0.44099403
          8.08899654          0.38019976
  1  1  1  1  1
          3.30137039          1.00000000
  1  1  1  1  1
          1.28776241          1.00000000
  1  1  1  1  1
          0.46546844          1.00000000
  1  2  2  3  1
         27.54673373          0.03063326
          7.46479407          0.15604066
          2.43275243          0.37003058
  1  2  2  1  1
          0.78187818          1.00000000
  1  2  2  1  1
          0.21977378          1.00000000
# MANGANESE   (14s,9p,5d) -> [8s,5p,3d]
MN Ahlrichs-VTZ
 16
  1  0  0  6  1
     323081.74475000         -0.00021859
      48425.98714700         -0.00169554
      11021.92842100         -0.00882905
       3122.86516830         -0.03599386
       1022.57022110         -0.11736441
        374.56667732         -0.28725943
  1  0  0  2  1
        148.65013953         -0.38025988
         60.37905678         -0.28945411
  1  0  0  1  1
         15.06128904          1.00000000
  1  0  0  1  1
          6.48276872          1.00000000
  1  0  0  1  1
          1.95351315          1.00000000
  1  0  0  1  1
          0.77017850          1.00000000
  1  0  0  1  1
          0.10192025          1.00000000
  1  0  0  1  1
          0.03861975          1.00000000
  1  1  1  3  1
       1777.87868240         -0.00193316
        421.57754180         -0.01584401
        136.11333999         -0.07556898
  1  1  1  3  1
         51.50677863         -0.23597435
         21.15322544         -0.43718792
          9.04771442         -0.38024193
  1  1  1  1  1
          3.73085636          1.00000000
  1  1  1  1  1
          1.47053315          1.00000000
  1  1  1  1  1
          0.54391841          1.00000000
  1  2  2  3  1
         35.42481665          0.02827075
          9.78132821          0.15071665
          3.26707129          0.38158552
  1  2  2  1  1
          1.10282719          1.00000000
  1  2  2  1  1
          0.33748087          1.00000000
# IRON        (14s,9p,5d) -> [8s,5p,3d]
FE Ahlrichs-VTZ
 16
  1  0  0  6  1
     350644.12607000          0.00021930
      52557.10447700          0.00170109
      11962.15760300          0.00885852
       3389.29879020          0.03611937
       1109.94098140          0.11780528
        406.75892124          0.28846626
  1  0  0  2  1
        161.55419196          0.38162019
         65.67521118          0.29212575
  1  0  0  1  1
         16.42571322          1.00000000
  1  0  0  1  1
          7.09302818          1.00000000
  1  0  0  1  1
          2.15942851          1.00000000
  1  0  0  1  1
          0.84771349          1.00000000
  1  0  0  1  1
          0.11079496          1.00000000
  1  0  0  1  1
          0.04131680          1.00000000
  1  1  1  3  1
       1953.60453190          0.00193816
        463.29314066          0.01591620
        149.67493331          0.07614915
  1  1  1  3  1
         56.70711203          0.23624430
         23.34102887          0.43978885
         10.01139316          0.38362586
  1  1  1  1  1
          4.15640196          1.00000000
  1  1  1  1  1
          1.63695826          1.00000000
  1  1  1  1  1
          0.60376297          1.00000000
  1  2  2  3  1
         38.96644239          0.02788407
         10.79897088          0.14863135
          3.61297484          0.36912959
  1  2  2  1  1
          1.21302858          1.00000000
  1  2  2  1  1
          0.36523978          1.00000000
# COBALT      (14s,9p,5d) -> [8s,5p,3d]
CO Ahlrichs-VTZ
 16
  1  0  0  6  1
     379411.77461000         -0.00021548
      56868.93439600         -0.00167144
      12943.60846200         -0.00870445
       3667.45326010         -0.03549617
       1201.14045910         -0.11581023
        440.33919478         -0.28374608
  1  0  0  2  1
        175.00035297         -0.38404173
         71.19098155         -0.29545416
  1  0  0  1  1
         17.84900792          1.00000000
  1  0  0  1  1
          7.72760703          1.00000000
  1  0  0  1  1
          2.37080608          1.00000000
  1  0  0  1  1
          0.92628272          1.00000000
  1  0  0  1  1
          0.11908621          1.00000000
  1  0  0  1  1
          0.04378239          1.00000000
  1  1  1  3  1
       2137.60077680         -0.00190579
        506.97292174         -0.01567839
        163.87524881         -0.07522963
  1  1  1  3  1
         62.15189899         -0.23369231
         25.63233144         -0.43693103
         11.02073903         -0.38210863
  1  1  1  1  1
          4.60243415          1.00000000
  1  1  1  1  1
          1.81028322          1.00000000
  1  1  1  1  1
          0.66569224          1.00000000
  1  2  2  3  1
         42.92437278          0.02975487
         11.94080960          0.15885714
          4.00372105          0.38970618
  1  2  2  1  1
          1.34125669          0.49652611
  1  2  2  1  1
          0.40011242          0.32719933
# NICKEL      (14s,9p,5d) -> [8s,5p,3d]
NI Ahlrichs-VTZ
 16
  1  0  0  6  1
     409347.86899000          0.00021252
      61355.83925500          0.00164849
      13964.85812800          0.00858533
       3956.85986990          0.03501533
       1296.02904740          0.11427673
        475.27876516          0.28015250
  1  0  0  2  1
        188.98838775          0.39246284
         76.92873698          0.30331302
  1  0  0  1  1
         19.33182873          1.00000000
  1  0  0  1  1
          8.38763997          1.00000000
  1  0  0  1  1
          2.58943429          1.00000000
  1  0  0  1  1
          1.00713747          1.00000000
  1  0  0  1  1
          0.12732573          1.00000000
  1  0  0  1  1
          0.04618981          1.00000000
  1  1  1  3  1
       2329.83843860         -0.00184142
        552.60693015         -0.01517369
        178.71193584         -0.07300467
  1  1  1  3  1
         67.84175081         -0.23224845
         28.02803353         -0.43596047
         12.07646920         -0.38213786
  1  1  1  1  1
          5.06941867          1.00000000
  1  1  1  1  1
          1.99118952          1.00000000
  1  1  1  1  1
          0.73006888          1.00000000
  1  2  2  3  1
         47.08830365          0.03152258
         13.14406723          0.16855326
          4.41585895          0.40930005
  1  2  2  1  1
          1.47699966          0.51501528
  1  2  2  1  1
          0.43728965          0.33962671
# COPPER      (14s,9p,5d) -> [8s,5p,3d]
CU Ahlrichs-VTZ
 16
  1  0  0  6  1
     441087.25070000         -0.00021814
      66112.02118700         -0.00169219
      15047.01142500         -0.00881371
       4263.42730840         -0.03595466
       1396.38157970         -0.11742970
        511.96055788         -0.28844267
  1  0  0  2  1
        203.45426948         -0.42678899
         82.79233703         -0.33044129
  1  0  0  1  1
         20.85428563          1.00000000
  1  0  0  1  1
          9.04106796          1.00000000
  1  0  0  1  1
          2.75181352          1.00000000
  1  0  0  1  1
          1.04348565          1.00000000
  1  0  0  1  1
          0.11172292          1.00000000
  1  0  0  1  1
          0.04104102          1.00000000
  1  1  1  3  1
       2530.09656710          0.00191379
        600.09792954          0.01579767
        194.08204479          0.07627126
  1  1  1  3  1
         73.67182138          0.23881452
         30.44736969          0.44980016
         13.12271488          0.39337682
  1  1  1  1  1
          5.52148400          1.00000000
  1  1  1  1  1
          2.14579221          1.00000000
  1  1  1  1  1
          0.76797489          1.00000000
  1  2  2  3  1
         47.31374370          0.03239976
         13.15468845          0.16822707
          4.36628857          0.38494430
  1  2  2  1  1
          1.41220659          1.00000000
  1  2  2  1  1
          0.38840713          1.00000000
# ZINC        (13s,9p,5d) -> [8s,5p,3d]
ZN Ahlrichs-VTZ
 16
  1  0  0  6  1
     472745.94164000         -0.00021701
      70858.09948400         -0.00168338
      16127.63973300         -0.00876775
       4569.76143200         -0.03576876
       1496.97653790         -0.11680699
        549.25646888         -0.28670653
  1  0  0  2  1
        218.59011012         -0.42684317
         89.06882333         -0.33251990
  1  0  0  1  1
         22.47575169          1.00000000
  1  0  0  1  1
          9.78369909          1.00000000
  1  0  0  1  1
          3.04760979          1.00000000
  1  0  0  1  1
          1.17513102          1.00000000
  1  0  0  1  1
          0.14336738          1.00000000
  1  0  0  1  1
          0.05076150          1.00000000
  1  1  1  3  1
       2738.99098490         -0.00187091
        649.72995198         -0.01546153
        210.29129074         -0.07475263
  1  1  1  3  1
         79.95436037         -0.23286955
         33.13129045         -0.44019360
         14.32639584         -0.38736391
  1  1  1  1  1
          6.06586466          1.00000000
  1  1  1  1  1
          2.37537196          1.00000000
  1  1  1  1  1
          0.86596317          1.00000000
  1  2  2  3  1
         56.07966480          0.02959823
         15.74825910          0.15879185
          5.30989277          0.37984178
  1  2  2  1  1
          1.77346525          1.00000000
  1  2  2  1  1
          0.51963234          1.00000000
# GALLIUM     (14s,11p,5p) -> [8s,6p,2d]
GA Ahlrichs-VTZ
 16
  1  0  0  6  1
     505335.63296000          0.00020974
      75742.78384400          0.00162697
      17239.46630500          0.00847412
       4884.93793620          0.03457115
       1600.54267360          0.11286666
        587.75692288          0.27673632
  1  0  0  2  1
        234.30109797          0.38518444
         95.61161803          0.30199565
  1  0  0  1  1
         24.16975022          1.00000000
  1  0  0  1  1
         10.57060341          1.00000000
  1  0  0  1  1
          3.38732467          1.00000000
  1  0  0  1  1
          1.33299479          1.00000000
  1  0  0  1  1
          0.19249282          1.00000000
  1  0  0  1  1
          0.07055192          1.00000000
  1  1  1  3  1
       2971.60789700          0.00159917
        705.19903787          0.01322248
        228.76520451          0.06379157
  1  1  1  3  1
         87.45639108          0.21775083
         36.54023197          0.41394919
         15.97457972          0.37538236
  1  1  1  1  1
          6.88706115          1.00000000
  1  1  1  2  1
          2.83185891          0.58552518
          1.10780100          0.33671543
  1  1  1  1  1
          0.23450859          1.00000000
  1  1  1  1  1
          0.06362688          1.00000000
  1  2  2  4  1
         65.34464181          0.02737834
         18.50057752          0.15105669
          6.31620584          0.37491843
          2.16388325          0.47510265
  1  2  2  1  1
          0.66688378          1.00000000
# GERMANIUM   (14s,11p,5d) -> [8s,6p,2d]
GE Ahlrichs-VTZ
 16
  1  0  0  6  1
     538981.20859000         -0.00021201
      80785.76895400         -0.00164460
      18387.32153900         -0.00856607
       5210.33695140         -0.03494637
       1707.48907720         -0.11406152
        627.54854073         -0.27936328
  1  0  0  2  1
        250.56696133         -0.39100943
        102.39333101         -0.30845092
  1  0  0  1  1
         25.92392334          1.00000000
  1  0  0  1  1
         11.38908119          1.00000000
  1  0  0  1  1
          3.74728089          1.00000000
  1  0  0  1  1
          1.50277333          1.00000000
  1  0  0  1  1
          0.24441034          1.00000000
  1  0  0  1  1
          0.09120539          1.00000000
  1  1  1  3  1
       3196.85712120          0.00150930
        758.78574707          0.01248854
        246.40186162          0.06025329
  1  1  1  3  1
         94.42908948          0.22636610
         39.60233327          0.43152372
         17.39402322          0.39496423
  1  1  1  1  1
          7.54688724          1.00000000
  1  1  1  2  1
          3.14979478          0.59773653
          1.26514858          0.34946773
  1  1  1  1  1
          0.30024032          1.00000000
  1  1  1  1  1
          0.08731919          1.00000000
  1  2  2  4  1
         74.77644790          0.02576022
         21.30776273          0.14540992
          7.34529660          0.37136368
          2.56568815          0.48003150
  1  2  2  1  1
          0.81988587          1.00000000
# ARSENIC     (14s,11p,5d) -> [8s,6p,2d]
AS Ahlrichs-VTZ
 16
  1  0  0  6  1
     573690.51140000         -0.00021423
      85988.18345500         -0.00166187
      19571.47427000         -0.00865618
       5546.03098040         -0.03531404
       1817.83619470         -0.11523139
        668.63675492         -0.28192647
  1  0  0  2  1
        267.38795948         -0.39133530
        109.41335253         -0.31052652
  1  0  0  1  1
         27.73776682          1.00000000
  1  0  0  1  1
         12.23852867          1.00000000
  1  0  0  1  1
          4.12659204          1.00000000
  1  0  0  1  1
          1.68350203          1.00000000
  1  0  0  1  1
          0.29954010          1.00000000
  1  0  0  1  1
          0.11318867          1.00000000
  1  1  1  3  1
       3425.09753580         -0.00147374
        813.08797098         -0.01220147
        264.28414769         -0.05885734
  1  1  1  3  1
        101.51263702         -0.20573149
         42.72235068         -0.39286344
         18.84511398         -0.36196398
  1  1  1  1  1
          8.22544553          1.00000000
  1  1  1  2  1
          3.47663635         -0.59644553
          1.42859183         -0.35023592
  1  1  1  1  1
          0.37149795          1.00000000
  1  1  1  1  1
          0.11244761          1.00000000
  1  2  2  4  1
         84.44262164          0.02452047
         24.18805173          0.14110224
          8.40378336          0.36874385
          2.98119494          0.48410290
  1  2  2  1  1
          0.97923124          1.00000000
# SELENIUM    (14s,11p,5d) -> [8s,6p,2d]
SE Ahlrichs-VTZ
 16
  1  0  0  6  1
     609461.56165000          0.00020666
      91349.72846900          0.00160315
      20791.84491000          0.00835041
       5892.00094020          0.03406659
       1931.57955230          0.11113200
        711.02173299          0.27160877
  1  0  0  2  1
        284.76563000          0.40353358
        116.67280336          0.32201538
  1  0  0  1  1
         29.61137985          1.00000000
  1  0  0  1  1
         13.11892160          1.00000000
  1  0  0  1  1
          4.52522746          1.00000000
  1  0  0  1  1
          1.87476785          1.00000000
  1  0  0  1  1
          0.35857738          1.00000000
  1  0  0  1  1
          0.13617744          1.00000000
  1  1  1  3  1
       3656.26581730          0.00147141
        868.08211673          0.01218823
        282.38879090          0.05878047
  1  1  1  3  1
        108.68249518          0.22385126
         45.88042837          0.42784038
         20.31363321          0.39569868
  1  1  1  1  1
          8.91386778          1.00000000
  1  1  1  2  1
          3.80294301          0.58895017
          1.59116635          0.34147004
  1  1  1  1  1
          0.44755579          1.00000000
  1  1  1  1  1
          0.13236319          1.00000000
  1  2  2  4  1
         94.49379399          0.02349045
         27.18650893          0.13749366
          9.50887420          0.36646763
          3.41754418          0.48752299
  1  2  2  1  1
          1.14814587          1.00000000
# BROMINE     (14s,11p,5d) -> [8s,6p,2d]
BR Ahlrichs-VTZ
 16
  1  0  0  6  1
     646312.41039000          0.00020844
      96873.03890000          0.00161696
      22048.96757400          0.00842249
       6248.35574820          0.03436088
       2048.74679770          0.11206361
        754.70826963          0.27360431
  1  0  0  2  1
        302.69689103          0.40561280
        124.16866898          0.32541501
  1  0  0  1  1
         31.54428107          1.00000000
  1  0  0  1  1
         14.02943598          1.00000000
  1  0  0  1  1
          4.94166792          1.00000000
  1  0  0  1  1
          2.07566180          1.00000000
  1  0  0  1  1
          0.42101474          1.00000000
  1  0  0  1  1
          0.16058114          1.00000000
  1  1  1  3  1
       3890.71817980          0.00151198
        923.85869493          0.01252930
        300.75537085          0.06040559
  1  1  1  3  1
        115.96376914          0.21102289
         49.09327108          0.40341288
         21.81039205          0.37386481
  1  1  1  1  1
          9.61901356          1.00000000
  1  1  1  2  1
          4.13415490          0.59931625
          1.75495989          0.33979400
  1  1  1  1  1
          0.52801532          1.00000000
  1  1  1  1  1
          0.15604838          1.00000000
  1  2  2  4  1
        104.85732970          0.02264931
         30.28008054          0.13456250
         10.65149713          0.36469675
          3.87058934          0.49046477
  1  2  2  1  1
          1.32429969          1.00000000
# KRYPTON     (14s,10p,5d) -> [8s,6p,2d]
KR Ahlrichs-VTZ
 16
  1  0  0  6  1
     684221.99700000          0.00020939
     102555.20043000          0.00162431
      23342.39377500          0.00846082
       6615.08355070          0.03451693
       2169.34386770          0.11254581
        799.69607957          0.27450859
  1  0  0  2  1
        321.18212105          0.33928755
        131.90111670          0.27359932
  1  0  0  1  1
         33.53647301          1.00000000
  1  0  0  1  1
         14.96988855          1.00000000
  1  0  0  1  1
          5.37553951          1.00000000
  1  0  0  1  1
          2.28584796          1.00000000
  1  0  0  1  1
          0.48690237          1.00000000
  1  0  0  1  1
          0.18641012          1.00000000
  1  1  1  3  1
       4128.69931990         -0.00156360
        980.47534405         -0.01296144
        319.40135820         -0.06246445
  1  1  1  3  1
        123.36181040         -0.21245677
         52.36231874         -0.40604316
         23.33542509         -0.37652208
  1  1  1  1  1
         10.34074505          1.00000000
  1  1  1  2  1
          4.46940780          0.55671931
          1.91778549          0.30604453
  1  1  1  1  1
          0.61259064          1.00000000
  1  1  1  1  1
          0.18236405          1.00000000
  1  2  2  4  1
        115.56236667          0.02194406
         33.47724715          0.13211460
         11.83479974          0.36327650
          4.34154927          0.49302860
  1  2  2  1  1
          1.50813570          1.00000000
# BASIS="Ahlrichs pVDZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#Elements                             References
#--------                             ----------
#H - Kr: R. Ahlrichs and coworkers, (mostly unpublished)
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (1p)
H  Ahlrichs-pVDZ
  3
  1  0  0  3  1
         13.01070100          0.01968216
          1.96225720          0.13796524
          0.44453796          0.47831935
  1  0  0  1  1
          0.12194962          1.00000000
  1  1  1  1  1
          0.80000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE Ahlrichs-pVDZ
  3
  1  0  0  3  1
         38.35493674          0.02381429
          5.76890815          0.15490907
          1.23994070          0.46998097
  1  0  0  1  1
          0.29757816          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# LITHIUM     (7s) -> [3s]
# LITHIUM     (1p)
LI Ahlrichs-pVDZ
  4
  1  0  0  5  1
        266.27785516          0.00649202
         40.06978345          0.04774786
          9.05599444          0.20268796
          2.45030091          0.48606575
          0.72209572          0.43626978
  1  0  0  1  1
          0.05281088          1.00000000
  1  0  0  1  1
          0.02096095          1.00000000
  1  1  1  1  1
          0.17000000          1.00000000
# BERYLLIUM   (7s) -> [3s]
# BERYLLIUM   (2p)
BE Ahlrichs-pVDZ
  5
  1  0  0  5  1
        515.18616125          0.00556153
         77.51103760          0.04119007
         17.55248169          0.17913378
          4.80289406          0.44736716
          1.45162143          0.42009582
  1  0  0  1  1
          0.13281634          1.00000000
  1  0  0  1  1
          0.04583737          1.00000000
  1  1  1  3  1
          3.63169171         -0.02903400
          0.71695694         -0.16877854
          0.19541933         -0.51403420
  1  1  1  1  1
          0.06051547          1.00000000
# BORON       (7s,4p) -> [3s,2p]
# BORON       (1d)
B  Ahlrichs-pVDZ
  6
  1  0  0  5  1
        839.31830086         -0.00559292
        126.26464843         -0.04156552
         28.62060076         -0.18299817
          7.87937227         -0.46540392
          2.40888572         -0.44173885
  1  0  0  1  1
          0.25105109          1.00000000
  1  0  0  1  1
          0.08364887          1.00000000
  1  1  1  3  1
          6.03322236         -0.03560367
          1.24991579         -0.19895776
          0.33871676         -0.50850203
  1  1  1  1  1
          0.09641563          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# CARBON      (7s,4p) -> [3s,2p]
# CARBON      (1d)
C  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       1238.40169380          0.00545688
        186.29004992          0.04063841
         42.25117635          0.18025594
         11.67655793          0.46315122
          3.59305065          0.44087173
  1  0  0  1  1
          0.40245147          1.00000000
  1  0  0  1  1
          0.13090183          1.00000000
  1  1  1  3  1
          9.46809706          0.03838787
          2.01035451          0.21117025
          0.54771005          0.51328172
  1  1  1  1  1
          0.15268614          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (7s,4p) -> [3s,2p]
# NITROGEN    (1d)
N  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       1712.84158530         -0.00539341
        257.64812677         -0.04022158
         58.45824585         -0.17931145
         16.19836791         -0.46376318
          5.00526008         -0.44171423
  1  0  0  1  1
          0.58731857          1.00000000
  1  0  0  1  1
          0.18764592          1.00000000
  1  1  1  3  1
         13.57147023         -0.04007240
          2.92573729         -0.21807045
          0.79927751         -0.51294466
  1  1  1  1  1
          0.21954348          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (7s,4p) -> [3s,2p]
# OXYGEN      (1d)
O  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       2266.17677850         -0.00534318
        340.87010191         -0.03989004
         77.36313517         -0.17853912
         21.47964494         -0.46427685
          6.65894331         -0.44309745
  1  0  0  1  1
          0.80975976          1.00000000
  1  0  0  1  1
          0.25530772          1.00000000
  1  1  1  3  1
         17.72150432          0.04339457
          3.86355054          0.23094121
          1.04809209          0.51375311
  1  1  1  1  1
          0.27641544          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# FLUORINE    (7s,4p) -> [3s,2p]
# FLUORINE    (1d)
F  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       2894.83259900         -0.00534083
        435.41939120         -0.03990426
         98.84332887         -0.17912768
         27.48519800         -0.46758091
          8.54054982         -0.44653131
  1  0  0  1  1
          1.06545780          1.00000000
  1  0  0  1  1
          0.33247347          1.00000000
  1  1  1  3  1
         22.69663392         -0.04521287
          4.98723393         -0.23754317
          1.34916140         -0.51287354
  1  1  1  1  1
          0.34829882          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NEON        (7s,4p) -> [3s,2p]
# NEON        (1d)
NE Ahlrichs-pVDZ
  6
  1  0  0  5  1
       3598.97366250         -0.00532593
        541.32073112         -0.03981742
        122.90450062         -0.17914358
         34.21661702         -0.46893583
         10.65058412         -0.44782538
  1  0  0  1  1
          1.35459540          1.00000000
  1  0  0  1  1
          0.41919363          1.00000000
  1  1  1  3  1
         28.42405379         -0.04603194
          6.28225110         -0.23993183
          1.69787151         -0.50871725
  1  1  1  1  1
          0.43300700          1.00000000
  1  2  2  1  1
          1.88800000          1.00000000
# SODIUM      (10s,5p) -> [4s,1p]
# SODIUM      (1p)
NA Ahlrichs-pVDZ
  6
  1  0  0  5  1
       4098.20039080         -0.00585359
        616.49374031         -0.04364716
        139.96644001         -0.19431466
         39.07344105         -0.48685066
         11.92984721         -0.41881705
  1  0  0  3  1
         20.65996603          0.08594969
          1.98388610         -0.56359144
          0.64836324         -0.51954009
  1  0  0  1  1
          0.05244397          1.00000000
  1  0  0  1  1
          0.02804816          1.00000000
  1  1  1  5  1
         75.40186202          0.01543536
         17.27481898          0.09973829
          5.18423474          0.31209594
          1.66012120          0.49295675
          0.51232529          0.32420398
  1  1  1  1  1
          0.05200000          1.00000000
# MAGNESIUM   (10s,5p) -> [4s,1p]
# MAGNESIUM   (1p)
MG Ahlrichs-pVDZ
  6
  1  0  0  5  1
       4953.83391960         -0.00577790
        745.18044154         -0.04312476
        169.21604972         -0.19268217
         47.30067202         -0.48641439
         14.46133697         -0.42550894
  1  0  0  3  1
         24.76817479          0.08795697
          2.49409453         -0.55165058
          0.87807585         -0.53443295
  1  0  0  1  1
          0.08721278          1.00000000
  1  0  0  1  1
          0.03359929          1.00000000
  1  1  1  5  1
         98.05301049         -0.01448056
         22.58693228         -0.09549575
          6.83915098         -0.30787673
          2.23328438         -0.49936293
          0.71606599         -0.31503476
  1  1  1  1  1
          0.18914796          1.00000000
# ALUMINUM    (10s,7p) -> [4s,3p]
# ALUMINUM    (1d)
AL Ahlrichs-pVDZ
  8
  1  0  0  5  1
       5887.57270300          0.00134833
        885.61225996          0.01007158
        201.13604899          0.04513245
         56.28497467          0.11461268
         17.22955124          0.10159609
  1  0  0  3  1
         29.34024992          0.06934745
          3.04396304         -0.42528118
          1.12855395         -0.41449832
  1  0  0  1  1
          0.14234175          1.00000000
  1  0  0  1  1
          0.05440019          1.00000000
  1  1  1  5  1
        145.11918809          0.00639634
         33.71789483          0.04418936
         10.36986308          0.15581576
          3.51356160          0.28635287
          1.19800503          0.22921423
  1  1  1  1  1
          0.26583006          1.00000000
  1  1  1  1  1
          0.07100336          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# SILICON     (10s,7p) -> [4s,3p]
# SILICON     (1d)
SI Ahlrichs-pVDZ
  8
  1  0  0  5  1
       6903.71186860          0.00133740
       1038.43464190          0.00999665
        235.87581480          0.04491017
         66.06938517          0.11463639
         20.24794576          0.10280064
  1  0  0  3  1
         34.35348173          0.07083729
          3.63707882         -0.43028836
          1.40020486         -0.41382775
  1  0  0  1  1
          0.20484415          1.00000000
  1  0  0  1  1
          0.07799410          1.00000000
  1  1  1  5  1
        179.83907373          0.00619167
         41.90725885          0.04339943
         12.95529437          0.15632019
          4.43832674          0.29419997
          1.54622479          0.23536824
  1  1  1  1  1
          0.35607612          1.00000000
  1  1  1  1  1
          0.10008514          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
# PHOSPHORUS  (10s,7p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  Ahlrichs-pVDZ
  8
  1  0  0  5  1
       8002.47951060          0.00575035
       1203.68135900          0.04300763
        273.44227031          0.19363986
         76.65554152          0.49651693
         23.51692744          0.44983262
  1  0  0  3  1
         39.79168344          0.09518813
          4.27703433         -0.57649840
          1.69402569         -0.54239584
  1  0  0  1  1
          0.27567675          1.00000000
  1  0  0  1  1
          0.10495590          1.00000000
  1  1  1  5  1
        219.50755823          0.00921006
         51.27415503          0.06540977
         15.92159589          0.24033730
          5.50699135          0.46318322
          1.95377194          0.37392563
  1  1  1  1  1
          0.47803398          1.00000000
  1  1  1  1  1
          0.13657953          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# SULFUR      (10s,7p) -> [4s,3p]
# SULFUR      (1d)
S  Ahlrichs-pVDZ
  8
  1  0  0  5  1
       9184.93030100         -0.00222944
       1381.51055030         -0.01668303
        313.87147580         -0.07526244
         88.05387062         -0.19376827
         27.03991491         -0.17718021
  1  0  0  3  1
         45.64873130         -0.10736063
          4.96645223          0.65066293
          2.01162420          0.59712155
  1  0  0  1  1
          0.35661077          1.00000000
  1  0  0  1  1
          0.13507221          1.00000000
  1  1  1  5  1
        261.98233439         -0.00927299
         61.30689474         -0.06654767
         19.10372989         -0.24828596
          6.65677204         -0.48703847
          2.39596352         -0.39337850
  1  1  1  1  1
          0.61776162          1.00000000
  1  1  1  1  1
          0.16993377          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE    (10s,7p) -> [4s,3p]
# CHLORINE    (1d)
CL Ahlrichs-pVDZ
  8
  1  0  0  5  1
      10449.82756600          0.00197084
       1571.73652210          0.01475473
        357.12065523          0.06667911
        100.25185935          0.17228924
         30.81272755          0.15883786
  1  0  0  3  1
         51.92378943         -0.10009299
          5.70457610          0.60841753
          2.35083768          0.54352153
  1  0  0  1  1
          0.44605125          1.00000000
  1  0  0  1  1
          0.16848856          1.00000000
  1  1  1  5  1
        307.66790569         -0.00878015
         72.10201551         -0.06356336
         22.53268026         -0.24016428
          7.89917654         -0.47798867
          2.87672683         -0.38515850
  1  1  1  1  1
          0.77459364          1.00000000
  1  1  1  1  1
          0.21037700          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# ARGON       (10s,7p) -> [4s,3p]
# ARGON       (1d)
AR Ahlrichs-pVDZ
  8
  1  0  0  5  1
      11797.11976500          0.00202145
       1774.35227530          0.01513985
        403.18875733          0.06852540
        113.24933999          0.17762929
         34.83529819          0.16496495
  1  0  0  3  1
         58.61477504         -0.10343394
          6.49220451          0.63133366
          2.71170144          0.54887572
  1  0  0  1  1
          0.54412975          1.00000000
  1  0  0  1  1
          0.20517411          1.00000000
  1  1  1  5  1
        356.28707256         -0.00873218
         83.59313287         -0.06368032
         26.18670403         -0.24311907
          9.22572759         -0.48956070
          3.39227550         -0.39229190
  1  1  1  1  1
          0.94740534          1.00000000
  1  1  1  1  1
          0.25659135          1.00000000
  1  2  2  1  1
          0.96900000          1.00000000
# POTASSIUM   (14s,8p) -> [5s,2p]
# POTASSIUM   (1p)
K  Ahlrichs-pVDZ
  8
  1  0  0  6  1
      31478.74676400          0.00398387
       4726.88760660          0.03050176
       1075.43453530          0.15073753
        303.39811023          0.51912940
         98.32711283          1.03669570
         33.63622218          0.76398963
  1  0  0  3  1
         65.63920996         -0.28242617
          7.31625922          1.69149359
          2.89025801          1.29653320
  1  0  0  3  1
          4.54597490         -0.00763436
          0.70404124          0.02563572
          0.28266889          0.01660686
  1  0  0  1  1
          0.02905816          1.00000000
  1  0  0  1  1
          0.01211164          1.00000000
  1  1  1  5  1
        361.22492154          0.02090648
         84.67022217          0.15043642
         26.46908824          0.55440061
          9.26580776          1.04090100
          3.34233883          0.67825341
  1  1  1  3  1
          1.51008761          0.75248191
          0.56568375          1.37085850
          0.20817008          0.66047633
  1  1  1  1  1
          0.04173700          1.00000000
# CALCIUM     (14s,8p) -> [5s,2p]
# CALCIUM     (1p)
CA Ahlrichs-pVDZ
  8
  1  0  0  6  1
      35138.71392900          0.00394825
       5276.41113480          0.03023424
       1200.46925890          0.14952020
        338.71810542          0.51597346
        109.85385922          1.03395103
         37.60888030          0.76937934
  1  0  0  3  1
         73.10797755         -0.28268525
          8.24077057          1.67960921
          3.29598130          1.28037660
  1  0  0  3  1
          5.23418009         -0.00768686
          0.84187221          0.02538238
          0.36510294          0.01651217
  1  0  0  1  1
          0.05122240          1.00000000
  1  0  0  1  1
          0.01982511          1.00000000
  1  1  1  5  1
        413.11313893          0.02032714
         96.93578622          0.14730276
         30.37215466          0.54887167
         10.68477683          1.04406598
          3.88212583          0.68653491
  1  1  1  3  1
          1.79930163          0.75410247
          0.69189057          1.34092966
          0.26364024          0.56391989
  1  1  1  1  1
          0.07497900          1.00000000
# SCANDIUM    (14s,8p,5d) -> [5s,2p,2d]
# SCANDIUM    (1p)
SC Ahlrichs-pVDZ
 10
  1  0  0  6  1
      38956.08180400          0.00392932
       5849.57336370          0.03009322
       1330.88131540          0.14890371
        375.55534165          0.51464283
        121.87261370          1.03377081
         41.76024373          0.77436852
  1  0  0  3  1
         81.06063395         -0.28318552
          9.20598240          1.67708070
          3.70632157          1.25947337
  1  0  0  3  1
          5.98889100         -0.00778214
          0.97363432          0.02549969
          0.42041019          0.01619156
  1  0  0  1  1
          0.05944055          1.00000000
  1  0  0  1  1
          0.02289781          1.00000000
  1  1  1  5  1
        466.31481262          0.01998430
        109.51217097          0.14561043
         34.37592183          0.54687466
         12.14209696          1.04790060
          4.43367677          0.68894890
  1  1  1  3  1
          2.09712919          0.75619215
          0.80977607          1.31782122
          0.30834047          0.54312268
  1  2  2  4  1
         19.24033493          0.02703908
          5.11789959          0.13803685
          1.65542788          0.34869086
          0.54016356          0.48594186
  1  2  2  1  1
          0.16211215          1.00000000
  1  1  1  1  1
          0.08974800          1.00000000
# TITANIUM    (14s,8p,5d) -> [5s,2p,2d]
# TITANIUM    (1p)
TI Ahlrichs-pVDZ
 10
  1  0  0  6  1
      42961.51218500          0.00391276
       6450.97591690          0.02996982
       1467.72109150          0.14836353
        414.20997355          0.51347285
        134.48715840          1.03353655
         46.12220980          0.77854234
  1  0  0  3  1
         89.44776254         -0.28385401
         10.22334606          1.67727853
          4.13537743          1.24119285
  1  0  0  3  1
          6.78961815         -0.00784000
          1.11067307          0.02549549
          0.47565976          0.01606117
  1  0  0  1  1
          0.06598696          1.00000000
  1  0  0  1  1
          0.02521034          1.00000000
  1  1  1  5  1
        522.03684782          0.01975418
        122.68649489          0.14460678
         38.57290361          0.54669004
         13.67216932          1.05316475
          5.01185294          0.69111213
  1  1  1  3  1
          2.41319283          0.75803437
          0.93252270          1.30362414
          0.35429058          0.53638653
  1  2  2  4  1
         23.46512596          0.02653638
          6.33325938          0.13796454
          2.07664899          0.35312644
          0.69027362          0.48647124
  1  2  2  1  1
          0.21088739          0.33026314
  1  1  1  1  1
          0.10156100          1.00000000
# VANADIUM    (14s,8p,5d) -> [5s,2p,2d]
# VANADIUM    (1p)
V  Ahlrichs-pVDZ
 10
  1  0  0  6  1
      47160.37606000          0.00144987
       7081.41108710          0.01110644
       1611.16212230          0.05500542
        454.72940551          0.19060253
        147.71321208          0.38435023
         50.69953895          0.29095547
  1  0  0  3  1
         98.26249267         -0.10942338
         11.29429310          0.64539490
          4.58533601          0.47117881
  1  0  0  3  1
          7.63596896         -0.22454949
          1.25398367          0.72594853
          0.53271935          0.45560583
  1  0  0  1  1
          0.07224624          1.00000000
  1  0  0  1  1
          0.02735809          1.00000000
  1  1  1  5  1
        580.55044988          0.00973151
        136.52341127          0.07153124
         42.98395882          0.27197688
         15.28279876          0.52618989
          5.62024952          0.34452533
  1  1  1  3  1
          2.74853864          0.34040396
          1.06185501          0.57983996
          0.40235519          0.23911643
  1  2  2  4  1
         27.35843402          0.02664193
          7.45406043          0.13995312
          2.46339178          0.35751067
          0.82480925          0.48488354
  1  2  2  1  1
          0.25257905          0.32332845
  1  1  1  1  1
          0.11124800          1.00000000
# CHROMIUM    (14s,8p,5d) -> [5s,2p,2d]
# CHROMIUM    (1p)
CR Ahlrichs-pVDZ
 10
  1  0  0  6  1
      51528.08634900          0.00144058
       7737.21034870          0.01103620
       1760.37484700          0.05467665
        496.87706544          0.18965038
        161.46520598          0.38295413
         55.46635227          0.29090051
  1  0  0  3  1
        107.54732999         -0.10932281
         12.40867190          0.64472599
          5.04236288          0.46262713
  1  0  0  3  1
          8.54616402         -0.22711013
          1.39004412          0.73301528
          0.56066603          0.44225565
  1  0  0  1  1
          0.07148371          1.00000000
  1  0  0  1  1
          0.02825069          1.00000000
  1  1  1  5  1
        640.48536096          0.00961267
        150.69711194          0.07088983
         47.50375530          0.27065259
         16.93412017          0.52437343
          6.24096806          0.34107995
  1  1  1  3  1
          3.08854632          0.33973987
          1.17910478          0.57272063
          0.43369774          0.24582728
  1  2  2  4  1
         27.55947943          0.03061249
          7.46870203          0.15593271
          2.43459036          0.36984421
          0.78244755          0.47071118
  1  2  2  1  1
          0.21995774          0.33941650
  1  1  1  1  1
          0.12067500          1.00000000
# MANGANESE   (14s,8p,5d) -> [5s,2p,2d]
# MANGANESE   (1p)
MN Ahlrichs-pVDZ
 10
  1  0  0  6  1
      56137.00903700          0.00143213
       8429.20639430          0.01097251
       1917.82772330          0.05438247
        541.36230198          0.18884335
        176.00069142          0.38198025
         60.50047701          0.29156773
  1  0  0  3  1
        117.17282882         -0.10933661
         13.59697337          0.64305039
          5.54839963          0.45848971
  1  0  0  3  1
          9.46628535         -0.22538977
          1.55950061          0.72307759
          0.65230206          0.45300722
  1  0  0  1  1
          0.08400373          1.00000000
  1  0  0  1  1
          0.03125610          1.00000000
  1  1  1  5  1
        706.00497535          0.00950555
        166.19728820          0.07035627
         52.45206191          0.27005557
         18.74693286          0.52574345
          6.92829916          0.34254033
  1  1  1  3  1
          3.47722049          0.33994074
          1.34069064          0.57203836
          0.50498803          0.23847606
  1  2  2  4  1
         35.42326493          0.02698530
          9.78142215          0.14383459
          3.26734888          0.36418958
          1.10264722          0.48152671
  1  2  2  1  1
          0.33743206          0.31458754
  1  1  1  1  1
          0.12765000          1.00000000
# IRON        (14s,8p,5d) -> [5s,2p,2d]
# IRON        (1p)
FE Ahlrichs-pVDZ
 10
  1  0  0  6  1
      60923.64064300          0.00143023
       9147.88939820          0.01095879
       2081.35059270          0.05433255
        587.55977067          0.18884995
        191.09043990          0.38253070
         65.73273011          0.29308336
  1  0  0  3  1
        127.25891928         -0.10964565
         14.83091301          0.64387631
          6.06533074          0.45472347
  1  0  0  3  1
         10.44994371         -0.22539640
          1.72452280          0.72164398
          0.71772177          0.44985493
  1  0  0  1  1
          0.09144983          1.00000000
  1  0  0  1  1
          0.03370669          1.00000000
  1  1  1  5  1
        773.43750995          0.00943257
        182.15149714          0.07002962
         57.54727276          0.26993652
         20.61498894          0.52700011
          7.63485579          0.34284148
  1  1  1  3  1
          3.87193280          0.33974403
          1.49247241          0.56842594
          0.56061285          0.23649366
  1  2  2  4  1
         38.96813342          0.02787966
         10.80006708          0.14858320
          3.61364580          0.36905479
          1.21299679          0.47745101
  1  2  2  1  1
          0.36524393          0.31418142
  1  1  1  1  1
          0.13491500          1.00000000
# COBALT      (14s,8p,5d) -> [5s,2p,2d]
# COBALT      (1p)
CO Ahlrichs-pVDZ
 10
  1  0  0  6  1
      65902.20825700          0.00142846
       9895.38960270          0.01094607
       2251.43057890          0.05428595
        635.61097084          0.18885179
        206.78820681          0.38301635
         71.17924297          0.29443551
  1  0  0  3  1
        137.77268040         -0.10990222
         16.11807924          0.64455537
          6.60303277          0.45116788
  1  0  0  3  1
         11.47991579         -0.22593847
          1.89564263          0.72231409
          0.78466232          0.44903812
  1  0  0  1  1
          0.09842577          1.00000000
  1  0  0  1  1
          0.03594574          1.00000000
  1  1  1  5  1
        843.64358575          0.00938661
        198.76386994          0.06988021
         62.85496310          0.27037070
         22.56284228          0.52904787
          8.37132091          0.34357030
  1  1  1  3  1
          4.28587198          0.34027999
          1.65080418          0.56693392
          0.61834231          0.23617980
  1  2  2  4  1
         42.92786761          0.02848779
         11.94253305          0.15206951
          4.00464957          0.37310914
          1.34131938          0.47549838
  1  2  2  1  1
          0.40015010          0.31346831
  1  1  1  1  1
          0.14130800          1.00000000
# NICKEL      (14s,8p,5d) -> [5s,2p,2d]
# NICKEL      (1p)
NI Ahlrichs-pVDZ
 10
  1  0  0  6  1
      71074.80321100          0.00142604
      10672.02094100          0.01092824
       2428.13890070          0.05421263
        685.53595148          0.18874769
        223.10072863          0.38324617
         76.84201404          0.29550637
  1  0  0  3  1
        148.71122016         -0.11014443
         17.45915499          0.64521427
          7.16252807          0.44797838
  1  0  0  3  1
         12.55613713         -0.22645403
          2.07357405          0.72320959
          0.85382641          0.44868026
  1  0  0  1  1
          0.10536766          1.00000000
  1  0  0  1  1
          0.03813409          1.00000000
  1  1  1  5  1
        916.73608662          0.00934396
        216.06139913          0.06973737
         68.38391482          0.27073495
         24.59384395          0.53078302
          9.13929602          0.34410229
  1  1  1  3  1
          4.71933717          0.34076082
          1.81618492          0.56580170
          0.67840751          0.23616717
  1  2  2  4  1
         47.09383211          0.02898232
         13.14646397          0.15494996
          4.41705489          0.37633115
          1.47715651          0.47365096
  1  2  2  1  1
          0.43735922          0.31247838
  1  1  1  1  1
          0.14658800          1.00000000
# COPPER      (14s,8p,5d) -> [5s,2p,2d]
# COPPER      (1p)
CU Ahlrichs-pVDZ
 10
  1  0  0  6  1
      76381.34805600          0.00143361
      11468.77749900          0.01098675
       2609.42464950          0.05451365
        736.75033098          0.18990128
        239.82419958          0.38581959
         82.65682925          0.29790607
  1  0  0  3  1
        160.13544196         -0.11146779
         18.83417770          0.65349301
          7.71765957          0.44770534
  1  0  0  3  1
         13.71084672         -0.22870911
          2.23498957          0.73464423
          0.87818360          0.43273071
  1  0  0  1  1
          0.08718746          1.00000000
  1  0  0  1  1
          0.03296911          1.00000000
  1  1  1  5  1
        991.24075782          0.00938785
        233.69376116          0.07020828
         74.02093093          0.27323522
         26.66496745          0.53580793
          9.91920875          0.34575795
  1  1  1  3  1
          5.15195539          0.34229108
          1.96382058          0.56456592
          0.71560097          0.24078584
  1  2  2  4  1
         47.33504959          0.03237555
         13.16166608          0.16810219
          4.36937772          0.38477708
          1.41329251          0.46147880
  1  2  2  1  1
          0.38878001          0.32388873
  1  1  1  1  1
          0.15506500          1.00000000
# ZINC        (13s,8p,5d) -> [5s,2p,2d]
# ZINC        (1p)
ZN Ahlrichs-pVDZ
 10
  1  0  0  6  1
      82000.71162900          0.00142108
      12312.47177700          0.01089150
       2801.39441930          0.05405719
        790.99424302          0.18847464
        257.56551079          0.38346549
         88.81493340          0.29723794
  1  0  0  3  1
        171.86353716         -0.11051850
         20.30253478          0.64607717
          8.34641231          0.44220117
  1  0  0  3  1
         14.84753694         -0.22705309
          2.44950295          0.72433218
          0.99845822          0.44836496
  1  0  0  1  1
          0.11891308          1.00000000
  1  0  0  1  1
          0.04229743          1.00000000
  1  1  1  5  1
       1071.51853720          0.00927678
        252.69712152          0.06954115
         80.10082913          0.27156773
         28.90339317          0.53401356
         10.76889988          0.34501323
  1  1  1  3  1
          5.64462125          0.34129600
          2.16782913          0.56390522
          0.80540898          0.23676110
  1  2  2  4  1
         56.08893919          0.02958887
         15.75190892          0.15872571
          5.31158124          0.37976229
          1.77379049          0.46898959
  1  2  2  1  1
          0.51975584          0.30907149
  1  1  1  1  1
          0.16245500          1.00000000
# GALLIUM     (14s,10p,5d) -> [5s,4p,2d]
# GALLIUM     (1d)
GA Ahlrichs-pVDZ
 12
  1  0  0  6  1
      87842.12629600          0.00142716
      13189.49640200          0.01093889
       3000.94821410          0.05430820
        847.38425966          0.18951056
        276.00980642          0.38615186
         95.21667207          0.30051083
  1  0  0  3  1
        184.00703968         -0.11124462
         21.82705143          0.64831323
          9.00269638          0.44358384
  1  0  0  3  1
         16.03317694         -0.23014300
          2.67077249          0.72946862
          1.12528342          0.46214977
  1  0  0  1  1
          0.15967609          1.00000000
  1  0  0  1  1
          0.05764304          1.00000000
  1  1  1  5  1
       1167.26658440          0.00909740
        275.38062789          0.06845627
         87.37507307          0.26922294
         31.59725467          0.53507898
         11.82412280          0.35279063
  1  1  1  3  1
          6.28818451          0.33938245
          2.51998532          0.56871948
          1.01697263          0.27717695
  1  1  1  1  1
          0.24748374          1.00000000
  1  1  1  1  1
          0.06668529          1.00000000
  1  2  2  4  1
         65.35423767          0.02737015
         18.50465675          0.15099464
          6.31796206          0.37485329
          2.16413894          0.47510607
  1  2  2  1  1
          0.66693093          0.29843287
  1  2  2  1  1
          0.20700000          1.00000000
# GERMANIUM   (14s,10p,5d) -> [5s,4p,2d]
# GERMANIUM   (1d)
GE Ahlrichs-pVDZ
 12
  1  0  0  6  1
      93889.83664200          0.00142340
      14097.49752800          0.01091080
       3207.54773090          0.05418371
        905.76727269          0.18922820
        295.11014693          0.38612847
        101.84713141          0.30164051
  1  0  0  3  1
        196.56719662         -0.11118771
         23.40529252          0.64616007
          9.68391167          0.44188905
  1  0  0  3  1
         17.26973654         -0.23027421
          2.89646222          0.73017169
          1.25536214          0.46197222
  1  0  0  1  1
          0.20213081          1.00000000
  1  0  0  1  1
          0.07386791          1.00000000
  1  1  1  5  1
       1259.20859950          0.00901155
        297.15626382          0.06798684
         94.35338752          0.26853856
         34.17632968          0.53659649
         12.81613962          0.35633515
  1  1  1  3  1
          6.84710298          0.33900693
          2.77173639          0.56809365
          1.14584182          0.27246540
  1  1  1  1  1
          0.30679632          1.00000000
  1  1  1  1  1
          0.08928364          1.00000000
  1  2  2  4  1
         74.78216818          0.02575586
         21.31084976          0.14536816
          7.34647924          0.37134210
          2.56562714          0.48002998
  1  2  2  1  1
          0.81981773          0.28978791
  1  2  2  1  1
          0.24600000          1.00000000
# ARSENIC     (14s,10p,5d) -> [5s,4p,2d]
# ARSENIC     (1d)
AS Ahlrichs-pVDZ
 12
  1  0  0  6  1
     100146.52554000          0.00142583
      15036.86171100          0.01093018
       3421.29028330          0.05429417
        966.16965717          0.18976078
        314.87394026          0.38775195
        108.70823790          0.30402812
  1  0  0  3  1
        209.54238950         -0.11162094
         25.03822114          0.64697608
         10.39096434          0.44223609
  1  0  0  3  1
         18.55509009         -0.22994191
          3.12812174          0.73319108
          1.38848851          0.45533654
  1  0  0  1  1
          0.24714362          1.00000000
  1  0  0  1  1
          0.09142943          1.00000000
  1  1  1  5  1
       1355.64435070          0.00891825
        319.99929270          0.06745475
        101.67734092          0.26759772
         36.88632384          0.53776845
         13.86111591          0.35992570
  1  1  1  3  1
          7.42606669          0.34036850
          3.03162472          0.57030149
          1.27830783          0.26606170
  1  1  1  1  1
          0.37568503          1.00000000
  1  1  1  1  1
          0.11394805          1.00000000
  1  2  2  4  1
         84.44551454          0.02451840
         24.19041610          0.14107455
          8.40450151          0.36875229
          2.98089707          0.48409561
  1  2  2  1  1
          0.97909243          0.28250269
  1  2  2  1  1
          0.29300000          1.00000000
# SELENIUM    (14s,10p,5d) -> [5s,4p,2d]
# SELENIUM    (1d)
SE Ahlrichs-pVDZ
 12
  1  0  0  6  1
     106612.20027000          0.00142749
      16007.60470100          0.01094353
       3642.16997070          0.05437417
       1028.59129930          0.19018093
        335.30298888          0.38913022
        115.80129154          0.30620207
  1  0  0  3  1
        222.93325020         -0.11198808
         26.72625793          0.64752124
         11.12450192          0.44241977
  1  0  0  3  1
         19.88852006         -0.22857228
          3.36684738          0.73591360
          1.52492778          0.44330200
  1  0  0  1  1
          0.29630038          1.00000000
  1  0  0  1  1
          0.11009289          1.00000000
  1  1  1  5  1
       1455.90681200          0.00882036
        343.75101831          0.06687585
        109.29554964          0.26640578
         39.70771102          0.53834928
         14.95018523          0.36303282
  1  1  1  3  1
          8.02089621          0.34153807
          3.29346498          0.57257907
          1.40586024          0.25549813
  1  1  1  1  1
          0.45076123          1.00000000
  1  1  1  1  1
          0.13353413          1.00000000
  1  2  2  4  1
         94.49402404          0.02349010
         27.18818526          0.13747736
          9.50915674          0.36649929
          3.41705169          0.48750990
  1  2  2  1  1
          1.14795901          0.27657943
  1  2  2  1  1
          0.33800000          1.00000000
# BROMINE     (14s,10p,5d) -> [5s,4p,2d]
# BROMINE     (1d)
BR Ahlrichs-pVDZ
 12
  1  0  0  6  1
     113286.38776000          0.00142830
      17009.62630300          0.01095042
       3870.18425670          0.05442101
       1093.03572270          0.19047908
        356.39721797          0.39024643
        123.12539643          0.30814433
  1  0  0  3  1
        236.74084007         -0.11228066
         28.46866107          0.64775962
         11.88344372          0.44235576
  1  0  0  3  1
         21.26963331         -0.22642576
          3.61292268          0.73823712
          1.66266490          0.42683869
  1  0  0  1  1
          0.34823793          1.00000000
  1  0  0  1  1
          0.13019031          1.00000000
  1  1  1  5  1
       1560.28018810          0.00871667
        368.47859205          0.06624364
        117.22978849          0.26495610
         42.64890925          0.53839161
         16.08722510          0.36579388
  1  1  1  3  1
          8.63528101          0.34248787
          3.56136655          0.57500678
          1.52926266          0.24330394
  1  1  1  1  1
          0.53064295          1.00000000
  1  1  1  1  1
          0.15702759          1.00000000
  1  2  2  4  1
        104.85518642          0.02265015
         30.28114369          0.13455483
         10.65139427          0.36474455
          3.86994562          0.49044587
  1  2  2  1  1
          1.32408768          0.27137289
  1  2  2  1  1
          0.38900000          1.00000000
# KRYPTON     (14s,10p,5d) -> [5s,4p,2d]
# KRYPTON     (1d)
KR Ahlrichs-pVDZ
 12
  1  0  0  6  1
     120165.64875000          0.00142942
      18042.50016900          0.01095960
       4105.18003880          0.05447965
       1159.44472480          0.19081239
        378.13810346          0.39140446
        130.67610045          0.31007347
  1  0  0  3  1
        250.96373353         -0.11258604
         30.26593038          0.64816323
         12.66811076          0.44240239
  1  0  0  3  1
         22.69794010         -0.22391965
          3.86730174          0.74060953
          1.80137067          0.40803658
  1  0  0  1  1
          0.40308639          1.00000000
  1  0  0  1  1
          0.15170528          1.00000000
  1  1  1  5  1
       1668.57366230          0.00862150
        394.13862798          0.06566551
        125.46644854          0.26366577
         45.70499273          0.53867659
         17.27013323          0.36865168
  1  1  1  3  1
          9.26994878          0.34346189
          3.83646177          0.57784776
          1.64671633          0.23075615
  1  1  1  1  1
          0.61479686          1.00000000
  1  1  1  1  1
          0.18319467          1.00000000
  1  2  2  4  1
        115.55868603          0.02194549
         33.47798586          0.13211213
         11.83445021          0.36333307
          4.34082549          0.49300484
  1  2  2  1  1
          1.50792732          0.26676859
  1  2  2  1  1
          0.44300000          1.00000000
# BASIS="Ahlrichs TZV"
#Elements                             References
#--------                             ----------
#Li - Kr: A. Schafer, C. Huber and R. Ahlrichs, J. Chem. Phys. 100, 5829 (1994).
#H,He added from VTZ (Joost)
#
# HYDROGEN    (5s) -> [3s]
H  Ahlrichs-TZV
  3
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
# HELIUM      (5s) -> [3s]
HE Ahlrichs-TZV
  3
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
# LITHIUM     (11s) -> [5s]
LI Ahlrichs-TZV
  5
  1  0  0  6  1
       6269.26280100          0.00020541
        940.31612431          0.00159166
        214.22107528          0.00828698
         60.75984018          0.03385637
         19.91515203          0.11103226
          7.31715098          0.27449383
  1  0  0  2  1
          2.97246742          0.23792456
          1.26398523          0.30765412
  1  0  0  1  1
          0.51427490          1.00000000
  1  0  0  1  1
          0.07703089          1.00000000
  1  0  0  1  1
          0.02893890          1.00000000
# BERYLLIUM   (11s) -> [5s]
BE Ahlrichs-TZV
  5
  1  0  0  6  1
       4700.23656260          0.00023584
        704.82845622          0.00182438
        160.43110478          0.00939661
         45.42534734          0.03690892
         14.79833412          0.10897561
          5.35124525          0.21694285
  1  0  0  2  1
          2.15420448          0.44695409
          0.93363744          0.20866986
  1  0  0  1  1
          0.18791433          1.00000000
  1  0  0  1  1
          0.74648268          1.00000000
  1  0  0  1  1
          0.03265048          1.00000000
# BORON       (11s,6p) -> [5s,3p]
B  Ahlrichs-TZV
  8
  1  0  0  6  1
       8564.86606870          0.00022837
       1284.15162630          0.00176826
        292.27871604          0.00914071
         82.77546918          0.03634264
         27.01793927          0.11063458
          9.81496197          0.23367344
  1  0  0  2  1
          3.93185591          0.41818778
          1.65955997          0.22325474
  1  0  0  1  1
          0.35762965          1.00000000
  1  0  0  1  1
          0.14246277          1.00000000
  1  0  0  1  1
          0.06056059          1.00000000
  1  1  1  4  1
         22.45387580          0.00502656
          5.10450583          0.03280174
          1.49860813          0.13151231
          0.50927831          0.33197168
  1  1  1  1  1
          0.18147078          1.00000000
  1  1  1  1  1
          0.06462189          1.00000000
# CARBON      (11s,6p) -> [5s,3p]
C  Ahlrichs-TZV
  8
  1  0  0  6  1
      13575.34968200          0.00022246
       2035.23336800          0.00172327
        463.22562359          0.00892557
        131.20019598          0.03572798
         42.85301589          0.11076260
         15.58418577          0.24295628
  1  0  0  2  1
          6.20671385          0.41440263
          2.57648965          0.23744969
  1  0  0  1  1
          0.57696339          1.00000000
  1  0  0  1  1
          0.22972831          1.00000000
  1  0  0  1  1
          0.09516444          1.00000000
  1  1  1  4  1
         34.69723224          0.00533337
          7.95826228          0.03586411
          2.37808269          0.14215873
          0.81433208          0.34270472
  1  1  1  1  1
          0.28887547          1.00000000
  1  1  1  1  1
          0.10056824          1.00000000
# NITROGEN    (11s,6p) -> [5s,3p]
N  Ahlrichs-TZV
  8
  1  0  0  6  1
      19730.80064700          0.00021888
       2957.89587450          0.00169607
        673.22133595          0.00879546
        190.68249494          0.03535938
         62.29544190          0.11095789
         22.65416118          0.24982973
  1  0  0  2  1
          8.97914774          0.40623896
          3.68630024          0.24338217
  1  0  0  1  1
          0.84660077          1.00000000
  1  0  0  1  1
          0.33647134          1.00000000
  1  0  0  1  1
          0.13647654          1.00000000
  1  1  1  4  1
         49.20038051          0.00555524
         11.34679054          0.03805238
          3.42739724          0.14953671
          1.17855251          0.34949305
  1  1  1  1  1
          0.41642205          1.00000000
  1  1  1  1  1
          0.14260826          1.00000000
# OXYGEN      (11s,6p) -> [5s,3p]
O  Ahlrichs-TZV
  8
  1  0  0  6  1
      27032.38263100          0.00021726
       4052.38713920          0.00168387
        922.32722710          0.00873956
        261.24070989          0.03523997
         85.35464135          0.11153519
         31.03503524          0.25588954
  1  0  0  2  1
         12.26086073          0.39768731
          4.99870760          0.24627849
  1  0  0  1  1
          1.17031082          1.00000000
  1  0  0  1  1
          0.46474741          1.00000000
  1  0  0  1  1
          0.18504536          1.00000000
  1  1  1  4  1
         63.27495480          0.00606851
         14.62704938          0.04191258
          4.45012235          0.16153841
          1.52757996          0.35706951
  1  1  1  1  1
          0.52935118          1.00000000
  1  1  1  1  1
          0.17478421          1.00000000
# FLUORINE    (11s,6p) -> [5s,3p]
F  Ahlrichs-TZV
  8
  1  0  0  6  1
      35479.10044100          0.00021545
       5318.47289830          0.00167007
       1210.48109750          0.00867332
        342.85518140          0.03504993
        112.01943181          0.11165320
         40.71474025          0.25988507
  1  0  0  2  1
         16.03967811          0.39422967
          6.50381867          0.24998239
  1  0  0  1  1
          1.54404775          1.00000000
  1  0  0  1  1
          0.61223453          1.00000000
  1  0  0  1  1
          0.24027980          1.00000000
  1  1  1  4  1
         80.23390048          0.00636860
         18.59401074          0.04430314
          5.68679027          0.16867249
          1.95110063          0.36166346
  1  1  1  1  1
          0.66970211          1.00000000
  1  1  1  1  1
          0.21651300          1.00000000
# NEON        (11s,6p) -> [5s,3p]
NE Ahlrichs-TZV
  8
  1  0  0  6  1
      45069.46402200          0.00021687
       6755.97686560          0.00168127
       1537.65028640          0.00873561
        435.51697667          0.03536127
        142.28655638          0.11321521
         51.69215380          0.26654653
  1  0  0  2  1
         20.31587049          0.39631960
          8.20219426          0.25582811
  1  0  0  1  1
          1.96812763          1.00000000
  1  0  0  1  1
          0.77904756          1.00000000
  1  0  0  1  1
          0.30229502          1.00000000
  1  1  1  4  1
         99.78299603          0.00655692
         23.17612410          0.04588801
          7.11639459          0.17331288
          2.44187114          0.36475268
  1  1  1  1  1
          0.83389606          1.00000000
  1  1  1  1  1
          0.26607311          1.00000000
# SODIUM      (14s,6p) -> [5s,2p]
NA Ahlrichs-TZV
  7
  1  0  0  7  1
      26041.10992700          0.00061806
       3906.12685480          0.00477486
        888.97454993          0.02447168
        251.45497961          0.09475539
         81.65014351          0.26867497
         28.90415840          0.47925475
         10.62578293          0.33248591
  1  0  0  3  1
         53.76941018          0.01952773
         16.30824302          0.09264801
          2.37303841         -0.39938670
  1  0  0  2  1
          0.95730773          1.64285954
          0.40806461          0.55692597
  1  0  0  1  1
          0.04996758          1.00000000
  1  0  0  1  1
          0.01926862          1.00000000
  1  1  1  5  1
        138.07979989          0.00579519
         32.23270039          0.04162085
          9.98160754          0.16281917
          3.48220339          0.36011785
          1.22991346          0.44858980
  1  1  1  1  1
          0.41743959          1.00000000
# MAGNESIUM   (14s,6p) -> [5s,2p]
MG Ahlrichs-TZV
  7
  1  0  0  7  1
      31438.34955500          0.00060912
       4715.51533540          0.00470662
       1073.16292470          0.02413582
        303.57238768          0.09362896
         98.62625104          0.26646742
         34.94380842          0.47890930
         12.85978520          0.33698490
  1  0  0  3  1
         64.87691300          0.01918089
         19.72552078          0.09091370
          2.89518043         -0.39563756
  1  0  0  2  1
          1.19604547          1.68276034
          0.54329451          0.52141092
  1  0  0  1  1
          0.10099104          1.00000000
  1  0  0  1  1
          0.03686573          1.00000000
  1  1  1  5  1
        179.87189612          0.00537995
         42.12006938          0.03931801
         13.12050303          0.15740129
          4.62575036          0.35919094
          1.66952110          0.45533379
  1  1  1  1  1
          0.58551012          1.00000000
# ALUMINUM    (14s,9p) -> [5s,4p]
AL Ahlrichs-TZV
  9
  1  0  0  7  1
      37792.55077200          0.00057048
       5668.06821650          0.00440930
       1289.85828410          0.02263097
        364.86596028          0.08802564
        118.57631515          0.25223702
         42.02486760          0.45960547
         15.49950163          0.33277886
  1  0  0  3  1
         75.20802660          0.01925056
         23.03140897          0.08790674
          3.63487976         -0.34246705
  1  0  0  2  1
          1.60650500          1.51062661
          0.76103395          0.58071016
  1  0  0  1  1
          0.16556709          1.00000000
  1  0  0  1  1
          0.06004158          1.00000000
  1  1  1  6  1
        452.52303192          0.00231108
        107.08195049          0.01856864
         34.13102125          0.08721624
         12.58703743          0.26902102
          4.98119197          0.52128324
          2.00703509          0.60271687
  1  1  1  1  1
          0.80083714          1.00000000
  1  1  1  1  1
          0.20178927          1.00000000
  1  1  1  1  1
          0.05789555          1.00000000
# SILICON     (14s,9p) -> [5s,4p]
SI Ahlrichs-TZV
  9
  1  0  0  7  1
      44773.35807800          0.00055915
       6717.19921040          0.00432060
       1528.89603250          0.02218710
        432.54746585          0.08648925
        140.61505226          0.24939890
         49.85763672          0.46017197
         18.43497489          0.34250237
  1  0  0  3  1
         86.53388611          0.02130006
         26.62460685          0.09467614
          4.49530572         -0.32616265
  1  0  0  2  1
          2.10350457          1.39808039
          1.01060949          0.63865787
  1  0  0  1  1
          0.23701751          1.00000000
  1  0  0  1  1
          0.08570341          1.00000000
  1  1  1  6  1
        394.47503628          0.00262857
         93.13768310          0.02055626
         29.51960874          0.09207026
         10.78166379          0.25565890
          4.16265748          0.42111707
          1.62479730          0.34401746
  1  1  1  1  1
          0.54306660          1.00000000
  1  1  1  1  1
          0.20582074          1.00000000
  1  1  1  1  1
          0.07005349          1.00000000
# PHOSPHORUS  (14s,9p) -> [5s,4p]
P  Ahlrichs-TZV
  9
  1  0  0  7  1
      52426.99923300          0.00055207
       7863.26605520          0.00426786
       1789.52273330          0.02193153
        506.27300165          0.08566717
        164.60698546          0.24840687
         58.39191872          0.46336754
         21.64366320          0.35350558
  1  0  0  3  1
         99.01383762          0.02189568
         30.55043982          0.09565047
          5.45370877         -0.29454270
  1  0  0  2  1
          2.65033626          1.32943812
          1.27266889          0.66109396
  1  0  0  1  1
          0.31645005          1.00000000
  1  0  0  1  1
          0.11417467          1.00000000
  1  1  1  6  1
        472.27219248          0.00257106
        111.58882756          0.02025030
         35.44593642          0.09158072
         12.99077688          0.25749454
          5.04862217          0.42862900
          1.99340496          0.34359818
  1  1  1  1  1
          0.66527284          1.00000000
  1  1  1  1  1
          0.25516832          1.00000000
  1  1  1  1  1
          0.09035776          1.00000000
# SULFUR      (14s,9p) -> [5s,4p]
S  Ahlrichs-TZV
  9
  1  0  0  7  1
      60700.92810400          0.00054696
       9102.61068540          0.00422972
       2071.41660090          0.02174782
        586.02476821          0.08510005
        190.55395021          0.24799128
         67.63038426          0.46703640
         25.12730691          0.36434588
  1  0  0  3  1
        112.57463010          0.02167004
         34.79555422          0.09360230
          6.51155562         -0.26068001
  1  0  0  2  1
          3.23990323          1.28420894
          1.54771609          0.66036417
  1  0  0  1  1
          0.40541030          1.00000000
  1  0  0  1  1
          0.14550651          1.00000000
  1  1  1  6  1
        564.36716027          0.00247968
        133.42624379          0.01967793
         42.46827119          0.08998001
         15.61652758          0.25705881
          6.10939885          0.43515167
          2.44041602          0.34883241
  1  1  1  1  1
          0.83882201          1.00000000
  1  1  1  1  1
          0.31288747          1.00000000
  1  1  1  1  1
          0.10770109          1.00000000
# CHLORINE    (14s,9p) -> [5s,4p]
CL Ahlrichs-TZV
  9
  1  0  0  7  1
      69507.99094500          0.00054315
      10426.15688000          0.00419905
       2373.23340610          0.02159214
        671.56420071          0.08459885
        218.41999790          0.24757250
         77.57224971          0.47016930
         28.88881528          0.37436371
  1  0  0  3  1
        127.10527185          0.02518217
         39.33958296          0.10786112
          7.67406800         -0.27408822
  1  0  0  2  1
          3.87456276          1.32138750
          1.83858326          0.68636955
  1  0  0  1  1
          0.50229058          1.00000000
  1  0  0  1  1
          0.17962723          1.00000000
  1  1  1  6  1
        666.50423284          0.00236327
        157.64241690          0.01887930
         50.26252098          0.08720634
         18.53607811          0.25285613
          7.29405328          0.43507155
          2.94332490          0.35026513
  1  1  1  1  1
          1.04049708          1.00000000
  1  1  1  1  1
          0.38456415          1.00000000
  1  1  1  1  1
          0.13069643          1.00000000
# ARGON       (14s,9p) -> [5s,4p]
AR Ahlrichs-TZV
  9
  1  0  0  7  1
      79111.42299800          0.00051029
      11864.74600900          0.00394630
       2700.16429730          0.02030707
        763.95943485          0.07969183
        248.45150561          0.23420624
         88.28358100          0.44833849
         32.94860707          0.36408167
  1  0  0  3  1
        142.55358000          0.02638741
         44.16368801          0.11226434
          8.95249950         -0.26178922
  1  0  0  2  1
          4.55469209          1.30024850
          2.14440790          0.67197237
  1  0  0  1  1
          0.60708777          1.00000000
  1  0  0  1  1
          0.21651432          1.00000000
  1  1  1  6  1
        776.77541998          0.00220280
        183.80107018          0.01769418
         58.69400317          0.08243129
         21.70159170          0.24207279
          8.58214896          0.42263558
          3.49226792          0.34151806
  1  1  1  1  1
          1.26374270          1.00000000
  1  1  1  1  1
          0.46607870          1.00000000
  1  1  1  1  1
          0.15766003          1.00000000
# POTASSIUM   (17s,10p) -> [6s,3p]
K  Ahlrichs-TZV
  9
  1  0  0  8  1
     153976.18325000          0.00023663
      23082.49767200          0.00183429
       5253.23447450          0.00953105
       1486.95501330          0.03863841
        484.06333726          0.12480769
        173.56653980          0.29278861
         67.11638146          0.40633426
         26.33950205          0.20077216
  1  0  0  4  1
        172.87693567         -0.02420096
         53.05864906         -0.11553095
          7.92127540          0.57455545
          3.21088805          0.57023185
  1  0  0  2  1
          4.56620709         -0.22615763
          0.70209907          0.75528392
  1  0  0  1  1
          0.28258943          1.00000000
  1  0  0  1  1
          0.03580582          1.00000000
  1  0  0  1  1
          0.01581921          1.00000000
  1  1  1  6  1
        728.18449873          0.00261507
        172.13265061          0.02067363
         54.82984707          0.09320560
         20.16626649          0.25436518
          7.86107288          0.39131133
          3.11052131          0.22481346
  1  1  1  3  1
         11.75733749         -0.02577729
          1.51396174          0.57359429
          0.58328592          1.07983200
  1  1  1  1  1
          0.21570478          1.00000000
# CALCIUM     (17s,10p) -> [6s,3p]
CA Ahlrichs-TZV
  9
  1  0  0  8  1
     172517.32685000          0.00023318
      25861.51927500          0.00180765
       5885.66186680          0.00939438
       1665.97300310          0.03810841
        542.36718148          0.12331204
        194.57803492          0.29004471
         75.30359764          0.40587151
         29.57406259          0.20398411
  1  0  0  4  1
        191.20074660         -0.02441976
         58.84029988         -0.11547027
          8.96425408          0.56356637
          3.68569605          0.56709683
  1  0  0  2  1
          5.24642897         -0.22825334
          0.84862622          0.72625219
  1  0  0  1  1
          0.36743301          1.00000000
  1  0  0  1  1
          0.06682158          1.00000000
  1  0  0  1  1
          0.02675973          1.00000000
  1  1  1  6  1
        836.97262058          0.00252583
        197.93040142          0.02007651
         63.13555805          0.09130299
         23.28268717          0.25247030
          9.11764449          0.39426326
          3.63361201          0.23011559
  1  1  1  3  1
         13.49416312         -0.02649502
          1.81392598          0.55088108
          0.71981826          1.02806166
  1  1  1  1  1
          0.27629577          1.00000000
# SCANDIUM    (17s,10p,6d) -> [6s,3p,3d]
SC Ahlrichs-TZV
 12
  1  0  0  8  1
     191612.91874000          0.00023076
      28723.85036300          0.00178903
       6537.01164900          0.00929904
       1850.30971710          0.03773944
        602.38855156          0.12227148
        216.17324766          0.28814821
         83.71251788          0.40517543
         32.90870719          0.20566020
  1  0  0  4  1
        211.34393234         -0.02452799
         65.12892014         -0.11570158
         10.03431153          0.55995283
          4.15968846          0.56087765
  1  0  0  2  1
          6.00090416         -0.22840494
          0.98255784          0.71948970
  1  0  0  1  1
          0.42483193          1.00000000
  1  0  0  1  1
          0.07718546          1.00000000
  1  0  0  1  1
          0.03014722          1.00000000
  1  1  1  6  1
        947.34122823          0.00247372
        224.09699732          0.01974297
         71.56033488          0.09035715
         26.44482449          0.25201603
         10.39379829          0.39675536
          4.16063046          0.23208625
  1  1  1  3  1
         15.56573714         -0.02712942
          2.11215449          0.55109257
          0.84184709          1.00906358
  1  1  1  1  1
          0.32297543          1.00000000
  1  2  2  4  1
         30.98939099          0.01190284
          8.69054651          0.06765586
          2.95202563          0.21332540
          1.07619107          0.38391076
  1  2  2  1  1
          0.38338915          1.00000000
  1  2  2  1  1
          0.12534686          1.00000000
# TITANIUM    (17s,10p,6d) -> [6s,3p,3d]
TI Ahlrichs-TZV
 12
  1  0  0  8  1
     211575.69025000          0.00023318
      31714.94505800          0.00180797
       7217.54765430          0.00939843
       2042.93942470          0.03815685
        665.12896208          0.12374757
        238.74942264          0.29208551
         92.50869100          0.41226801
         36.40391921          0.21090534
  1  0  0  4  1
        232.72624607         -0.02492014
         71.79120971         -0.11746490
         11.15853462          0.56503342
          4.65481354          0.56211102
  1  0  0  2  1
          6.80346292         -0.23011426
          1.12010764          0.72103187
  1  0  0  1  1
          0.48080119          1.00000000
  1  0  0  1  1
          0.08515727          1.00000000
  1  0  0  1  1
          0.03265748          1.00000000
  1  1  1  6  1
       1063.14747320          0.00246908
        251.56507061          0.01977335
         80.40855485          0.09098798
         29.76819327          0.25559900
         11.73683056          0.40489387
          4.71423752          0.23693403
  1  1  1  3  1
         17.79680370         -0.02787864
          2.42726987          0.55672915
          0.96823446          1.00554473
  1  1  1  1  1
          0.37056694          1.00000000
  1  2  2  4  1
         37.71338472          0.01151384
         10.69293118          0.06724634
          3.67284470          0.21484208
          1.35885903          0.38890893
  1  2  2  1  1
          0.49213295          1.00000000
  1  2  2  1  1
          0.16330521          1.00000000
# VANADIUM    (17s,10p,6d) -> [6s,3p,3d]
V  Ahlrichs-TZV
 12
  1  0  0  8  1
     232340.65058000          0.00023072
      34828.84117000          0.00178882
       7926.54486910          0.00929925
       2243.77330460          0.03776146
        730.59322944          0.12255910
        262.32219631          0.28963509
        101.70403805          0.41004703
         40.06478462          0.21113611
  1  0  0  4  1
        255.24014968         -0.02445812
         78.80464696         -0.11527205
         12.34059895          0.55174749
          5.17420192          0.54504528
  1  0  0  2  1
          7.65138945         -0.22967638
          1.26397599          0.71683769
  1  0  0  1  1
          0.53861762          1.00000000
  1  0  0  1  1
          0.09271930          1.00000000
  1  0  0  1  1
          0.03499806          1.00000000
  1  1  1  6  1
       1184.23691510          0.00244498
        280.23075192          0.01964345
         89.64362714          0.09079695
         33.24241125          0.25650768
         13.14451445          0.40815394
          5.29485341          0.23860378
  1  1  1  3  1
         20.17558685         -0.02824149
          2.76058652          0.55574636
          1.10089009          0.99319919
  1  1  1  1  1
          0.42013311          1.00000000
  1  2  2  4  1
         43.86113486          0.01148717
         12.51602189          0.06824715
          4.33138550          0.21837784
          1.61388558          0.39245212
  1  2  2  1  1
          0.58749574          1.00000000
  1  2  2  1  1
          0.19515723          1.00000000
# CHROMIUM    (17s,10p,6d) -> [6s,3p,3d]
CR Ahlrichs-TZV
 12
  1  0  0  8  1
     254477.80704000          0.00023387
      38131.79705400          0.00181426
       8675.29306070          0.00943639
       2455.00998480          0.03834364
        799.16217787          0.12459195
        286.90021489          0.29489696
        111.25413232          0.41846150
         43.86415264          0.21633763
  1  0  0  4  1
        279.32669173         -0.02345091
         86.27473238         -0.11080370
         13.55575611          0.53028966
          5.69781128          0.51603517
  1  0  0  2  1
          8.56365826         -0.38109546
          1.39882968          1.19915914
  1  0  0  1  1
          0.57288171          1.00000000
  1  0  0  1  1
          0.09009617          1.00000000
  1  0  0  1  1
          0.03412589          1.00000000
  1  1  1  6  1
       1306.43988640          0.00242773
        309.25311441          0.01954404
         98.99627396          0.09065179
         36.75691645          0.25699279
         14.56665708          0.40935505
          5.87399374          0.23729389
  1  1  1  3  1
         22.89099970         -0.02816603
          3.08550018          0.56034120
          1.21323291          0.98119020
  1  1  1  1  1
          0.44931681          1.00000000
  1  2  2  4  1
         43.72007448          0.01362296
         12.39124265          0.07893518
          4.26394420          0.23833840
          1.55252218          0.39526851
  1  2  2  1  1
          0.53761929          1.00000000
  1  2  2  1  1
          0.16493173          1.00000000
# MANGANESE   (17s,10p,6d) -> [6s,3p,3d]
MN Ahlrichs-TZV
 12
  1  0  0  8  1
     277185.00153000          0.00022838
      41550.76989000          0.00177077
       9455.97001520          0.00920772
       2676.52064820          0.03741597
        871.46687530          0.12164861
        312.98306420          0.28824392
        121.44454051          0.41041601
         47.92259883          0.21372375
  1  0  0  4  1
        303.66723163         -0.02458993
         93.88140319         -0.11602608
         14.87942121          0.55112060
          6.28652007          0.53707561
  1  0  0  2  1
          9.48585913         -0.22889263
          1.56987062          0.71196170
  1  0  0  1  1
          0.65903214          1.00000000
  1  0  0  1  1
          0.10686292          1.00000000
  1  0  0  1  1
          0.03926744          1.00000000
  1  1  1  6  1
       1444.79781820          0.00239941
        342.06551197          0.01936929
        109.58400891          0.09023611
         40.74798817          0.25745468
         16.18862657          0.41272352
          6.54845060          0.24087700
  1  1  1  3  1
         25.35708644         -0.02870717
          3.48301688          0.55208101
          1.38588009          0.97226901
  1  1  1  1  1
          0.52555095          1.00000000
  1  2  2  4  1
         56.56318912          0.01154325
         16.27873471          0.07029985
          5.69642739          0.22450771
          2.14111479          0.39703065
  1  2  2  1  1
          0.78291802          1.00000000
  1  2  2  1  1
          0.25952311          1.00000000
# IRON        (17s,10p,6d) -> [6s,3p,3d]
FE Ahlrichs-TZV
 12
  1  0  0  8  1
     300784.84637000          0.00022806
      45088.97055700          0.00176818
      10262.51631700          0.00919271
       2905.28972930          0.03735550
        946.11487137          0.12151108
        339.87832894          0.28818881
        131.94425588          0.41126613
         52.11149408          0.21518584
  1  0  0  4  1
        329.48839267         -0.02474522
        101.92332739         -0.11683089
         16.24046274          0.55293621
          6.88406758          0.53601640
  1  0  0  2  1
         10.47069378         -0.22912709
          1.73600396          0.71159320
  1  0  0  1  1
          0.72577289          1.00000000
  1  0  0  1  1
          0.11595528          1.00000000
  1  0  0  1  1
          0.04196823          1.00000000
  1  1  1  6  1
       1585.39599700          0.00237940
        375.38006499          0.01925315
        120.31816501          0.09002184
         44.78874903          0.25798172
         17.82927858          0.41492650
          7.22471538          0.24207475
  1  1  1  3  1
         28.14321976         -0.02904176
          3.87432414          0.55312260
          1.54107523          0.96771137
  1  1  1  1  1
          0.58285615          1.00000000
  1  2  2  4  1
         61.99667503          0.01197197
         17.87373255          0.07321014
          6.27447829          0.23103094
          2.35523372          0.39910706
  1  2  2  1  1
          0.85432240          1.00000000
  1  2  2  1  1
          0.27869254          1.00000000
# COBALT      (17s,10p,6d) -> [6s,3p,3d]
CO Ahlrichs-TZV
 12
  1  0  0  8  1
     325817.01553000          0.00022568
      48839.63645300          0.00174994
      11114.93730700          0.00910031
       3146.16036420          0.03699626
       1024.43784650          0.12044270
        368.02508816          0.28598732
        142.91229205          0.40908312
         56.48264921          0.21500146
  1  0  0  4  1
        356.40298318         -0.02476706
        110.31165215         -0.11702139
         17.65963483          0.55215522
          7.50590305          0.53246877
  1  0  0  2  1
         11.50180718         -0.22942470
          1.90819946          0.71180934
  1  0  0  1  1
          0.79396697          1.00000000
  1  0  0  1  1
          0.12444449          1.00000000
  1  0  0  1  1
          0.04444465          1.00000000
  1  1  1  6  1
       1731.13691440          0.00239058
        409.91750438          0.01938300
        131.45648578          0.09090545
         48.98743971          0.26146682
         19.53707899          0.42157265
          7.92872816          0.24571814
  1  1  1  3  1
         31.07601758         -0.02943807
          4.28351807          0.55615568
          1.70229216          0.96772195
  1  1  1  1  1
          0.64202909          1.00000000
  1  2  2  4  1
         68.14074524          0.01198385
         19.68524102          0.07368854
          6.93221288          0.23085497
          2.60251257          0.39281059
  1  2  2  1  1
          0.94016837          0.49652611
  1  2  2  1  1
          0.30381458          0.32719933
# NICKEL      (17s,10p,6d) -> [6s,3p,3d]
NI Ahlrichs-TZV
 12
  1  0  0  8  1
     351535.72935000          0.00022529
      52695.80928300          0.00174686
      11992.46829300          0.00908500
       3394.57766890          0.03694075
       1105.35945850          0.12032820
        397.14677769          0.28596715
        154.27542974          0.40983020
         61.01872378          0.21620643
  1  0  0  4  1
        384.45559739         -0.02465128
        119.04879199         -0.11658505
         19.13701222          0.54864127
          8.15267186          0.52640051
  1  0  0  2  1
         12.57940864         -0.22797884
          2.08708661          0.70703738
  1  0  0  1  1
          0.86432569          1.00000000
  1  0  0  1  1
          0.13283169          1.00000000
  1  0  0  1  1
          0.04684533          1.00000000
  1  1  1  6  1
       1883.09074860          0.00237483
        445.95155320          0.01928946
        143.08430815          0.09071821
         53.37292072          0.26181414
         21.32191936          0.42309150
          8.66435620          0.24641686
  1  1  1  3  1
         34.14425521         -0.02967713
          4.71224559          0.55616824
          1.87092318          0.96357766
  1  1  1  1  1
          0.70370016          1.00000000
  1  2  2  4  1
         74.59160347          0.01207745
         21.59063275          0.07463726
          7.62461426          0.23236776
          2.86322068          0.39042652
  1  2  2  1  1
          1.03110634          0.51501528
  1  2  2  1  1
          0.33060761          0.33962671
# COPPER      (17s,10p,6d) -> [6s,3p,3d]
CU Ahlrichs-TZV
 12
  1  0  0  8  1
     377518.79923000          0.00022812
      56589.98431100          0.00176880
      12878.71170600          0.00919935
       3645.37521430          0.03741102
       1187.00729450          0.12189874
        426.46421902          0.28983901
        165.70660164          0.41531872
         65.59894271          0.21905799
  1  0  0  4  1
        414.41265811         -0.02468253
        128.32056039         -0.11716827
         20.62208975          0.55301316
          8.78212260          0.52242719
  1  0  0  2  1
         13.74137201         -0.22736062
          2.24312468          0.71761211
  1  0  0  1  1
          0.89370549          1.00000000
  1  0  0  1  1
          0.10836700          1.00000000
  1  0  0  1  1
          0.03880618          1.00000000
  1  1  1  6  1
       2034.75966920          0.00235248
        481.90468106          0.01913407
        154.67482963          0.09017111
         57.74057697          0.26063285
         23.09905281          0.42093486
          9.38824786          0.24344615
  1  1  1  3  1
         37.59617121         -0.02899109
          5.12406908          0.54919084
          2.01199961          0.93793330
  1  1  1  1  1
          0.73860686          1.00000000
  1  2  2  4  1
         74.12946064          0.01436322
         21.35984259          0.08662818
          7.49952405          0.25631431
          2.76013942          0.40374062
  1  2  2  1  1
          0.95362061          1.00000000
  1  2  2  1  1
          0.28420863          1.00000000
# ZINC        (17s,10p,6d) -> [6s,3p,3d]
ZN Ahlrichs-TZV
 12
  1  0  0  8  1
     405924.31028000          0.00022442
      60846.95573500          0.00174021
      13847.34309200          0.00905133
       3919.61585510          0.03681734
       1276.35941670          0.12004850
        458.67254435          0.28576058
        178.28725246          0.41087462
         70.61219284          0.21816962
  1  0  0  4  1
        443.88077950         -0.02493427
        137.55875267         -0.11817956
         22.26808348          0.55367318
          9.52173106          0.52628935
  1  0  0  2  1
         14.87411407         -0.22929955
          2.46475176          0.71135485
  1  0  0  1  1
          1.01132722          1.00000000
  1  0  0  1  1
          0.14919852          1.00000000
  1  0  0  1  1
          0.05144187          1.00000000
  1  1  1  6  1
       2205.35085340          0.00233562
        522.35300699          0.01903102
        167.73055542          0.08995576
         62.67004537          0.26113249
         25.10974946          0.42348448
         10.22514268          0.24618927
  1  1  1  3  1
         40.71344252         -0.03002967
          5.62470907          0.55575255
          2.22799491          0.95581013
  1  1  1  1  1
          0.83354742          1.00000000
  1  2  2  4  1
         88.55431531          0.01272817
         25.72152556          0.07939450
          9.12783676          0.24491507
          3.43123641          0.40390526
  1  2  2  1  1
          1.23089206          1.00000000
  1  2  2  1  1
          0.39031845          1.00000000
# GALLIUM     (17s,12p,6p) -> [6s,5p,2d]
GA Ahlrichs-TZV
 13
  1  0  0  8  1
     435548.66254000          0.00023646
      65289.58903100          0.00183353
      14858.78425600          0.00953719
       4205.97347290          0.03880341
       1369.64164310          0.12661605
        492.30348905          0.30175310
        191.41923233          0.43543934
         75.84055867          0.23282364
  1  0  0  4  1
        474.30810613         -0.02674371
        147.10297560         -0.12654658
         23.98259943          0.58840347
         10.29823009          0.56324272
  1  0  0  2  1
         16.05038143         -0.24516440
          2.69884688          0.74578050
  1  0  0  1  1
          1.14285887          1.00000000
  1  0  0  1  1
          0.20217652          1.00000000
  1  0  0  1  1
          0.07198015          1.00000000
  1  1  1  6  1
       2432.01710700          0.00224341
        576.12049582          0.01834227
        185.11584354          0.08727970
         69.24657256          0.25684868
         27.81810778          0.42398378
         11.42022994          0.25701340
  1  1  1  3  1
         42.81966153         -0.01932652
          6.38859010          0.31571387
          2.66989933          0.57617793
  1  1  1  1  1
          1.07817838          1.00000000
  1  1  1  1  1
          0.22796559          1.00000000
  1  1  1  1  1
          0.06283623          1.00000000
  1  2  2  5  1
        103.92331829          0.01146461
         30.37109439          0.07362575
         10.87207810          0.23505107
          4.15491380          0.40318564
          1.53456591          0.40824748
  1  2  2  1  1
          0.51114264          1.00000000
# GERMANIUM   (17s,12p,6p) -> [6s,5p,2d]
GE Ahlrichs-TZV
 13
  1  0  0  8  1
     466115.00592000          0.00022487
      69875.42076200          0.00174354
      15903.27671600          0.00906915
       4501.82334530          0.03690617
       1466.05709240          0.12050168
        527.07841728          0.28748642
        205.00395074          0.41622322
         81.25159607          0.22397846
  1  0  0  4  1
        505.74661282         -0.02518461
        156.96593744         -0.11898930
         25.76144818          0.54930136
         11.10665469          0.52939309
  1  0  0  2  1
         17.27205910         -0.22854596
          2.94382890          0.68377930
  1  0  0  1  1
          1.28391649          1.00000000
  1  0  0  1  1
          0.25873337          1.00000000
  1  0  0  1  1
          0.09352491          1.00000000
  1  1  1  6  1
       2633.93462410          0.00221439
        624.00161628          0.01814090
        200.58528404          0.08663218
         75.09708153          0.25649021
         30.21438847          0.42658611
         12.44008757          0.26200527
  1  1  1  3  1
         45.98131600         -0.02032177
          6.99456544          0.32013745
          2.96860013          0.59051015
  1  1  1  1  1
          1.23209885          1.00000000
  1  1  1  1  1
          0.28981615          1.00000000
  1  1  1  1  1
          0.08556461          1.00000000
  1  2  2  5  1
        119.44887581          0.01058654
         35.06291529          0.06960128
         12.63692453          0.22807035
          4.88886729          0.40301067
          1.84531954          0.41304847
  1  2  2  1  1
          0.63571159          1.00000000
# ARSENIC     (17s,13p,6p) -> [6s,5p,2d]
AS Ahlrichs-TZV
 13
  1  0  0  8  1
     498032.42158000          0.00022740
      74656.86874300          0.00176328
      16990.96000400          0.00917280
       4809.62003210          0.03733783
       1566.28870550          0.12199536
        563.21360499          0.29137475
        219.11179978          0.42326351
         86.86606103          0.22921464
  1  0  0  4  1
        538.19512479         -0.02525420
        167.14850224         -0.11915461
         27.60551716          0.54628496
         11.94785852          0.53001521
  1  0  0  2  1
         18.53802313         -0.23479188
          3.20189857          0.69167053
  1  0  0  1  1
          1.43565221          1.00000000
  1  0  0  1  1
          0.31837805          1.00000000
  1  0  0  1  1
          0.11622632          1.00000000
  1  1  1  6  1
       2678.94215460          0.00233190
        634.61765840          0.01904215
        203.93967606          0.09022974
         76.32389037          0.26169038
         30.66412494          0.41857168
         12.50505673          0.23447830
  1  1  1  4  1
         49.25622955         -0.02123554
          7.72748915          0.30470207
          3.54104935          0.52888373
          1.69855855          0.37272251
  1  1  1  1  1
          0.76848071          1.00000000
  1  1  1  1  1
          0.30050823         -0.35023592
  1  1  1  1  1
          0.09819064          1.00000000
  1  2  2  5  1
        135.33289305          0.00992911
         39.86021274          0.06656884
         14.44642836          0.22275768
          5.64329004          0.40309224
          2.16681886          0.41671668
  1  2  2  1  1
          0.76514971          1.00000000
# SELENIUM    (17s,13p,6p) -> [6s,5p,2d]
SE Ahlrichs-TZV
 13
  1  0  0  8  1
     531071.66696000          0.00024109
      79603.04411700          0.00186964
      18115.84424000          0.00972716
       5127.89231940          0.03960479
       1669.91308390          0.12948855
        600.57534527          0.30959437
        233.70021247          0.45115769
         92.67244393          0.24579189
  1  0  0  4  1
        571.57513675         -0.02689571
        177.63686375         -0.12670989
         29.51776705          0.57699002
         12.82439979          0.56369075
  1  0  0  2  1
         19.84823584         -0.25132416
          3.47440185          0.72905417
  1  0  0  1  1
          1.59889108          1.00000000
  1  0  0  1  1
          0.38333469          1.00000000
  1  0  0  1  1
          0.14049742          1.00000000
  1  1  1  6  1
       2815.35005660          0.00255690
        666.92558298          0.02087403
        214.34213188          0.09877210
         80.24668794          0.28471821
         32.25108129          0.45003585
         13.10643256          0.24416091
  1  1  1  4  1
         53.36610852         -0.02155846
          8.18277772          0.32662311
          3.62399457          0.57740499
          1.63415914          0.34301321
  1  1  1  1  1
          0.58418320          1.00000000
  1  1  1  1  1
          0.23966269          1.00000000
  1  1  1  1  1
          0.08878513          1.00000000
  1  2  2  5  1
        151.82910279          0.00939703
         44.83999252          0.06408650
         16.32899951          0.21834238
          6.43050576          0.40314790
          2.50480252          0.41966491
  1  2  2  1  1
          0.90271148          1.00000000
# BROMINE     (17s,13p,6p) -> [6s,5p,2d]
BR Ahlrichs-TZV
 13
  1  0  0  8  1
     565073.25256000          0.00023660
      84701.72317900          0.00183483
      19276.27190000          0.00954658
       5456.42845760          0.03887714
       1776.95035000          0.12718314
        639.19398276          0.30437662
        248.78823961          0.44490940
         98.67830549          0.24381643
  1  0  0  4  1
        606.07824568         -0.02652716
        188.45598484         -0.12484585
         31.49714451          0.56468684
         13.73600832          0.55555269
  1  0  0  2  1
         21.20321277         -0.24940920
          3.76164202          0.71213120
  1  0  0  1  1
          1.77359340          1.00000000
  1  0  0  1  1
          0.45197414          1.00000000
  1  0  0  1  1
          0.16613377          1.00000000
  1  1  1  6  1
       3019.69557230          0.00249710
        715.35481126          0.02041927
        229.98328751          0.09689715
         86.16784462          0.28053901
         34.66787080          0.44606390
         14.11387031          0.24410074
  1  1  1  4  1
         57.08565308         -0.02185595
          8.81938458          0.32707075
          3.93403029          0.57855230
          1.79988304          0.33570988
  1  1  1  1  1
          0.66899411          1.00000000
  1  1  1  1  1
          0.27136238          1.00000000
  1  1  1  1  1
          0.10083790          1.00000000
  1  2  2  5  1
        168.85370257          0.00896640
         49.97794992          0.06206206
         18.27491334          0.21474732
          7.24556946          0.40335337
          2.85623150          0.42208813
  1  2  2  1  1
          1.04596211          1.00000000
# KRYPTON     (17s,13p,6p) -> [6s,5p,2d]
KR Ahlrichs-TZV
 13
  1  0  0  8  1
     600250.97575000          0.00023741
      89976.65078100          0.00184102
      20476.81422500          0.00957956
       5796.15540780          0.03902065
       1887.59131960          0.12772646
        679.11458519          0.30596521
        264.38244511          0.44857474
        104.88368574          0.24722957
  1  0  0  4  1
        641.47370764         -0.02674528
        199.57524820         -0.12571123
         33.54546295          0.56483736
         14.68395514          0.55972766
  1  0  0  2  1
         22.60310186         -0.25298772
          4.06506830          0.70992160
  1  0  0  1  1
          1.96110271          1.00000000
  1  0  0  1  1
          0.52465148          1.00000000
  1  0  0  1  1
          0.19332400          1.00000000
  1  1  1  6  1
       3232.95896140          0.00248856
        765.96442694          0.02037901
        246.33940810          0.09697719
         92.36528304          0.28199961
         37.19950955          0.45116254
         15.17216653          0.24917131
  1  1  1  4  1
         60.93132170         -0.02217360
          9.47926006          0.32838463
          4.25646863          0.58124997
          1.97293138          0.32863542
  1  1  1  1  1
          0.76337109          1.00000000
  1  1  1  1  1
          0.30943626          0.55671931
  1  1  1  1  1
          0.11569704          1.00000000
  1  2  2  5  1
        186.41760904          0.00861203
         55.27412435          0.06039441
         20.28321912          0.21181332
          8.08845370          0.40366293
          3.22140339          0.42402861
  1  2  2  1  1
          1.19521701          1.00000000
# BASIS="Ahlrichs pTZV"
# this basis has been constructed adding Ahlrichs polarization to Ahlrichs TZV
#Elements                             References
#--------                             ----------
#Li - Kr: A. Schafer, C. Huber and R. Ahlrichs, J. Chem. Phys. 100, 5829 (1994).
#H,He from VTZ
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
H  Ahlrichs-pTZV
  4
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
  1  1  1  1  1
          0.80000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE Ahlrichs-pTZV
  4
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# LITHIUM     (11s) -> [5s]
# LITHIUM     (1p)
LI Ahlrichs-pTZV
  6
  1  0  0  6  1
       6269.26280100          0.00020541
        940.31612431          0.00159166
        214.22107528          0.00828698
         60.75984018          0.03385637
         19.91515203          0.11103226
          7.31715098          0.27449383
  1  0  0  2  1
          2.97246742          0.23792456
          1.26398523          0.30765412
  1  0  0  1  1
          0.51427490          1.00000000
  1  0  0  1  1
          0.07703089          1.00000000
  1  0  0  1  1
          0.02893890          1.00000000
  1  1  1  1  1
          0.17000000          1.00000000
# BERYLLIUM   (11s) -> [5s]
# BERYLLIUM   (2p)
BE Ahlrichs-pTZV
  7
  1  0  0  6  1
       4700.23656260          0.00023584
        704.82845622          0.00182438
        160.43110478          0.00939661
         45.42534734          0.03690892
         14.79833412          0.10897561
          5.35124525          0.21694285
  1  0  0  2  1
          2.15420448          0.44695409
          0.93363744          0.20866986
  1  0  0  1  1
          0.18791433          1.00000000
  1  0  0  1  1
          0.74648268          1.00000000
  1  0  0  1  1
          0.03265048          1.00000000
  1  1  1  3  1
          3.63169171         -0.02903400
          0.71695694         -0.16877854
          0.19541933         -0.51403420
  1  1  1  1  1
          0.06051547          1.00000000
# BORON       (11s,6p) -> [5s,3p]
# BORON       (1d)
B  Ahlrichs-pTZV
  9
  1  0  0  6  1
       8564.86606870          0.00022837
       1284.15162630          0.00176826
        292.27871604          0.00914071
         82.77546918          0.03634264
         27.01793927          0.11063458
          9.81496197          0.23367344
  1  0  0  2  1
          3.93185591          0.41818778
          1.65955997          0.22325474
  1  0  0  1  1
          0.35762965          1.00000000
  1  0  0  1  1
          0.14246277          1.00000000
  1  0  0  1  1
          0.06056059          1.00000000
  1  1  1  4  1
         22.45387580          0.00502656
          5.10450583          0.03280174
          1.49860813          0.13151231
          0.50927831          0.33197168
  1  1  1  1  1
          0.18147078          1.00000000
  1  1  1  1  1
          0.06462189          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# CARBON      (11s,6p) -> [5s,3p]
# CARBON      (1d)
C  Ahlrichs-pTZV
  9
  1  0  0  6  1
      13575.34968200          0.00022246
       2035.23336800          0.00172327
        463.22562359          0.00892557
        131.20019598          0.03572798
         42.85301589          0.11076260
         15.58418577          0.24295628
  1  0  0  2  1
          6.20671385          0.41440263
          2.57648965          0.23744969
  1  0  0  1  1
          0.57696339          1.00000000
  1  0  0  1  1
          0.22972831          1.00000000
  1  0  0  1  1
          0.09516444          1.00000000
  1  1  1  4  1
         34.69723224          0.00533337
          7.95826228          0.03586411
          2.37808269          0.14215873
          0.81433208          0.34270472
  1  1  1  1  1
          0.28887547          1.00000000
  1  1  1  1  1
          0.10056824          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (11s,6p) -> [5s,3p]
# NITROGEN    (1d)
N  Ahlrichs-pTZV
  9
  1  0  0  6  1
      19730.80064700          0.00021888
       2957.89587450          0.00169607
        673.22133595          0.00879546
        190.68249494          0.03535938
         62.29544190          0.11095789
         22.65416118          0.24982973
  1  0  0  2  1
          8.97914774          0.40623896
          3.68630024          0.24338217
  1  0  0  1  1
          0.84660077          1.00000000
  1  0  0  1  1
          0.33647134          1.00000000
  1  0  0  1  1
          0.13647654          1.00000000
  1  1  1  4  1
         49.20038051          0.00555524
         11.34679054          0.03805238
          3.42739724          0.14953671
          1.17855251          0.34949305
  1  1  1  1  1
          0.41642205          1.00000000
  1  1  1  1  1
          0.14260826          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (11s,6p) -> [5s,3p]
# OXYGEN      (1d)
O  Ahlrichs-pTZV
  9
  1  0  0  6  1
      27032.38263100          0.00021726
       4052.38713920          0.00168387
        922.32722710          0.00873956
        261.24070989          0.03523997
         85.35464135          0.11153519
         31.03503524          0.25588954
  1  0  0  2  1
         12.26086073          0.39768731
          4.99870760          0.24627849
  1  0  0  1  1
          1.17031082          1.00000000
  1  0  0  1  1
          0.46474741          1.00000000
  1  0  0  1  1
          0.18504536          1.00000000
  1  1  1  4  1
         63.27495480          0.00606851
         14.62704938          0.04191258
          4.45012235          0.16153841
          1.52757996          0.35706951
  1  1  1  1  1
          0.52935118          1.00000000
  1  1  1  1  1
          0.17478421          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# FLUORINE    (11s,6p) -> [5s,3p]
# FLUORINE    (1d)
F  Ahlrichs-pTZV
  9
  1  0  0  6  1
      35479.10044100          0.00021545
       5318.47289830          0.00167007
       1210.48109750          0.00867332
        342.85518140          0.03504993
        112.01943181          0.11165320
         40.71474025          0.25988507
  1  0  0  2  1
         16.03967811          0.39422967
          6.50381867          0.24998239
  1  0  0  1  1
          1.54404775          1.00000000
  1  0  0  1  1
          0.61223453          1.00000000
  1  0  0  1  1
          0.24027980          1.00000000
  1  1  1  4  1
         80.23390048          0.00636860
         18.59401074          0.04430314
          5.68679027          0.16867249
          1.95110063          0.36166346
  1  1  1  1  1
          0.66970211          1.00000000
  1  1  1  1  1
          0.21651300          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NEON        (11s,6p) -> [5s,3p]
# NEON        (1d)
NE Ahlrichs-pTZV
  9
  1  0  0  6  1
      45069.46402200          0.00021687
       6755.97686560          0.00168127
       1537.65028640          0.00873561
        435.51697667          0.03536127
        142.28655638          0.11321521
         51.69215380          0.26654653
  1  0  0  2  1
         20.31587049          0.39631960
          8.20219426          0.25582811
  1  0  0  1  1
          1.96812763          1.00000000
  1  0  0  1  1
          0.77904756          1.00000000
  1  0  0  1  1
          0.30229502          1.00000000
  1  1  1  4  1
         99.78299603          0.00655692
         23.17612410          0.04588801
          7.11639459          0.17331288
          2.44187114          0.36475268
  1  1  1  1  1
          0.83389606          1.00000000
  1  1  1  1  1
          0.26607311          1.00000000
  1  2  2  1  1
          1.88800000          1.00000000
# SODIUM      (14s,6p) -> [5s,2p]
# SODIUM      (1p)
NA Ahlrichs-pTZV
  8
  1  0  0  7  1
      26041.10992700          0.00061806
       3906.12685480          0.00477486
        888.97454993          0.02447168
        251.45497961          0.09475539
         81.65014351          0.26867497
         28.90415840          0.47925475
         10.62578293          0.33248591
  1  0  0  3  1
         53.76941018          0.01952773
         16.30824302          0.09264801
          2.37303841         -0.39938670
  1  0  0  2  1
          0.95730773          1.64285954
          0.40806461          0.55692597
  1  0  0  1  1
          0.04996758          1.00000000
  1  0  0  1  1
          0.01926862          1.00000000
  1  1  1  5  1
        138.07979989          0.00579519
         32.23270039          0.04162085
          9.98160754          0.16281917
          3.48220339          0.36011785
          1.22991346          0.44858980
  1  1  1  1  1
          0.41743959          1.00000000
  1  1  1  1  1
          0.05200000          1.00000000
# MAGNESIUM   (14s,6p) -> [5s,2p]
# MAGNESIUM   (1p)
MG Ahlrichs-pTZV
  8
  1  0  0  7  1
      31438.34955500          0.00060912
       4715.51533540          0.00470662
       1073.16292470          0.02413582
        303.57238768          0.09362896
         98.62625104          0.26646742
         34.94380842          0.47890930
         12.85978520          0.33698490
  1  0  0  3  1
         64.87691300          0.01918089
         19.72552078          0.09091370
          2.89518043         -0.39563756
  1  0  0  2  1
          1.19604547          1.68276034
          0.54329451          0.52141092
  1  0  0  1  1
          0.10099104          1.00000000
  1  0  0  1  1
          0.03686573          1.00000000
  1  1  1  5  1
        179.87189612          0.00537995
         42.12006938          0.03931801
         13.12050303          0.15740129
          4.62575036          0.35919094
          1.66952110          0.45533379
  1  1  1  1  1
          0.58551012          1.00000000
  1  1  1  1  1
          0.18914796          1.00000000
# ALUMINUM    (14s,9p) -> [5s,4p]
# ALUMINUM    (1d)
AL Ahlrichs-pTZV
 10
  1  0  0  7  1
      37792.55077200          0.00057048
       5668.06821650          0.00440930
       1289.85828410          0.02263097
        364.86596028          0.08802564
        118.57631515          0.25223702
         42.02486760          0.45960547
         15.49950163          0.33277886
  1  0  0  3  1
         75.20802660          0.01925056
         23.03140897          0.08790674
          3.63487976         -0.34246705
  1  0  0  2  1
          1.60650500          1.51062661
          0.76103395          0.58071016
  1  0  0  1  1
          0.16556709          1.00000000
  1  0  0  1  1
          0.06004158          1.00000000
  1  1  1  6  1
        452.52303192          0.00231108
        107.08195049          0.01856864
         34.13102125          0.08721624
         12.58703743          0.26902102
          4.98119197          0.52128324
          2.00703509          0.60271687
  1  1  1  1  1
          0.80083714          1.00000000
  1  1  1  1  1
          0.20178927          1.00000000
  1  1  1  1  1
          0.05789555          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# SILICON     (14s,9p) -> [5s,4p]
# SILICON     (1d)
SI Ahlrichs-pTZV
 10
  1  0  0  7  1
      44773.35807800          0.00055915
       6717.19921040          0.00432060
       1528.89603250          0.02218710
        432.54746585          0.08648925
        140.61505226          0.24939890
         49.85763672          0.46017197
         18.43497489          0.34250237
  1  0  0  3  1
         86.53388611          0.02130006
         26.62460685          0.09467614
          4.49530572         -0.32616265
  1  0  0  2  1
          2.10350457          1.39808039
          1.01060949          0.63865787
  1  0  0  1  1
          0.23701751          1.00000000
  1  0  0  1  1
          0.08570341          1.00000000
  1  1  1  6  1
        394.47503628          0.00262857
         93.13768310          0.02055626
         29.51960874          0.09207026
         10.78166379          0.25565890
          4.16265748          0.42111707
          1.62479730          0.34401746
  1  1  1  1  1
          0.54306660          1.00000000
  1  1  1  1  1
          0.20582074          1.00000000
  1  1  1  1  1
          0.07005349          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
# PHOSPHORUS  (14s,9p) -> [5s,4p]
# PHOSPHORUS  (1d)
P  Ahlrichs-pTZV
 10
  1  0  0  7  1
      52426.99923300          0.00055207
       7863.26605520          0.00426786
       1789.52273330          0.02193153
        506.27300165          0.08566717
        164.60698546          0.24840687
         58.39191872          0.46336754
         21.64366320          0.35350558
  1  0  0  3  1
         99.01383762          0.02189568
         30.55043982          0.09565047
          5.45370877         -0.29454270
  1  0  0  2  1
          2.65033626          1.32943812
          1.27266889          0.66109396
  1  0  0  1  1
          0.31645005          1.00000000
  1  0  0  1  1
          0.11417467          1.00000000
  1  1  1  6  1
        472.27219248          0.00257106
        111.58882756          0.02025030
         35.44593642          0.09158072
         12.99077688          0.25749454
          5.04862217          0.42862900
          1.99340496          0.34359818
  1  1  1  1  1
          0.66527284          1.00000000
  1  1  1  1  1
          0.25516832          1.00000000
  1  1  1  1  1
          0.09035776          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# SULFUR      (14s,9p) -> [5s,4p]
# SULFUR      (1d)
S  Ahlrichs-pTZV
 10
  1  0  0  7  1
      60700.92810400          0.00054696
       9102.61068540          0.00422972
       2071.41660090          0.02174782
        586.02476821          0.08510005
        190.55395021          0.24799128
         67.63038426          0.46703640
         25.12730691          0.36434588
  1  0  0  3  1
        112.57463010          0.02167004
         34.79555422          0.09360230
          6.51155562         -0.26068001
  1  0  0  2  1
          3.23990323          1.28420894
          1.54771609          0.66036417
  1  0  0  1  1
          0.40541030          1.00000000
  1  0  0  1  1
          0.14550651          1.00000000
  1  1  1  6  1
        564.36716027          0.00247968
        133.42624379          0.01967793
         42.46827119          0.08998001
         15.61652758          0.25705881
          6.10939885          0.43515167
          2.44041602          0.34883241
  1  1  1  1  1
          0.83882201          1.00000000
  1  1  1  1  1
          0.31288747          1.00000000
  1  1  1  1  1
          0.10770109          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE    (14s,9p) -> [5s,4p]
# CHLORINE    (1d)
CL Ahlrichs-pTZV
 10
  1  0  0  7  1
      69507.99094500          0.00054315
      10426.15688000          0.00419905
       2373.23340610          0.02159214
        671.56420071          0.08459885
        218.41999790          0.24757250
         77.57224971          0.47016930
         28.88881528          0.37436371
  1  0  0  3  1
        127.10527185          0.02518217
         39.33958296          0.10786112
          7.67406800         -0.27408822
  1  0  0  2  1
          3.87456276          1.32138750
          1.83858326          0.68636955
  1  0  0  1  1
          0.50229058          1.00000000
  1  0  0  1  1
          0.17962723          1.00000000
  1  1  1  6  1
        666.50423284          0.00236327
        157.64241690          0.01887930
         50.26252098          0.08720634
         18.53607811          0.25285613
          7.29405328          0.43507155
          2.94332490          0.35026513
  1  1  1  1  1
          1.04049708          1.00000000
  1  1  1  1  1
          0.38456415          1.00000000
  1  1  1  1  1
          0.13069643          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# ARGON       (14s,9p) -> [5s,4p]
# ARGON       (1d)
AR Ahlrichs-pTZV
 10
  1  0  0  7  1
      79111.42299800          0.00051029
      11864.74600900          0.00394630
       2700.16429730          0.02030707
        763.95943485          0.07969183
        248.45150561          0.23420624
         88.28358100          0.44833849
         32.94860707          0.36408167
  1  0  0  3  1
        142.55358000          0.02638741
         44.16368801          0.11226434
          8.95249950         -0.26178922
  1  0  0  2  1
          4.55469209          1.30024850
          2.14440790          0.67197237
  1  0  0  1  1
          0.60708777          1.00000000
  1  0  0  1  1
          0.21651432          1.00000000
  1  1  1  6  1
        776.77541998          0.00220280
        183.80107018          0.01769418
         58.69400317          0.08243129
         21.70159170          0.24207279
          8.58214896          0.42263558
          3.49226792          0.34151806
  1  1  1  1  1
          1.26374270          1.00000000
  1  1  1  1  1
          0.46607870          1.00000000
  1  1  1  1  1
          0.15766003          1.00000000
  1  2  2  1  1
          0.96900000          1.00000000
# POTASSIUM   (17s,10p) -> [6s,3p]
# POTASSIUM   (1p)
K  Ahlrichs-pTZV
 10
  1  0  0  8  1
     153976.18325000          0.00023663
      23082.49767200          0.00183429
       5253.23447450          0.00953105
       1486.95501330          0.03863841
        484.06333726          0.12480769
        173.56653980          0.29278861
         67.11638146          0.40633426
         26.33950205          0.20077216
  1  0  0  4  1
        172.87693567         -0.02420096
         53.05864906         -0.11553095
          7.92127540          0.57455545
          3.21088805          0.57023185
  1  0  0  2  1
          4.56620709         -0.22615763
          0.70209907          0.75528392
  1  0  0  1  1
          0.28258943          1.00000000
  1  0  0  1  1
          0.03580582          1.00000000
  1  0  0  1  1
          0.01581921          1.00000000
  1  1  1  6  1
        728.18449873          0.00261507
        172.13265061          0.02067363
         54.82984707          0.09320560
         20.16626649          0.25436518
          7.86107288          0.39131133
          3.11052131          0.22481346
  1  1  1  3  1
         11.75733749         -0.02577729
          1.51396174          0.57359429
          0.58328592          1.07983200
  1  1  1  1  1
          0.21570478          1.00000000
  1  1  1  1  1
          0.04173700          1.00000000
# CALCIUM     (17s,10p) -> [6s,3p]
# CALCIUM     (1p)
CA Ahlrichs-pTZV
 10
  1  0  0  8  1
     172517.32685000          0.00023318
      25861.51927500          0.00180765
       5885.66186680          0.00939438
       1665.97300310          0.03810841
        542.36718148          0.12331204
        194.57803492          0.29004471
         75.30359764          0.40587151
         29.57406259          0.20398411
  1  0  0  4  1
        191.20074660         -0.02441976
         58.84029988         -0.11547027
          8.96425408          0.56356637
          3.68569605          0.56709683
  1  0  0  2  1
          5.24642897         -0.22825334
          0.84862622          0.72625219
  1  0  0  1  1
          0.36743301          1.00000000
  1  0  0  1  1
          0.06682158          1.00000000
  1  0  0  1  1
          0.02675973          1.00000000
  1  1  1  6  1
        836.97262058          0.00252583
        197.93040142          0.02007651
         63.13555805          0.09130299
         23.28268717          0.25247030
          9.11764449          0.39426326
          3.63361201          0.23011559
  1  1  1  3  1
         13.49416312         -0.02649502
          1.81392598          0.55088108
          0.71981826          1.02806166
  1  1  1  1  1
          0.27629577          1.00000000
  1  1  1  1  1
          0.07497900          1.00000000
# SCANDIUM    (17s,10p,6d) -> [6s,3p,3d]
# SCANDIUM    (1p)
SC Ahlrichs-pTZV
 13
  1  0  0  8  1
     191612.91874000          0.00023076
      28723.85036300          0.00178903
       6537.01164900          0.00929904
       1850.30971710          0.03773944
        602.38855156          0.12227148
        216.17324766          0.28814821
         83.71251788          0.40517543
         32.90870719          0.20566020
  1  0  0  4  1
        211.34393234         -0.02452799
         65.12892014         -0.11570158
         10.03431153          0.55995283
          4.15968846          0.56087765
  1  0  0  2  1
          6.00090416         -0.22840494
          0.98255784          0.71948970
  1  0  0  1  1
          0.42483193          1.00000000
  1  0  0  1  1
          0.07718546          1.00000000
  1  0  0  1  1
          0.03014722          1.00000000
  1  1  1  6  1
        947.34122823          0.00247372
        224.09699732          0.01974297
         71.56033488          0.09035715
         26.44482449          0.25201603
         10.39379829          0.39675536
          4.16063046          0.23208625
  1  1  1  3  1
         15.56573714         -0.02712942
          2.11215449          0.55109257
          0.84184709          1.00906358
  1  1  1  1  1
          0.32297543          1.00000000
  1  2  2  4  1
         30.98939099          0.01190284
          8.69054651          0.06765586
          2.95202563          0.21332540
          1.07619107          0.38391076
  1  2  2  1  1
          0.38338915          1.00000000
  1  2  2  1  1
          0.12534686          1.00000000
  1  1  1  1  1
          0.08974800          1.00000000
# TITANIUM    (17s,10p,6d) -> [6s,3p,3d]
# TITANIUM    (1p)
TI Ahlrichs-pTZV
 13
  1  0  0  8  1
     211575.69025000          0.00023318
      31714.94505800          0.00180797
       7217.54765430          0.00939843
       2042.93942470          0.03815685
        665.12896208          0.12374757
        238.74942264          0.29208551
         92.50869100          0.41226801
         36.40391921          0.21090534
  1  0  0  4  1
        232.72624607         -0.02492014
         71.79120971         -0.11746490
         11.15853462          0.56503342
          4.65481354          0.56211102
  1  0  0  2  1
          6.80346292         -0.23011426
          1.12010764          0.72103187
  1  0  0  1  1
          0.48080119          1.00000000
  1  0  0  1  1
          0.08515727          1.00000000
  1  0  0  1  1
          0.03265748          1.00000000
  1  1  1  6  1
       1063.14747320          0.00246908
        251.56507061          0.01977335
         80.40855485          0.09098798
         29.76819327          0.25559900
         11.73683056          0.40489387
          4.71423752          0.23693403
  1  1  1  3  1
         17.79680370         -0.02787864
          2.42726987          0.55672915
          0.96823446          1.00554473
  1  1  1  1  1
          0.37056694          1.00000000
  1  2  2  4  1
         37.71338472          0.01151384
         10.69293118          0.06724634
          3.67284470          0.21484208
          1.35885903          0.38890893
  1  2  2  1  1
          0.49213295          1.00000000
  1  2  2  1  1
          0.16330521          1.00000000
  1  1  1  1  1
          0.10156100          1.00000000
# VANADIUM    (17s,10p,6d) -> [6s,3p,3d]
# VANADIUM    (1p)
V  Ahlrichs-pTZV
 13
  1  0  0  8  1
     232340.65058000          0.00023072
      34828.84117000          0.00178882
       7926.54486910          0.00929925
       2243.77330460          0.03776146
        730.59322944          0.12255910
        262.32219631          0.28963509
        101.70403805          0.41004703
         40.06478462          0.21113611
  1  0  0  4  1
        255.24014968         -0.02445812
         78.80464696         -0.11527205
         12.34059895          0.55174749
          5.17420192          0.54504528
  1  0  0  2  1
          7.65138945         -0.22967638
          1.26397599          0.71683769
  1  0  0  1  1
          0.53861762          1.00000000
  1  0  0  1  1
          0.09271930          1.00000000
  1  0  0  1  1
          0.03499806          1.00000000
  1  1  1  6  1
       1184.23691510          0.00244498
        280.23075192          0.01964345
         89.64362714          0.09079695
         33.24241125          0.25650768
         13.14451445          0.40815394
          5.29485341          0.23860378
  1  1  1  3  1
         20.17558685         -0.02824149
          2.76058652          0.55574636
          1.10089009          0.99319919
  1  1  1  1  1
          0.42013311          1.00000000
  1  2  2  4  1
         43.86113486          0.01148717
         12.51602189          0.06824715
          4.33138550          0.21837784
          1.61388558          0.39245212
  1  2  2  1  1
          0.58749574          1.00000000
  1  2  2  1  1
          0.19515723          1.00000000
  1  1  1  1  1
          0.11124800          1.00000000
# CHROMIUM    (17s,10p,6d) -> [6s,3p,3d]
# CHROMIUM    (1p)
CR Ahlrichs-pTZV
 13
  1  0  0  8  1
     254477.80704000          0.00023387
      38131.79705400          0.00181426
       8675.29306070          0.00943639
       2455.00998480          0.03834364
        799.16217787          0.12459195
        286.90021489          0.29489696
        111.25413232          0.41846150
         43.86415264          0.21633763
  1  0  0  4  1
        279.32669173         -0.02345091
         86.27473238         -0.11080370
         13.55575611          0.53028966
          5.69781128          0.51603517
  1  0  0  2  1
          8.56365826         -0.38109546
          1.39882968          1.19915914
  1  0  0  1  1
          0.57288171          1.00000000
  1  0  0  1  1
          0.09009617          1.00000000
  1  0  0  1  1
          0.03412589          1.00000000
  1  1  1  6  1
       1306.43988640          0.00242773
        309.25311441          0.01954404
         98.99627396          0.09065179
         36.75691645          0.25699279
         14.56665708          0.40935505
          5.87399374          0.23729389
  1  1  1  3  1
         22.89099970         -0.02816603
          3.08550018          0.56034120
          1.21323291          0.98119020
  1  1  1  1  1
          0.44931681          1.00000000
  1  2  2  4  1
         43.72007448          0.01362296
         12.39124265          0.07893518
          4.26394420          0.23833840
          1.55252218          0.39526851
  1  2  2  1  1
          0.53761929          1.00000000
  1  2  2  1  1
          0.16493173          1.00000000
  1  1  1  1  1
          0.12067500          1.00000000
# MANGANESE   (17s,10p,6d) -> [6s,3p,3d]
# MANGANESE   (1p)
MN Ahlrichs-pTZV
 13
  1  0  0  8  1
     277185.00153000          0.00022838
      41550.76989000          0.00177077
       9455.97001520          0.00920772
       2676.52064820          0.03741597
        871.46687530          0.12164861
        312.98306420          0.28824392
        121.44454051          0.41041601
         47.92259883          0.21372375
  1  0  0  4  1
        303.66723163         -0.02458993
         93.88140319         -0.11602608
         14.87942121          0.55112060
          6.28652007          0.53707561
  1  0  0  2  1
          9.48585913         -0.22889263
          1.56987062          0.71196170
  1  0  0  1  1
          0.65903214          1.00000000
  1  0  0  1  1
          0.10686292          1.00000000
  1  0  0  1  1
          0.03926744          1.00000000
  1  1  1  6  1
       1444.79781820          0.00239941
        342.06551197          0.01936929
        109.58400891          0.09023611
         40.74798817          0.25745468
         16.18862657          0.41272352
          6.54845060          0.24087700
  1  1  1  3  1
         25.35708644         -0.02870717
          3.48301688          0.55208101
          1.38588009          0.97226901
  1  1  1  1  1
          0.52555095          1.00000000
  1  2  2  4  1
         56.56318912          0.01154325
         16.27873471          0.07029985
          5.69642739          0.22450771
          2.14111479          0.39703065
  1  2  2  1  1
          0.78291802          1.00000000
  1  2  2  1  1
          0.25952311          1.00000000
  1  1  1  1  1
          0.12765000          1.00000000
# IRON        (17s,10p,6d) -> [6s,3p,3d]
# IRON        (1p)
FE Ahlrichs-pTZV
 13
  1  0  0  8  1
     300784.84637000          0.00022806
      45088.97055700          0.00176818
      10262.51631700          0.00919271
       2905.28972930          0.03735550
        946.11487137          0.12151108
        339.87832894          0.28818881
        131.94425588          0.41126613
         52.11149408          0.21518584
  1  0  0  4  1
        329.48839267         -0.02474522
        101.92332739         -0.11683089
         16.24046274          0.55293621
          6.88406758          0.53601640
  1  0  0  2  1
         10.47069378         -0.22912709
          1.73600396          0.71159320
  1  0  0  1  1
          0.72577289          1.00000000
  1  0  0  1  1
          0.11595528          1.00000000
  1  0  0  1  1
          0.04196823          1.00000000
  1  1  1  6  1
       1585.39599700          0.00237940
        375.38006499          0.01925315
        120.31816501          0.09002184
         44.78874903          0.25798172
         17.82927858          0.41492650
          7.22471538          0.24207475
  1  1  1  3  1
         28.14321976         -0.02904176
          3.87432414          0.55312260
          1.54107523          0.96771137
  1  1  1  1  1
          0.58285615          1.00000000
  1  2  2  4  1
         61.99667503          0.01197197
         17.87373255          0.07321014
          6.27447829          0.23103094
          2.35523372          0.39910706
  1  2  2  1  1
          0.85432240          1.00000000
  1  2  2  1  1
          0.27869254          1.00000000
  1  1  1  1  1
          0.13491500          1.00000000
# COBALT      (17s,10p,6d) -> [6s,3p,3d]
# COBALT      (1p)
CO Ahlrichs-pTZV
 13
  1  0  0  8  1
     325817.01553000          0.00022568
      48839.63645300          0.00174994
      11114.93730700          0.00910031
       3146.16036420          0.03699626
       1024.43784650          0.12044270
        368.02508816          0.28598732
        142.91229205          0.40908312
         56.48264921          0.21500146
  1  0  0  4  1
        356.40298318         -0.02476706
        110.31165215         -0.11702139
         17.65963483          0.55215522
          7.50590305          0.53246877
  1  0  0  2  1
         11.50180718         -0.22942470
          1.90819946          0.71180934
  1  0  0  1  1
          0.79396697          1.00000000
  1  0  0  1  1
          0.12444449          1.00000000
  1  0  0  1  1
          0.04444465          1.00000000
  1  1  1  6  1
       1731.13691440          0.00239058
        409.91750438          0.01938300
        131.45648578          0.09090545
         48.98743971          0.26146682
         19.53707899          0.42157265
          7.92872816          0.24571814
  1  1  1  3  1
         31.07601758         -0.02943807
          4.28351807          0.55615568
          1.70229216          0.96772195
  1  1  1  1  1
          0.64202909          1.00000000
  1  2  2  4  1
         68.14074524          0.01198385
         19.68524102          0.07368854
          6.93221288          0.23085497
          2.60251257          0.39281059
  1  2  2  1  1
          0.94016837          0.49652611
  1  2  2  1  1
          0.30381458          0.32719933
  1  1  1  1  1
          0.14130800          1.00000000
# NICKEL      (17s,10p,6d) -> [6s,3p,3d]
# NICKEL      (1p)
NI Ahlrichs-pTZV
 13
  1  0  0  8  1
     351535.72935000          0.00022529
      52695.80928300          0.00174686
      11992.46829300          0.00908500
       3394.57766890          0.03694075
       1105.35945850          0.12032820
        397.14677769          0.28596715
        154.27542974          0.40983020
         61.01872378          0.21620643
  1  0  0  4  1
        384.45559739         -0.02465128
        119.04879199         -0.11658505
         19.13701222          0.54864127
          8.15267186          0.52640051
  1  0  0  2  1
         12.57940864         -0.22797884
          2.08708661          0.70703738
  1  0  0  1  1
          0.86432569          1.00000000
  1  0  0  1  1
          0.13283169          1.00000000
  1  0  0  1  1
          0.04684533          1.00000000
  1  1  1  6  1
       1883.09074860          0.00237483
        445.95155320          0.01928946
        143.08430815          0.09071821
         53.37292072          0.26181414
         21.32191936          0.42309150
          8.66435620          0.24641686
  1  1  1  3  1
         34.14425521         -0.02967713
          4.71224559          0.55616824
          1.87092318          0.96357766
  1  1  1  1  1
          0.70370016          1.00000000
  1  2  2  4  1
         74.59160347          0.01207745
         21.59063275          0.07463726
          7.62461426          0.23236776
          2.86322068          0.39042652
  1  2  2  1  1
          1.03110634          0.51501528
  1  2  2  1  1
          0.33060761          0.33962671
  1  1  1  1  1
          0.14658800          1.00000000
# COPPER      (17s,10p,6d) -> [6s,3p,3d]
# COPPER      (1p)
CU Ahlrichs-pTZV
 13
  1  0  0  8  1
     377518.79923000          0.00022812
      56589.98431100          0.00176880
      12878.71170600          0.00919935
       3645.37521430          0.03741102
       1187.00729450          0.12189874
        426.46421902          0.28983901
        165.70660164          0.41531872
         65.59894271          0.21905799
  1  0  0  4  1
        414.41265811         -0.02468253
        128.32056039         -0.11716827
         20.62208975          0.55301316
          8.78212260          0.52242719
  1  0  0  2  1
         13.74137201         -0.22736062
          2.24312468          0.71761211
  1  0  0  1  1
          0.89370549          1.00000000
  1  0  0  1  1
          0.10836700          1.00000000
  1  0  0  1  1
          0.03880618          1.00000000
  1  1  1  6  1
       2034.75966920          0.00235248
        481.90468106          0.01913407
        154.67482963          0.09017111
         57.74057697          0.26063285
         23.09905281          0.42093486
          9.38824786          0.24344615
  1  1  1  3  1
         37.59617121         -0.02899109
          5.12406908          0.54919084
          2.01199961          0.93793330
  1  1  1  1  1
          0.73860686          1.00000000
  1  2  2  4  1
         74.12946064          0.01436322
         21.35984259          0.08662818
          7.49952405          0.25631431
          2.76013942          0.40374062
  1  2  2  1  1
          0.95362061          1.00000000
  1  2  2  1  1
          0.28420863          1.00000000
  1  1  1  1  1
          0.15506500          1.00000000
# ZINC        (17s,10p,6d) -> [6s,3p,3d]
# ZINC        (1p)
ZN Ahlrichs-pTZV
 13
  1  0  0  8  1
     405924.31028000          0.00022442
      60846.95573500          0.00174021
      13847.34309200          0.00905133
       3919.61585510          0.03681734
       1276.35941670          0.12004850
        458.67254435          0.28576058
        178.28725246          0.41087462
         70.61219284          0.21816962
  1  0  0  4  1
        443.88077950         -0.02493427
        137.55875267         -0.11817956
         22.26808348          0.55367318
          9.52173106          0.52628935
  1  0  0  2  1
         14.87411407         -0.22929955
          2.46475176          0.71135485
  1  0  0  1  1
          1.01132722          1.00000000
  1  0  0  1  1
          0.14919852          1.00000000
  1  0  0  1  1
          0.05144187          1.00000000
  1  1  1  6  1
       2205.35085340          0.00233562
        522.35300699          0.01903102
        167.73055542          0.08995576
         62.67004537          0.26113249
         25.10974946          0.42348448
         10.22514268          0.24618927
  1  1  1  3  1
         40.71344252         -0.03002967
          5.62470907          0.55575255
          2.22799491          0.95581013
  1  1  1  1  1
          0.83354742          1.00000000
  1  2  2  4  1
         88.55431531          0.01272817
         25.72152556          0.07939450
          9.12783676          0.24491507
          3.43123641          0.40390526
  1  2  2  1  1
          1.23089206          1.00000000
  1  2  2  1  1
          0.39031845          1.00000000
  1  1  1  1  1
          0.16245500          1.00000000
# GALLIUM     (17s,12p,6p) -> [6s,5p,2d]
# GALLIUM     (1d)
GA Ahlrichs-pTZV
 14
  1  0  0  8  1
     435548.66254000          0.00023646
      65289.58903100          0.00183353
      14858.78425600          0.00953719
       4205.97347290          0.03880341
       1369.64164310          0.12661605
        492.30348905          0.30175310
        191.41923233          0.43543934
         75.84055867          0.23282364
  1  0  0  4  1
        474.30810613         -0.02674371
        147.10297560         -0.12654658
         23.98259943          0.58840347
         10.29823009          0.56324272
  1  0  0  2  1
         16.05038143         -0.24516440
          2.69884688          0.74578050
  1  0  0  1  1
          1.14285887          1.00000000
  1  0  0  1  1
          0.20217652          1.00000000
  1  0  0  1  1
          0.07198015          1.00000000
  1  1  1  6  1
       2432.01710700          0.00224341
        576.12049582          0.01834227
        185.11584354          0.08727970
         69.24657256          0.25684868
         27.81810778          0.42398378
         11.42022994          0.25701340
  1  1  1  3  1
         42.81966153         -0.01932652
          6.38859010          0.31571387
          2.66989933          0.57617793
  1  1  1  1  1
          1.07817838          1.00000000
  1  1  1  1  1
          0.22796559          1.00000000
  1  1  1  1  1
          0.06283623          1.00000000
  1  2  2  5  1
        103.92331829          0.01146461
         30.37109439          0.07362575
         10.87207810          0.23505107
          4.15491380          0.40318564
          1.53456591          0.40824748
  1  2  2  1  1
          0.51114264          1.00000000
  1  2  2  1  1
          0.20700000          1.00000000
# GERMANIUM   (17s,12p,6p) -> [6s,5p,2d]
# GERMANIUM   (1d)
GE Ahlrichs-pTZV
 14
  1  0  0  8  1
     466115.00592000          0.00022487
      69875.42076200          0.00174354
      15903.27671600          0.00906915
       4501.82334530          0.03690617
       1466.05709240          0.12050168
        527.07841728          0.28748642
        205.00395074          0.41622322
         81.25159607          0.22397846
  1  0  0  4  1
        505.74661282         -0.02518461
        156.96593744         -0.11898930
         25.76144818          0.54930136
         11.10665469          0.52939309
  1  0  0  2  1
         17.27205910         -0.22854596
          2.94382890          0.68377930
  1  0  0  1  1
          1.28391649          1.00000000
  1  0  0  1  1
          0.25873337          1.00000000
  1  0  0  1  1
          0.09352491          1.00000000
  1  1  1  6  1
       2633.93462410          0.00221439
        624.00161628          0.01814090
        200.58528404          0.08663218
         75.09708153          0.25649021
         30.21438847          0.42658611
         12.44008757          0.26200527
  1  1  1  3  1
         45.98131600         -0.02032177
          6.99456544          0.32013745
          2.96860013          0.59051015
  1  1  1  1  1
          1.23209885          1.00000000
  1  1  1  1  1
          0.28981615          1.00000000
  1  1  1  1  1
          0.08556461          1.00000000
  1  2  2  5  1
        119.44887581          0.01058654
         35.06291529          0.06960128
         12.63692453          0.22807035
          4.88886729          0.40301067
          1.84531954          0.41304847
  1  2  2  1  1
          0.63571159          1.00000000
  1  2  2  1  1
          0.24600000          1.00000000
# ARSENIC     (17s,13p,6p) -> [6s,5p,2d]
# ARSENIC     (1d)
AS Ahlrichs-pTZV
 14
  1  0  0  8  1
     498032.42158000          0.00022740
      74656.86874300          0.00176328
      16990.96000400          0.00917280
       4809.62003210          0.03733783
       1566.28870550          0.12199536
        563.21360499          0.29137475
        219.11179978          0.42326351
         86.86606103          0.22921464
  1  0  0  4  1
        538.19512479         -0.02525420
        167.14850224         -0.11915461
         27.60551716          0.54628496
         11.94785852          0.53001521
  1  0  0  2  1
         18.53802313         -0.23479188
          3.20189857          0.69167053
  1  0  0  1  1
          1.43565221          1.00000000
  1  0  0  1  1
          0.31837805          1.00000000
  1  0  0  1  1
          0.11622632          1.00000000
  1  1  1  6  1
       2678.94215460          0.00233190
        634.61765840          0.01904215
        203.93967606          0.09022974
         76.32389037          0.26169038
         30.66412494          0.41857168
         12.50505673          0.23447830
  1  1  1  4  1
         49.25622955         -0.02123554
          7.72748915          0.30470207
          3.54104935          0.52888373
          1.69855855          0.37272251
  1  1  1  1  1
          0.76848071          1.00000000
  1  1  1  1  1
          0.30050823         -0.35023592
  1  1  1  1  1
          0.09819064          1.00000000
  1  2  2  5  1
        135.33289305          0.00992911
         39.86021274          0.06656884
         14.44642836          0.22275768
          5.64329004          0.40309224
          2.16681886          0.41671668
  1  2  2  1  1
          0.76514971          1.00000000
  1  2  2  1  1
          0.29300000          1.00000000
# SELENIUM    (17s,13p,6p) -> [6s,5p,2d]
# SELENIUM    (1d)
SE Ahlrichs-pTZV
 14
  1  0  0  8  1
     531071.66696000          0.00024109
      79603.04411700          0.00186964
      18115.84424000          0.00972716
       5127.89231940          0.03960479
       1669.91308390          0.12948855
        600.57534527          0.30959437
        233.70021247          0.45115769
         92.67244393          0.24579189
  1  0  0  4  1
        571.57513675         -0.02689571
        177.63686375         -0.12670989
         29.51776705          0.57699002
         12.82439979          0.56369075
  1  0  0  2  1
         19.84823584         -0.25132416
          3.47440185          0.72905417
  1  0  0  1  1
          1.59889108          1.00000000
  1  0  0  1  1
          0.38333469          1.00000000
  1  0  0  1  1
          0.14049742          1.00000000
  1  1  1  6  1
       2815.35005660          0.00255690
        666.92558298          0.02087403
        214.34213188          0.09877210
         80.24668794          0.28471821
         32.25108129          0.45003585
         13.10643256          0.24416091
  1  1  1  4  1
         53.36610852         -0.02155846
          8.18277772          0.32662311
          3.62399457          0.57740499
          1.63415914          0.34301321
  1  1  1  1  1
          0.58418320          1.00000000
  1  1  1  1  1
          0.23966269          1.00000000
  1  1  1  1  1
          0.08878513          1.00000000
  1  2  2  5  1
        151.82910279          0.00939703
         44.83999252          0.06408650
         16.32899951          0.21834238
          6.43050576          0.40314790
          2.50480252          0.41966491
  1  2  2  1  1
          0.90271148          1.00000000
  1  2  2  1  1
          0.33800000          1.00000000
# BROMINE     (17s,13p,6p) -> [6s,5p,2d]
# BROMINE     (1d)
BR Ahlrichs-pTZV
 14
  1  0  0  8  1
     565073.25256000          0.00023660
      84701.72317900          0.00183483
      19276.27190000          0.00954658
       5456.42845760          0.03887714
       1776.95035000          0.12718314
        639.19398276          0.30437662
        248.78823961          0.44490940
         98.67830549          0.24381643
  1  0  0  4  1
        606.07824568         -0.02652716
        188.45598484         -0.12484585
         31.49714451          0.56468684
         13.73600832          0.55555269
  1  0  0  2  1
         21.20321277         -0.24940920
          3.76164202          0.71213120
  1  0  0  1  1
          1.77359340          1.00000000
  1  0  0  1  1
          0.45197414          1.00000000
  1  0  0  1  1
          0.16613377          1.00000000
  1  1  1  6  1
       3019.69557230          0.00249710
        715.35481126          0.02041927
        229.98328751          0.09689715
         86.16784462          0.28053901
         34.66787080          0.44606390
         14.11387031          0.24410074
  1  1  1  4  1
         57.08565308         -0.02185595
          8.81938458          0.32707075
          3.93403029          0.57855230
          1.79988304          0.33570988
  1  1  1  1  1
          0.66899411          1.00000000
  1  1  1  1  1
          0.27136238          1.00000000
  1  1  1  1  1
          0.10083790          1.00000000
  1  2  2  5  1
        168.85370257          0.00896640
         49.97794992          0.06206206
         18.27491334          0.21474732
          7.24556946          0.40335337
          2.85623150          0.42208813
  1  2  2  1  1
          1.04596211          1.00000000
  1  2  2  1  1
          0.38900000          1.00000000
# KRYPTON     (17s,13p,6p) -> [6s,5p,2d]
# KRYPTON     (1d)
KR Ahlrichs-pTZV
 14
  1  0  0  8  1
     600250.97575000          0.00023741
      89976.65078100          0.00184102
      20476.81422500          0.00957956
       5796.15540780          0.03902065
       1887.59131960          0.12772646
        679.11458519          0.30596521
        264.38244511          0.44857474
        104.88368574          0.24722957
  1  0  0  4  1
        641.47370764         -0.02674528
        199.57524820         -0.12571123
         33.54546295          0.56483736
         14.68395514          0.55972766
  1  0  0  2  1
         22.60310186         -0.25298772
          4.06506830          0.70992160
  1  0  0  1  1
          1.96110271          1.00000000
  1  0  0  1  1
          0.52465148          1.00000000
  1  0  0  1  1
          0.19332400          1.00000000
  1  1  1  6  1
       3232.95896140          0.00248856
        765.96442694          0.02037901
        246.33940810          0.09697719
         92.36528304          0.28199961
         37.19950955          0.45116254
         15.17216653          0.24917131
  1  1  1  4  1
         60.93132170         -0.02217360
          9.47926006          0.32838463
          4.25646863          0.58124997
          1.97293138          0.32863542
  1  1  1  1  1
          0.76337109          1.00000000
  1  1  1  1  1
          0.30943626          0.55671931
  1  1  1  1  1
          0.11569704          1.00000000
  1  2  2  5  1
        186.41760904          0.00861203
         55.27412435          0.06039441
         20.28321912          0.21181332
          8.08845370          0.40366293
          3.22140339          0.42402861
  1  2  2  1  1
          1.19521701          1.00000000
  1  2  2  1  1
          0.44300000          1.00000000
# BASIS="aug-cc-pVDZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (4s,1p) -> [2s,1p]
# HYDROGEN    Diffuse (1s,1p)
H  aug-cc-pVDZ
  5
  1  0  0  3  1
         13.01000000          0.01968500
          1.96200000          0.13797700
          0.44460000          0.47814800
  1  0  0  1  1
          0.12200000          1.00000000
  1  1  1  1  1
          0.72700000          1.00000000
  1  0  0  1  1
          0.02974000          1.00000000
  1  1  1  1  1
          0.14100000          1.00000000
# HELIUM      (4s,1p) -> [2s,1p]
# HELIUM      Diffuse (1s,1p)
HE aug-cc-pVDZ
  5
  1  0  0  3  1
         38.36000000          0.02380900
          5.77000000          0.15489100
          1.24000000          0.46998700
  1  0  0  1  1
          0.29760000          1.00000000
  1  1  1  1  1
          1.27500000          1.00000000
  1  0  0  1  1
          0.07255000          1.00000000
  1  1  1  1  1
          0.24730000          1.00000000
# BORON       (9s,4p,1d) -> [3s,2p,1d]
# BORON       Diffuse (1s,1p,1d)
B  aug-cc-pVDZ
  8
  1  0  0  8  2
       4570.00000000          0.00069600         -0.00013900
        685.90000000          0.00535300         -0.00109700
        156.50000000          0.02713400         -0.00544400
         44.47000000          0.10138000         -0.02191600
         14.48000000          0.27205500         -0.05975100
          5.13100000          0.44840300         -0.13873200
          1.89800000          0.29012300         -0.13148200
          0.33290000          0.01432200          0.53952600
  1  0  0  1  1
          0.10430000          1.00000000
  1  1  1  3  1
          6.00100000          0.03548100
          1.24100000          0.19807200
          0.33640000          0.50523000
  1  1  1  1  1
          0.09538000          1.00000000
  1  2  2  1  1
          0.34300000          1.00000000
  1  0  0  1  1
          0.03105000          1.00000000
  1  1  1  1  1
          0.02378000          1.00000000
  1  2  2  1  1
          0.09040000          1.00000000
# CARBON      (9s,4p,1d) -> [3s,2p,1d]
# CARBON      Diffuse (1s,1p,1d)
C  aug-cc-pVDZ
  8
  1  0  0  8  2
       6665.00000000          0.00069200         -0.00014600
       1000.00000000          0.00532900         -0.00115400
        228.00000000          0.02707700         -0.00572500
         64.71000000          0.10171800         -0.02331200
         21.06000000          0.27474000         -0.06395500
          7.49500000          0.44856400         -0.14998100
          2.79700000          0.28507400         -0.12726200
          0.52150000          0.01520400          0.54452900
  1  0  0  1  1
          0.15960000          1.00000000
  1  1  1  3  1
          9.43900000          0.03810900
          2.00200000          0.20948000
          0.54560000          0.50855700
  1  1  1  1  1
          0.15170000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  0  0  1  1
          0.04690000          1.00000000
  1  1  1  1  1
          0.04041000          1.00000000
  1  2  2  1  1
          0.15100000          1.00000000
# NITROGEN    (9s,4p,1d) -> [3s,2p,1d]
# NITROGEN    Diffuse (1s,1p,1d)
N  aug-cc-pVDZ
  8
  1  0  0  8  2
       9046.00000000          0.00070000         -0.00015300
       1357.00000000          0.00538900         -0.00120800
        309.30000000          0.02740600         -0.00599200
         87.73000000          0.10320700         -0.02454400
         28.56000000          0.27872300         -0.06745900
         10.21000000          0.44854000         -0.15807800
          3.83800000          0.27823800         -0.12183100
          0.74660000          0.01544000          0.54900300
  1  0  0  1  1
          0.22480000          1.00000000
  1  1  1  3  1
         13.55000000          0.03991900
          2.91700000          0.21716900
          0.79730000          0.51031900
  1  1  1  1  1
          0.21850000          1.00000000
  1  2  2  1  1
          0.81700000          1.00000000
  1  0  0  1  1
          0.06124000          1.00000000
  1  1  1  1  1
          0.05611000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
# OXYGEN      (9s,4p,1d) -> [3s,2p,1d]
# OXYGEN      Diffuse (1s,1p,1d)
O  aug-cc-pVDZ
  8
  1  0  0  8  2
      11720.00000000          0.00071000         -0.00016000
       1759.00000000          0.00547000         -0.00126300
        400.80000000          0.02783700         -0.00626700
        113.70000000          0.10480000         -0.02571600
         37.03000000          0.28306200         -0.07092400
         13.27000000          0.44871900         -0.16541100
          5.02500000          0.27095200         -0.11695500
          1.01300000          0.01545800          0.55736800
  1  0  0  1  1
          0.30230000          1.00000000
  1  1  1  3  1
         17.70000000          0.04301800
          3.85400000          0.22891300
          1.04600000          0.50872800
  1  1  1  1  1
          0.27530000          1.00000000
  1  2  2  1  1
          1.18500000          1.00000000
  1  0  0  1  1
          0.07896000          1.00000000
  1  1  1  1  1
          0.06856000          1.00000000
  1  2  2  1  1
          0.33200000          1.00000000
# FLUORINE    (9s,4p,1d) -> [3s,2p,1d]
# FLUORINE    Diffuse (1s,1p,1d)
F  aug-cc-pVDZ
  8
  1  0  0  8  2
      14710.00000000          0.00072100         -0.00016500
       2207.00000000          0.00555300         -0.00130800
        502.80000000          0.02826700         -0.00649500
        142.60000000          0.10644400         -0.02669100
         46.47000000          0.28681400         -0.07369000
         16.70000000          0.44864100         -0.17077600
          6.35600000          0.26476100         -0.11232700
          1.31600000          0.01533300          0.56281400
  1  0  0  1  1
          0.38970000          1.00000000
  1  1  1  3  1
         22.67000000          0.04487800
          4.97700000          0.23571800
          1.34700000          0.50852100
  1  1  1  1  1
          0.34710000          1.00000000
  1  2  2  1  1
          1.64000000          1.00000000
  1  0  0  1  1
          0.09863000          1.00000000
  1  1  1  1  1
          0.08502000          1.00000000
  1  2  2  1  1
          0.46400000          1.00000000
# NEON        (9s,4p,1d) -> [3s,2p,1d]
# NEON        Diffuse (1s,1p,1d)
NE aug-cc-pVDZ
  8
  1  0  0  8  2
      17880.00000000          0.00073800         -0.00017200
       2683.00000000          0.00567700         -0.00135700
        611.50000000          0.02888300         -0.00673700
        173.50000000          0.10854000         -0.02766300
         56.64000000          0.29090700         -0.07620800
         20.42000000          0.44832400         -0.17522700
          7.81000000          0.25802600         -0.10703800
          1.65300000          0.01506300          0.56705000
  1  0  0  1  1
          0.48690000          1.00000000
  1  1  1  3  1
         28.39000000          0.04608700
          6.27000000          0.24018100
          1.69500000          0.50874400
  1  1  1  1  1
          0.43170000          1.00000000
  1  2  2  1  1
          2.20200000          1.00000000
  1  0  0  1  1
          0.12300000          1.00000000
  1  1  1  1  1
          0.10640000          1.00000000
  1  2  2  1  1
          0.63100000          1.00000000
# ALUMINUM    (12s,8p,1d) -> [4s,3p,1d]
# ALUMINUM    Diffuse (1s,1p,1d)
AL aug-cc-pVDZ
  8
  1  0  0 11  3
      64150.00000000          0.00029025         -0.00007580          0.00001751
       9617.00000000          0.00225064         -0.00058179          0.00013421
       2189.00000000          0.01164590         -0.00308113          0.00071244
        620.50000000          0.04673770         -0.01231120          0.00284330
        202.70000000          0.14629900         -0.04197810          0.00976842
         73.15000000          0.33028300         -0.10337100          0.02418500
         28.55000000          0.41586100         -0.19630800          0.04749930
         11.77000000          0.18925300         -0.08300020          0.02036210
          3.30000000          0.01158890          0.54104000         -0.15878800
          1.17300000         -0.00128385          0.57879600         -0.31169400
          0.17520000          0.00042588          0.02881470          0.62014700
  1  0  0  1  1
          0.06473000          1.00000000
  1  1  1  7  2
        258.80000000          0.00406847         -0.00074805
         60.89000000          0.03068150         -0.00545796
         19.14000000          0.12914900         -0.02453710
          6.88100000          0.32083100         -0.05821380
          2.57400000          0.45381500         -0.09837560
          0.95720000          0.27506600         -0.02600640
          0.20990000          0.01908070          0.46402000
  1  1  1  1  1
          0.05986000          1.00000000
  1  2  2  1  1
          0.18900000          1.00000000
  1  0  0  1  1
          0.02310000          1.00000000
  1  1  1  1  1
          0.01530000          1.00000000
  1  2  2  1  1
          0.05350000          1.00000000
# SILICON     (12s,8p,1d) -> [4s,3p,1d]
# SILICON     Diffuse (1s,1p,1d)
SI aug-cc-pVDZ
  8
  1  0  0 11  3
      78860.00000000          0.00027044         -0.00007232          0.00001851
      11820.00000000          0.00209717         -0.00055512          0.00014224
       2692.00000000          0.01085060         -0.00293805          0.00075219
        763.40000000          0.04367540         -0.01176870          0.00302279
        249.60000000          0.13765300         -0.04029070          0.01036770
         90.28000000          0.31664400         -0.10060900          0.02625630
         35.29000000          0.41858100         -0.19652800          0.05239890
         14.51000000          0.21021200         -0.10238200          0.02909590
          4.05300000          0.01449520          0.52719000         -0.17800300
          1.48200000         -0.00203590          0.59325100         -0.34687400
          0.25170000          0.00062419          0.03326520          0.62302000
  1  0  0  1  1
          0.09243000          1.00000000
  1  1  1  7  2
        315.90000000          0.00392656         -0.00085830
         74.42000000          0.02988110         -0.00630328
         23.48000000          0.12721200         -0.02882550
          8.48800000          0.32094300         -0.06945600
          3.21700000          0.45542900         -0.11949300
          1.22900000          0.26856300         -0.01995810
          0.29640000          0.01883360          0.51026800
  1  1  1  1  1
          0.08768000          1.00000000
  1  2  2  1  1
          0.27500000          1.00000000
  1  0  0  1  1
          0.03320000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  1  1
          0.08230000          1.00000000
# PHOSPHORUS  (12s,8p,1d) -> [4s,3p,1d]
# PHOSPHORUS  Diffuse (1s,1p,1d)
P  aug-cc-pVDZ
  8
  1  0  0 11  3
      94840.00000000          0.00025551         -0.00006969          0.00001912
      14220.00000000          0.00198193         -0.00053527          0.00014722
       3236.00000000          0.01027600         -0.00283709          0.00077791
        917.10000000          0.04148230         -0.01139830          0.00314546
        299.50000000          0.13198400         -0.03929290          0.01082000
        108.10000000          0.30866200         -0.09963640          0.02799570
         42.18000000          0.42064700         -0.19798300          0.05639780
         17.28000000          0.22287800         -0.11486000          0.03581900
          4.85800000          0.01640350          0.51859500         -0.19338700
          1.81800000         -0.00254255          0.60184700         -0.37209700
          0.33720000          0.00074805          0.03686120          0.62424600
  1  0  0  1  1
          0.12320000          1.00000000
  1  1  1  7  2
        370.50000000          0.00395005         -0.00095983
         87.33000000          0.03024920         -0.00711177
         27.59000000          0.12955400         -0.03271220
         10.00000000          0.32759400         -0.07957840
          3.82500000          0.45699200         -0.13501600
          1.49400000          0.25308600         -0.00910585
          0.39210000          0.01687980          0.53780200
  1  1  1  1  1
          0.11860000          1.00000000
  1  2  2  1  1
          0.37300000          1.00000000
  1  0  0  1  1
          0.04170000          1.00000000
  1  1  1  1  1
          0.03430000          1.00000000
  1  2  2  1  1
          0.11300000          1.00000000
# SULFUR      (12s,8p,1d) -> [4s,3p,1d]
# SULFUR      Diffuse (1s,1p,1d)
S  aug-cc-pVDZ
  8
  1  0  0 11  3
     110800.00000000          0.00024764         -0.00006870          0.00001991
      16610.00000000          0.00192026         -0.00052768          0.00015348
       3781.00000000          0.00996192         -0.00279671          0.00080950
       1071.00000000          0.04029750         -0.01126510          0.00328974
        349.80000000          0.12860400         -0.03888340          0.01129670
        126.30000000          0.30348000         -0.09950250          0.02963850
         49.26000000          0.42143200         -0.19974000          0.05998510
         20.16000000          0.23078100         -0.12336000          0.04132480
          5.72000000          0.01789710          0.51319400         -0.20747400
          2.18200000         -0.00297516          0.60712000         -0.39288900
          0.43270000          0.00084952          0.03967530          0.63284000
  1  0  0  1  1
          0.15700000          1.00000000
  1  1  1  7  2
        399.70000000          0.00447541         -0.00116251
         94.19000000          0.03417080         -0.00865664
         29.75000000          0.14425000         -0.03908860
         10.77000000          0.35392800         -0.09346250
          4.11900000          0.45908500         -0.14799400
          1.62500000          0.20638300          0.03019040
          0.47260000          0.01021410          0.56157300
  1  1  1  1  1
          0.14070000          1.00000000
  1  2  2  1  1
          0.47900000          1.00000000
  1  0  0  1  1
          0.05070000          1.00000000
  1  1  1  1  1
          0.03990000          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
# CHLORINE    (12s,8p,1d) -> [4s,3p,1d]
# CHLORINE    Diffuse (1s,1p,1d)
CL aug-cc-pVDZ
  8
  1  0  0 11  3
     127900.00000000          0.00024115         -0.00006789          0.00002050
      19170.00000000          0.00187095         -0.00052184          0.00015830
       4363.00000000          0.00970827         -0.00276513          0.00083364
       1236.00000000          0.03931530         -0.01115370          0.00339880
        403.60000000          0.12593200         -0.03859190          0.01167380
        145.70000000          0.29934100         -0.09948480          0.03096220
         56.81000000          0.42188600         -0.20139200          0.06295330
         23.23000000          0.23720100         -0.13031300          0.04602570
          6.64400000          0.01915310          0.50944300         -0.21931200
          2.57500000         -0.00334792          0.61072500         -0.40877300
          0.53710000          0.00092988          0.04215490          0.63846500
  1  0  0  1  1
          0.19380000          1.00000000
  1  1  1  7  2
        417.60000000          0.00525982         -0.00143570
         98.33000000          0.03983320         -0.01077960
         31.04000000          0.16465500         -0.04700750
         11.19000000          0.38732200         -0.11103000
          4.24900000          0.45707200         -0.15327500
          1.62400000          0.15163600          0.08946090
          0.53220000          0.00181615          0.57944400
  1  1  1  1  1
          0.16200000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  0  0  1  1
          0.06080000          1.00000000
  1  1  1  1  1
          0.04660000          1.00000000
  1  2  2  1  1
          0.19600000          1.00000000
# ARGON       (12s,8p,1d) -> [4s,3p,1d]
# ARGON       Diffuse (1s,1p,1d)
AR aug-cc-pVDZ
  8
  1  0  0 11  3
     145700.00000000          0.00023670         -0.00006749          0.00002105
      21840.00000000          0.00183523         -0.00051852          0.00016257
       4972.00000000          0.00952860         -0.00274825          0.00085546
       1408.00000000          0.03862830         -0.01110070          0.00349745
        459.70000000          0.12408100         -0.03848200          0.01201560
        165.90000000          0.29647100         -0.09975990          0.03213680
         64.69000000          0.42206800         -0.20308800          0.06552790
         26.44000000          0.24171100         -0.13560800          0.04993700
          7.62800000          0.02005090          0.50719500         -0.22976900
          2.99600000         -0.00361000          0.61289800         -0.42100600
          0.65040000          0.00097561          0.04429680          0.64233100
  1  0  0  1  1
          0.23370000          1.00000000
  1  1  1  7  2
        453.70000000          0.00570555         -0.00160655
        106.80000000          0.04304600         -0.01217140
         33.73000000          0.17659100         -0.05207890
         12.13000000          0.40686300         -0.12373700
          4.59400000          0.45254900         -0.15161900
          1.67800000          0.12280100          0.14242500
          0.59090000         -0.00445996          0.58450100
  1  1  1  1  1
          0.18520000          1.00000000
  1  2  2  1  1
          0.73800000          1.00000000
  1  0  0  1  1
          0.07090000          1.00000000
  1  1  1  1  1
          0.05330000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
# GALLIUM     (14s,11p,6d) -> [5s,4p,2d]
# GALLIUM     Diffuse (1s,1p,1d)
GA aug-cc-pVDZ
  9
  1  0  0 13  4
     485130.00000000          0.00020680         -0.00006430          0.00002450         -0.00000570
      72719.00000000          0.00160470         -0.00049540          0.00018950         -0.00004400
      16552.00000000          0.00834020         -0.00262080          0.00099640         -0.00023050
       4687.80000000          0.03402480         -0.01068390          0.00410820         -0.00095440
       1529.10000000          0.11116990         -0.03741230          0.01429380         -0.00330550
        551.81000000          0.27539300         -0.10096360          0.03980340         -0.00928880
        215.18000000          0.42126280         -0.21451410          0.08559400         -0.01986440
         88.17400000          0.27389060         -0.17522970          0.07963050         -0.01908880
         27.15400000          0.02837200          0.48315990         -0.29391070          0.07323560
         11.50300000         -0.00629310          0.63236770         -0.52639140          0.13415260
          3.30180000          0.00206060          0.06849420          0.58642490         -0.18319290
          1.33140000         -0.00092690         -0.01187120          0.67263470         -0.35713080
          0.19316000          0.00022730          0.00266520          0.02761230          0.62460130
  1  0  0  1  1
          0.07089500          1.00000000
  1  1  1 10  3
       3248.60000000          0.00152600         -0.00058030          0.00009500
        769.97000000          0.01274860         -0.00486470          0.00078320
        248.20000000          0.06337420         -0.02483940          0.00408550
         93.36400000          0.20657750         -0.08417590          0.01359870
         38.25100000          0.40929630         -0.18008850          0.03026950
         16.42200000          0.39191830         -0.15855550          0.02417900
          6.79180000          0.10294410          0.23553760         -0.04237770
          2.83360000         -0.00072030          0.58205870         -0.12656610
          1.10620000          0.00209500          0.33666190         -0.04994440
          0.22250000         -0.00032900          0.01719120          0.44941990
  1  1  1  1  1
          0.06177200          1.00000000
  1  2  2  5  1
         65.33700000          0.02738250
         18.49700000          0.15108050
          6.31500000          0.37492170
          2.16350000          0.47507990
          0.66675000          0.29827500
  1  2  2  1  1
          0.18840000          1.00000000
  1  0  0  1  1
          0.02434800          1.00000000
  1  1  1  1  1
          0.01516400          1.00000000
  1  2  2  1  1
          0.05370000          1.00000000
# GERMANIUM   (14s,11p,6d) -> [5s,4p,2d]
# GERMANIUM   Diffuse (1s,1p,1d)
GE aug-cc-pVDZ
  9
  1  0  0 13  4
     521800.00000000          0.00020450         -0.00006380          0.00002460         -0.00000630
      78214.00000000          0.00158680         -0.00049160          0.00019000         -0.00004860
      17803.00000000          0.00824800         -0.00260020          0.00099930         -0.00025530
       5041.90000000          0.03366490         -0.01060800          0.00412000         -0.00105600
       1644.50000000          0.11012490         -0.03716020          0.01435570         -0.00366740
        593.43000000          0.27356070         -0.10057900          0.04003750         -0.01030530
        231.36000000          0.42106700         -0.21439770          0.08657940         -0.02222000
         94.76200000          0.27667910         -0.17826170          0.08158610         -0.02152750
         29.27400000          0.02921800          0.47774040         -0.29347700          0.08067520
         12.45000000         -0.00659030          0.63559830         -0.53679830          0.15249580
          3.64630000          0.00224300          0.07221740          0.56379850         -0.19805280
          1.50250000         -0.00103820         -0.01272650          0.69471820         -0.40739540
          0.24503000          0.00026950          0.00296080          0.03157300          0.64772880
  1  0  0  1  1
          0.09159400          1.00000000
  1  1  1 10  3
       3568.10000000          0.00145910         -0.00056300          0.00011150
        845.72000000          0.01221760         -0.00473540          0.00092120
        272.74000000          0.06104900         -0.02426430          0.00482730
        102.68000000          0.20080390         -0.08309000          0.01622720
         42.14800000          0.40389420         -0.18002470          0.03663540
         18.14900000          0.39700270         -0.16632950          0.03078670
          7.59340000          0.11054810          0.21937170         -0.04806430
          3.19640000          0.00007680          0.58202390         -0.15598040
          1.27430000          0.00212630          0.34777200         -0.06323700
          0.28258000         -0.00037440          0.01924550          0.50408190
  1  1  1  1  1
          0.08409000          1.00000000
  1  2  2  5  1
         74.76200000          0.02576840
         21.30200000          0.14544210
          7.34360000          0.37137210
          2.56510000          0.48000020
          0.81970000          0.28968000
  1  2  2  1  1
          0.24700000          1.00000000
  1  0  0  1  1
          0.03396100          1.00000000
  1  1  1  1  1
          0.02394500          1.00000000
  1  2  2  1  1
          0.07710000          1.00000000
# ARSENIC     (14s,11p,6d) -> [5s,4p,2d]
# ARSENIC     Diffuse (1s,1p,1d)
AS aug-cc-pVDZ
  9
  1  0  0 13  4
     559583.79000000          0.00020240         -0.00006340          0.00002460         -0.00000680
      83879.33000000          0.00157090         -0.00048830          0.00019070         -0.00005250
      19092.66800000          0.00816620         -0.00258210          0.00100310         -0.00027560
       5407.39250000          0.03333990         -0.01054020          0.00413530         -0.00113890
       1763.75590000          0.10917260         -0.03693250          0.01442590         -0.00396460
        636.45672000          0.27188530         -0.10023550          0.04029620         -0.01114230
        248.08843000          0.42085090         -0.21429480          0.08756700         -0.02419910
        101.57851000          0.27922570         -0.18105260          0.08351780         -0.02363390
         31.47551300          0.03003010          0.47254100         -0.29329350          0.08663170
         13.43728200         -0.00688040          0.63861940         -0.54705200          0.16858390
          4.00869000          0.00242400          0.07581070          0.54387380         -0.20914250
          1.68492900         -0.00114910         -0.01352780          0.71435910         -0.45009180
          0.30001900          0.00030950          0.00319700          0.03534430          0.66039780
  1  0  0  1  1
          0.11358700          1.00000000
  1  1  1 10  3
       3886.35640000          0.00140970         -0.00055190          0.00012360
        921.20201000          0.01182770         -0.00465500          0.00102400
        297.19319000          0.05932800         -0.02391760          0.00538050
        111.97508000          0.19651150         -0.08256270          0.01824430
         46.03462100          0.39978910         -0.18067910          0.04159790
         19.87419400          0.40046530         -0.17248480          0.03629980
          8.38608800          0.11641960          0.20867000         -0.05235690
          3.55872800          0.00069180          0.58236220         -0.17916670
          1.44728200          0.00216330          0.35374650         -0.07404770
          0.34777900         -0.00041500          0.02064390          0.53580940
  1  1  1  1  1
          0.10769900          1.00000000
  1  2  2  5  1
         84.42423400          0.02452880
         24.18158900          0.14113400
          8.40177700          0.36875790
          2.98050200          0.48406260
          0.97900300          0.28244340
  1  2  2  1  1
          0.30980000          1.00000000
  1  0  0  1  1
          0.04115200          1.00000000
  1  1  1  1  1
          0.03126800          1.00000000
  1  2  2  1  1
          0.10780000          1.00000000
# SELENIUM    (14s,11p,6d) -> [5s,4p,2d]
# SELENIUM    Diffuse (1s,1p,1d)
SE aug-cc-pVDZ
  9
  1  0  0 13  4
     598990.00000000          0.00020040         -0.00006290          0.00002470         -0.00000720
      89783.00000000          0.00155540         -0.00048500          0.00019130         -0.00005590
      20435.00000000          0.00808720         -0.00256440          0.00100680         -0.00029380
       5786.90000000          0.03303440         -0.01047610          0.00415140         -0.00121360
       1887.30000000          0.10829240         -0.03672230          0.01449910         -0.00423400
        680.97000000          0.27033610         -0.09992250          0.04056580         -0.01190350
        265.39000000          0.42062360         -0.21419730          0.08853640         -0.02602060
        108.63000000          0.28159220         -0.18365930          0.08542120         -0.02561480
         33.76000000          0.03081100          0.46754540         -0.29325810          0.09194270
         14.46500000         -0.00716170          0.64147400         -0.55707270          0.18387000
          4.38900000          0.00260220          0.07925690          0.52614360         -0.21884610
          1.87830000         -0.00125830         -0.01426970          0.73203710         -0.48965240
          0.35859000          0.00034650          0.00337920          0.03882460          0.67758180
  1  0  0  1  1
          0.13649000          1.00000000
  1  1  1 10  3
       4135.60000000          0.00141270         -0.00056100          0.00013660
        980.34000000          0.01185880         -0.00473400          0.00113080
        316.35000000          0.05951530         -0.02435040          0.00595810
        119.25000000          0.19722010         -0.08410710          0.02018660
         49.06800000          0.40074390         -0.18413840          0.04619390
         21.21200000          0.39947400         -0.17350040          0.03940500
          8.94620000          0.11533640          0.21672630         -0.05928460
          3.82360000          0.00022190          0.58500990         -0.20146630
          1.58830000          0.00228380          0.34168160         -0.06878210
          0.40969000         -0.00047560          0.01991250          0.55959440
  1  1  1  1  1
          0.12459000          1.00000000
  1  2  2  5  1
         94.47200000          0.02349820
         27.18000000          0.13751830
          9.50680000          0.36648240
          3.41680000          0.48747170
          1.14790000          0.27657690
  1  2  2  1  1
          0.36820000          1.00000000
  1  0  0  1  1
          0.04874700          1.00000000
  1  1  1  1  1
          0.03549200          1.00000000
  1  2  2  1  1
          0.12830000          1.00000000
# BROMINE     (14s,11p,6d) -> [5s,4p,2d]
# BROMINE     Diffuse (1s,1p,1d)
BR aug-cc-pVDZ
  9
  1  0  0 13  4
     640100.00000000          0.00019840         -0.00006250          0.00002480         -0.00000760
      95938.00000000          0.00154000         -0.00048160          0.00019190         -0.00005880
      21833.00000000          0.00800960         -0.00254660          0.00101000         -0.00030920
       6181.90000000          0.03273410         -0.01041120          0.00416590         -0.00127660
       2015.70000000          0.10744800         -0.03651790          0.01456830         -0.00446340
        727.10000000          0.26889460         -0.09962950          0.04083450         -0.01255750
        283.28000000          0.42044110         -0.21413100          0.08948590         -0.02761450
        115.91000000          0.28380410         -0.18609110          0.08727860         -0.02739450
         36.12400000          0.03154550          0.46282610         -0.29336440          0.09640940
         15.53200000         -0.00742680          0.64411410         -0.56671090          0.19768710
          4.78570000          0.00277280          0.08255020          0.51056580         -0.22666930
          2.08170000         -0.00136350         -0.01496940          0.74772140         -0.52411650
          0.42028000          0.00038120          0.00352880          0.04215120          0.68898650
  1  0  0  1  1
          0.16069000          1.00000000
  1  1  1 10  3
       4340.80000000          0.00144480         -0.00058190          0.00015180
       1028.90000000          0.01212880         -0.00490650          0.00125630
        332.02000000          0.06080770         -0.02525140          0.00662240
        125.16000000          0.20093580         -0.08694450          0.02238160
         51.51100000          0.40474190         -0.18934220          0.05097170
         22.28100000          0.39571510         -0.17108820          0.04140090
          9.34170000          0.11022130          0.23687550         -0.07039700
          4.01320000         -0.00090900          0.58984000         -0.22325400
          1.70020000          0.00248320          0.31719440         -0.05641790
          0.47194000         -0.00057440          0.01798330          0.58080790
  1  1  1  1  1
          0.14421000          1.00000000
  1  2  2  5  1
        104.83000000          0.02265830
         30.27200000          0.13458950
         10.64900000          0.36471810
          3.86960000          0.49041960
          1.32390000          0.27138850
  1  2  2  1  1
          0.40980000          1.00000000
  1  0  0  1  1
          0.05694600          1.00000000
  1  1  1  1  1
          0.04104900          1.00000000
  1  2  2  1  1
          0.17190000          1.00000000
# KRYPTON     (14s,11p,6d) -> [5s,4p,2d]
# KRYPTON     Diffuse (1s,1p,1d)
KR aug-cc-pVDZ
  9
  1  0  0 13  4
     681358.82000000          0.00019690         -0.00006220          0.00002490         -0.00000790
     102126.48000000          0.00152860         -0.00047940          0.00019280         -0.00006140
      23243.71000000          0.00795000         -0.00253410          0.00101490         -0.00032300
       6582.00730000          0.03249380         -0.01036360          0.00418570         -0.00133300
       2146.42860000          0.10672400         -0.03635160          0.01464590         -0.00466720
        774.33782000          0.26757010         -0.09937370          0.04110700         -0.01313520
        301.67020000          0.42018510         -0.21406100          0.09039550         -0.02903420
        123.41184000          0.28580150         -0.18831920          0.08906230         -0.02901730
         38.56755100          0.03224610          0.45838160         -0.29357180          0.10026640
         16.63737900         -0.00768280          0.64656640         -0.57596980          0.21038180
          5.19879500          0.00293930          0.08565790          0.49685780         -0.23324710
          2.29481400         -0.00146620         -0.01561230          0.76168950         -0.55464970
          0.48521100          0.00041440          0.00364900          0.04532670          0.69695220
  1  0  0  1  1
          0.18627000          1.00000000
  1  1  1 10  3
       4474.26990000          0.00151950         -0.00062080          0.00017010
       1060.57900000          0.01274240         -0.00522120          0.00140640
        342.20812000          0.06364650         -0.02684630          0.00739630
        128.99842000          0.20856350         -0.09158230          0.02482540
         53.08722200          0.41224230         -0.19681640          0.05571550
         22.95942500          0.38781030         -0.16347500          0.04121320
          9.50730000          0.10038200          0.27382040         -0.08760570
          4.08305500         -0.00250780          0.59815920         -0.24405860
          1.75044600          0.00271390          0.27504530         -0.02950070
          0.52919000         -0.00069770          0.01277060          0.60122950
  1  1  1  1  1
          0.16436900          1.00000000
  1  2  2  5  1
        115.52532000          0.02195570
         33.46524600          0.13216200
         11.83045900          0.36334840
          4.33977100          0.49295820
          1.50752400          0.26675600
  1  2  2  1  1
          0.50300000          1.00000000
  1  0  0  1  1
          0.06514500          1.00000000
  1  1  1  1  1
          0.04660600          1.00000000
  1  2  2  1  1
          0.21550000          1.00000000
# BASIS="aug-cc-pVTZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (5s,2p,1d) -> [3s,2p,1d]
# HYDROGEN    Diffuse (1s,1p,1d)
H  aug-cc-pVTZ
  9
  1  0  0  3  1
         33.87000000          0.00606800
          5.09500000          0.04530800
          1.15900000          0.20282200
  1  0  0  1  1
          0.32580000          1.00000000
  1  0  0  1  1
          0.10270000          1.00000000
  1  1  1  1  1
          1.40700000          1.00000000
  1  1  1  1  1
          0.38800000          1.00000000
  1  2  2  1  1
          1.05700000          1.00000000
  1  0  0  1  1
          0.02526000          1.00000000
  1  1  1  1  1
          0.10200000          1.00000000
  1  2  2  1  1
          0.24700000          1.00000000
# HELIUM      (6s,2p,1d) -> [3s,2p,1d]
# HELIUM      Diffuse (1s,1p,1d)
HE aug-cc-pVTZ
  9
  1  0  0  4  1
        234.00000000          0.00258700
         35.16000000          0.01953300
          7.98900000          0.09099800
          2.21200000          0.27205000
  1  0  0  1  1
          0.66690000          1.00000000
  1  0  0  1  1
          0.20890000          1.00000000
  1  1  1  1  1
          3.04400000          1.00000000
  1  1  1  1  1
          0.75800000          1.00000000
  1  2  2  1  1
          1.96500000          1.00000000
  1  0  0  1  1
          0.05138000          1.00000000
  1  1  1  1  1
          0.19930000          1.00000000
  1  2  2  1  1
          0.45920000          1.00000000
# BORON       (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# BORON       Diffuse (1s,1p,1d,1f)
B  aug-cc-pVTZ
 13
  1  0  0  8  2
       5473.00000000          0.00055500         -0.00011200
        820.90000000          0.00429100         -0.00086800
        186.80000000          0.02194900         -0.00448400
         52.83000000          0.08444100         -0.01768300
         17.08000000          0.23855700         -0.05363900
          5.99900000          0.43507200         -0.11900500
          2.20800000          0.34195500         -0.16582400
          0.24150000         -0.00954500          0.59598100
  1  0  0  1  1
          0.58790000          1.00000000
  1  0  0  1  1
          0.08610000          1.00000000
  1  1  1  3  1
         12.05000000          0.01311800
          2.61300000          0.07989600
          0.74750000          0.27727500
  1  1  1  1  1
          0.23850000          1.00000000
  1  1  1  1  1
          0.07698000          1.00000000
  1  2  2  1  1
          0.66100000          1.00000000
  1  2  2  1  1
          0.19900000          1.00000000
  1  3  3  1  1
          0.49000000          1.00000000
  1  0  0  1  1
          0.02914000          1.00000000
  1  1  1  1  1
          0.02096000          1.00000000
  1  2  2  1  1
          0.06040000          1.00000000
  1  3  3  1  1
          0.16300000          1.00000000
# CARBON      (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# CARBON      Diffuse (1s,1p,1d,1f)
C  aug-cc-pVTZ
 13
  1  0  0  8  2
       8236.00000000          0.00053100         -0.00011300
       1235.00000000          0.00410800         -0.00087800
        280.80000000          0.02108700         -0.00454000
         79.27000000          0.08185300         -0.01813300
         25.59000000          0.23481700         -0.05576000
          8.99700000          0.43440100         -0.12689500
          3.31900000          0.34612900         -0.17035200
          0.36430000         -0.00898300          0.59868400
  1  0  0  1  1
          0.90590000          1.00000000
  1  0  0  1  1
          0.12850000          1.00000000
  1  1  1  3  1
         18.71000000          0.01403100
          4.13300000          0.08686600
          1.20000000          0.29021600
  1  1  1  1  1
          0.38270000          1.00000000
  1  1  1  1  1
          0.12090000          1.00000000
  1  2  2  1  1
          1.09700000          1.00000000
  1  2  2  1  1
          0.31800000          1.00000000
  1  3  3  1  1
          0.76100000          1.00000000
  1  0  0  1  1
          0.04402000          1.00000000
  1  1  1  1  1
          0.03569000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          0.26800000          1.00000000
# NITROGEN    (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# NITROGEN    Diffuse (1s,1p,1d,1f)
N  aug-cc-pVTZ
 13
  1  0  0  8  2
      11420.00000000          0.00052300         -0.00011500
       1712.00000000          0.00404500         -0.00089500
        389.30000000          0.02077500         -0.00462400
        110.00000000          0.08072700         -0.01852800
         35.57000000          0.23307400         -0.05733900
         12.54000000          0.43350100         -0.13207600
          4.64400000          0.34747200         -0.17251000
          0.51180000         -0.00850800          0.59994400
  1  0  0  1  1
          1.29300000          1.00000000
  1  0  0  1  1
          0.17870000          1.00000000
  1  1  1  3  1
         26.63000000          0.01467000
          5.94800000          0.09176400
          1.74200000          0.29868300
  1  1  1  1  1
          0.55500000          1.00000000
  1  1  1  1  1
          0.17250000          1.00000000
  1  2  2  1  1
          1.65400000          1.00000000
  1  2  2  1  1
          0.46900000          1.00000000
  1  3  3  1  1
          1.09300000          1.00000000
  1  0  0  1  1
          0.05760000          1.00000000
  1  1  1  1  1
          0.04910000          1.00000000
  1  2  2  1  1
          0.15100000          1.00000000
  1  3  3  1  1
          0.36400000          1.00000000
# OXYGEN      (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# OXYGEN      Diffuse (1s,1p,1d,1f)
O  aug-cc-pVTZ
 13
  1  0  0  8  2
      15330.00000000          0.00050800         -0.00011500
       2299.00000000          0.00392900         -0.00089500
        522.40000000          0.02024300         -0.00463600
        147.30000000          0.07918100         -0.01872400
         47.55000000          0.23068700         -0.05846300
         16.76000000          0.43311800         -0.13646300
          6.20700000          0.35026000         -0.17574000
          0.68820000         -0.00815400          0.60341800
  1  0  0  1  1
          1.75200000          1.00000000
  1  0  0  1  1
          0.23840000          1.00000000
  1  1  1  3  1
         34.46000000          0.01592800
          7.74900000          0.09974000
          2.28000000          0.31049200
  1  1  1  1  1
          0.71560000          1.00000000
  1  1  1  1  1
          0.21400000          1.00000000
  1  2  2  1  1
          2.31400000          1.00000000
  1  2  2  1  1
          0.64500000          1.00000000
  1  3  3  1  1
          1.42800000          1.00000000
  1  0  0  1  1
          0.07376000          1.00000000
  1  1  1  1  1
          0.05974000          1.00000000
  1  2  2  1  1
          0.21400000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
# FLUORINE    (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# FLUORINE    Diffuse (1s,1p,1d,1f)
F  aug-cc-pVTZ
 13
  1  0  0  8  2
      19500.00000000          0.00050700         -0.00011700
       2923.00000000          0.00392300         -0.00091200
        664.50000000          0.02020000         -0.00471700
        187.50000000          0.07901000         -0.01908600
         60.62000000          0.23043900         -0.05965500
         21.42000000          0.43287200         -0.14001000
          7.95000000          0.34996400         -0.17678200
          0.88150000         -0.00789200          0.60504300
  1  0  0  1  1
          2.25700000          1.00000000
  1  0  0  1  1
          0.30410000          1.00000000
  1  1  1  3  1
         43.88000000          0.01666500
          9.92600000          0.10447200
          2.93000000          0.31726000
  1  1  1  1  1
          0.91320000          1.00000000
  1  1  1  1  1
          0.26720000          1.00000000
  1  2  2  1  1
          3.10700000          1.00000000
  1  2  2  1  1
          0.85500000          1.00000000
  1  3  3  1  1
          1.91700000          1.00000000
  1  0  0  1  1
          0.09158000          1.00000000
  1  1  1  1  1
          0.07361000          1.00000000
  1  2  2  1  1
          0.29200000          1.00000000
  1  3  3  1  1
          0.72400000          1.00000000
# NEON        (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# NEON        Diffuse (1s,1p,1d,1f)
NE aug-cc-pVTZ
 13
  1  0  0  8  2
      24350.00000000          0.00050200         -0.00011800
       3650.00000000          0.00388100         -0.00091500
        829.60000000          0.01999700         -0.00473700
        234.00000000          0.07841800         -0.01923300
         75.61000000          0.22967600         -0.06036900
         26.73000000          0.43272200         -0.14250800
          9.92700000          0.35064200         -0.17771000
          1.10200000         -0.00764500          0.60583600
  1  0  0  1  1
          2.83600000          1.00000000
  1  0  0  1  1
          0.37820000          1.00000000
  1  1  1  3  1
         54.70000000          0.01715100
         12.43000000          0.10765600
          3.67900000          0.32168100
  1  1  1  1  1
          1.14300000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          4.01400000          1.00000000
  1  2  2  1  1
          1.09600000          1.00000000
  1  3  3  1  1
          2.54400000          1.00000000
  1  0  0  1  1
          0.11330000          1.00000000
  1  1  1  1  1
          0.09175000          1.00000000
  1  2  2  1  1
          0.38600000          1.00000000
  1  3  3  1  1
          1.08400000          1.00000000
# ALUMINUM    (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# ALUMINUM    Diffuse (1s,1p,1d,1f)
AL aug-cc-pVTZ
 13
  1  0  0 13  3
     205500.00000000          0.00006788         -0.00001764          0.00000407
      30780.00000000          0.00052715         -0.00013720          0.00003166
       7006.00000000          0.00276203         -0.00071891          0.00016612
       1985.00000000          0.01147280         -0.00301146          0.00069499
        649.10000000          0.03981880         -0.01060140          0.00245511
        235.00000000          0.11504000         -0.03213450          0.00744598
         91.62000000          0.26088700         -0.08031560          0.01882530
         37.67000000          0.39638600         -0.15679400          0.03727720
         15.91000000          0.28459700         -0.16837600          0.04194960
          5.85000000          0.04445830          0.12687900         -0.03543750
          2.54200000         -0.00489838          0.56149400         -0.17513200
          1.05700000          0.00261253          0.43661300         -0.27620300
          0.14550000          0.00072207         -0.01145630          0.65280900
  1  0  0  1  1
          0.29310000          1.00000000
  1  0  0  1  1
          0.05650000          1.00000000
  1  1  1  7  2
        444.40000000          0.00162786         -0.00028634
        105.10000000          0.01306870         -0.00242308
         33.47000000          0.06123410         -0.01086580
         12.33000000          0.18787000         -0.03643070
          4.86900000          0.36045200         -0.06410740
          1.96100000          0.40845400         -0.09722390
          0.18880000          0.00976514          0.50344800
  1  1  1  1  1
          0.78340000          1.00000000
  1  1  1  1  1
          0.05557000          1.00000000
  1  2  2  1  1
          0.10900000          1.00000000
  1  2  2  1  1
          0.33300000          1.00000000
  1  3  3  1  1
          0.24400000          1.00000000
  1  0  0  1  1
          0.02210000          1.00000000
  1  1  1  1  1
          0.01460000          1.00000000
  1  2  2  1  1
          0.03560000          1.00000000
  1  3  3  1  1
          0.08580000          1.00000000
# SILICON     (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# SILICON     Diffuse (1s,1p,1d,1f)
SI aug-cc-pVTZ
 13
  1  0  0 13  3
     254900.00000000          0.00006251         -0.00001664          0.00000426
      38190.00000000          0.00048555         -0.00012931          0.00003311
       8690.00000000          0.00254516         -0.00067883          0.00017402
       2462.00000000          0.01058660         -0.00284117          0.00072757
        804.80000000          0.03687870         -0.01005510          0.00258333
        291.30000000          0.10747900         -0.03057740          0.00786354
        113.60000000          0.24793600         -0.07772560          0.02021550
         46.75000000          0.39092700         -0.15423600          0.04073200
         19.82000000          0.30202600         -0.18036800          0.04993580
          7.70800000          0.05592360          0.07982180         -0.02493960
          3.34000000         -0.00402406          0.54744100         -0.19035000
          1.40200000          0.00258030          0.48011900         -0.31835000
          0.20700000          0.00060793         -0.01069960          0.68118000
  1  0  0  1  1
          0.43870000          1.00000000
  1  0  0  1  1
          0.07944000          1.00000000
  1  1  1  7  2
        481.50000000          0.00192045         -0.00040522
        113.90000000          0.01535520         -0.00335896
         36.23000000          0.07139910         -0.01528600
         13.34000000          0.21305200         -0.04892180
          5.25200000          0.39035400         -0.08550080
          2.12000000          0.39372100         -0.11213700
          0.25280000          0.00395630          0.55191900
  1  1  1  1  1
          0.85610000          1.00000000
  1  1  1  1  1
          0.07889000          1.00000000
  1  2  2  1  1
          0.15900000          1.00000000
  1  2  2  1  1
          0.48100000          1.00000000
  1  3  3  1  1
          0.33600000          1.00000000
  1  0  0  1  1
          0.03300000          1.00000000
  1  1  1  1  1
          0.02370000          1.00000000
  1  2  2  1  1
          0.05560000          1.00000000
  1  3  3  1  1
          0.12500000          1.00000000
# PHOSPHORUS  (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# PHOSPHORUS  Diffuse (1s,1p,1d,1f)
P  aug-cc-pVTZ
 13
  1  0  0 13  3
     312400.00000000          0.00005770         -0.00001567          0.00000431
      46800.00000000          0.00044830         -0.00012172          0.00003342
      10650.00000000          0.00234939         -0.00063967          0.00017589
       3018.00000000          0.00978265         -0.00267426          0.00073434
        986.80000000          0.03414670         -0.00949831          0.00261775
        357.40000000          0.10020400         -0.02893490          0.00797852
        139.60000000          0.23437200         -0.07451210          0.02079400
         57.63000000          0.38243400         -0.14993800          0.04244460
         24.60000000          0.31808800         -0.18946700          0.05634360
         10.12000000          0.07077880          0.03632700         -0.01273580
          4.28300000         -0.00181799          0.52881600         -0.19649500
          1.80500000          0.00216180          0.51911500         -0.35355500
          0.27820000          0.00043230         -0.00925695          0.70091200
  1  0  0  1  1
          0.61580000          1.00000000
  1  0  0  1  1
          0.10550000          1.00000000
  1  1  1  7  2
        504.90000000          0.00233728         -0.00055524
        119.40000000          0.01854100         -0.00445913
         37.96000000          0.08496930         -0.02063500
         13.95000000          0.24461500         -0.06176940
          5.45700000          0.42276600         -0.10892400
          2.17700000          0.36843900         -0.10559900
          0.28770000         -0.00379005          0.57698100
  1  1  1  1  1
          0.80100000          1.00000000
  1  1  1  1  1
          0.09714000          1.00000000
  1  2  2  1  1
          0.21600000          1.00000000
  1  2  2  1  1
          0.65200000          1.00000000
  1  3  3  1  1
          0.45200000          1.00000000
  1  0  0  1  1
          0.04090000          1.00000000
  1  1  1  1  1
          0.03070000          1.00000000
  1  2  2  1  1
          0.07750000          1.00000000
  1  3  3  1  1
          0.16500000          1.00000000
# SULFUR      (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# SULFUR      Diffuse (1s,1p,1d,1f)
S  aug-cc-pVTZ
 13
  1  0  0 13  3
     374100.00000000          0.00005421         -0.00001498          0.00000435
      56050.00000000          0.00042086         -0.00011620          0.00003371
      12760.00000000          0.00220698         -0.00061158          0.00017767
       3615.00000000          0.00919258         -0.00255370          0.00074112
       1183.00000000          0.03211230         -0.00908708          0.00264591
        428.80000000          0.09466830         -0.02770450          0.00807487
        167.80000000          0.22363000         -0.07200200          0.02122760
         69.47000000          0.37439300         -0.14643900          0.04383230
         29.84000000          0.32910800         -0.19515000          0.06127160
         12.72000000          0.08470380          0.00819193         -0.00361510
          5.24400000          0.00044085          0.51660100         -0.20451000
          2.21900000          0.00164827          0.54217800         -0.38187100
          0.34900000          0.00030131         -0.00918072          0.71414700
  1  0  0  1  1
          0.77670000          1.00000000
  1  0  0  1  1
          0.13220000          1.00000000
  1  1  1  7  2
        574.40000000          0.00242264         -0.00062010
        135.80000000          0.01927960         -0.00493882
         43.19000000          0.08854010         -0.02326470
         15.87000000          0.25465400         -0.06851950
          6.20800000          0.43398400         -0.12389600
          2.48300000          0.35495300         -0.09694990
          0.32290000         -0.00502977          0.56939400
  1  1  1  1  1
          0.86880000          1.00000000
  1  1  1  1  1
          0.10980000          1.00000000
  1  2  2  1  1
          0.26900000          1.00000000
  1  2  2  1  1
          0.81900000          1.00000000
  1  3  3  1  1
          0.55700000          1.00000000
  1  0  0  1  1
          0.04970000          1.00000000
  1  1  1  1  1
          0.03510000          1.00000000
  1  2  2  1  1
          0.10100000          1.00000000
  1  3  3  1  1
          0.21800000          1.00000000
# CHLORINE    (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# CHLORINE    Diffuse (1s,1p,1d,1f)
CL aug-cc-pVTZ
 13
  1  0  0 13  3
     456100.00000000          0.00004930         -0.00001383          0.00000419
      68330.00000000          0.00038303         -0.00010728          0.00003244
      15550.00000000          0.00200854         -0.00056508          0.00017111
       4405.00000000          0.00838558         -0.00236135          0.00071418
       1439.00000000          0.02947030         -0.00845886          0.00256705
        520.40000000          0.08783250         -0.02596380          0.00788552
        203.10000000          0.21147300         -0.06863620          0.02108670
         83.96000000          0.36536400         -0.14187400          0.04422640
         36.20000000          0.34088400         -0.19931900          0.06516700
         15.83000000          0.10213300         -0.01956620          0.00603012
          6.33400000          0.00311675          0.49974100         -0.20649500
          2.69400000          0.00105751          0.56373600         -0.40587100
          0.43130000          0.00015614         -0.00835091          0.72566100
  1  0  0  1  1
          0.97680000          1.00000000
  1  0  0  1  1
          0.16250000          1.00000000
  1  1  1  7  2
        663.30000000          0.00240448         -0.00065215
        156.80000000          0.01921480         -0.00519445
         49.98000000          0.08850970         -0.02469380
         18.42000000          0.25602000         -0.07281670
          7.24000000          0.43692700         -0.13403000
          2.92200000          0.35033400         -0.09477420
          0.38180000         -0.00458423          0.56466700
  1  1  1  1  1
          1.02200000          1.00000000
  1  1  1  1  1
          0.13010000          1.00000000
  1  2  2  1  1
          1.04600000          1.00000000
  1  2  2  1  1
          0.34400000          1.00000000
  1  3  3  1  1
          0.70600000          1.00000000
  1  0  0  1  1
          0.05910000          1.00000000
  1  1  1  1  1
          0.04190000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  3  3  1  1
          0.31200000          1.00000000
# ARGON       (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# ARGON       Diffuse (1s,1p,1d,1f)
AR aug-cc-pVTZ
 13
  1  0  0 13  3
     545000.00000000          0.00004558         -0.00001296          0.00000405
      81640.00000000          0.00035411         -0.00010043          0.00003137
      18580.00000000          0.00185797         -0.00052958          0.00016565
       5261.00000000          0.00776851         -0.00221396          0.00069166
       1717.00000000          0.02742320         -0.00796845          0.00249790
        619.90000000          0.08238360         -0.02458030          0.00771074
        241.60000000          0.20123000         -0.06577980          0.02087140
         99.79000000          0.35678100         -0.13794200          0.04439650
         43.15000000          0.34956300         -0.20163000          0.06802240
         19.14000000          0.11826600         -0.04128340          0.01413500
          7.48800000          0.00560190          0.48468000         -0.20748900
          3.20500000          0.00048347          0.57922400         -0.42504500
          0.52040000          0.00002920         -0.00727553          0.73362700
  1  0  0  1  1
          1.19600000          1.00000000
  1  0  0  1  1
          0.19540000          1.00000000
  1  1  1  7  2
        761.80000000          0.00236976         -0.00066721
        180.20000000          0.01901990         -0.00532717
         57.50000000          0.08808070         -0.02554940
         21.24000000          0.25637700         -0.07571970
          8.38800000          0.43871100         -0.14113300
          3.41600000          0.34756900         -0.09327680
          0.45230000         -0.00523882          0.56245000
  1  1  1  1  1
          1.20600000          1.00000000
  1  1  1  1  1
          0.15450000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          1.25400000          1.00000000
  1  3  3  1  1
          0.89000000          1.00000000
  1  0  0  1  1
          0.06850000          1.00000000
  1  1  1  1  1
          0.04870000          1.00000000
  1  2  2  1  1
          0.16900000          1.00000000
  1  3  3  1  1
          0.40600000          1.00000000
# GALLIUM     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# GALLIUM     Diffuse (1s,1p,1d,1f)
GA aug-cc-pVTZ
 14
  1  0  0 18  4
    6558157.30000000          0.00000800         -0.00000250          0.00000000          0.00000000
     982025.34000000          0.00006220         -0.00001930          0.00000740          0.00000170
     223467.69000000          0.00032700         -0.00010140          0.00003870          0.00000900
      63288.29100000          0.00137940         -0.00042810          0.00016330          0.00003800
      20642.94000000          0.00499930         -0.00155820          0.00059440          0.00013820
       7450.52240000          0.01606050         -0.00504690          0.00192920          0.00044890
       2905.07440000          0.04601240         -0.01480560          0.00566890          0.00131880
       1204.21000000          0.11522240         -0.03894820          0.01502820          0.00350160
        524.30454000          0.23739210         -0.08968320          0.03502220          0.00816730
        237.46563000          0.35319890         -0.16640760          0.06711350          0.01573380
        110.57866000          0.29155000         -0.20040100          0.08501560          0.02002840
         51.37462400          0.08121290          0.01149430         -0.00472120         -0.00101360
         24.44084600          0.00076550          0.49581340         -0.30167370         -0.07501620
         11.76859100          0.00161240          0.52955500         -0.48254890         -0.12579800
          5.34211900         -0.00075300          0.11101850          0.08916950          0.03008570
          2.49503600          0.00031340         -0.00070000          0.72878300          0.24881690
          1.09877300         -0.00013060          0.00222830          0.42885420          0.28437060
          0.26018000          0.00005130         -0.00050140          0.02072490         -0.31105940
  1  0  0  1  1
          0.12707900          1.00000000
  1  0  0  1  1
          0.05440800          1.00000000
  1  1  1 11  3
       8050.16740000          0.00031690         -0.00012030          0.00002000
       1907.53610000          0.00276480         -0.00104920          0.00016890
        618.62746000          0.01512040         -0.00581020          0.00096680
        235.32417000          0.05995830         -0.02343450          0.00377970
         98.89964600          0.17331200         -0.07082700          0.01190820
         44.24821500          0.34108200         -0.14655110          0.02356930
         20.61742900          0.38969670         -0.17696600          0.03142330
          9.78051600          0.18398170          0.03638210         -0.01361880
          4.44123800          0.02188960          0.42328480         -0.07340030
          1.96404500          0.00116080          0.49525860         -0.12647850
          0.83357800          0.00027350          0.17974280          0.01585790
  1  1  1  1  1
          0.19344500          1.00000000
  1  1  1  1  1
          0.05611700          1.00000000
  1  2  2  7  1
        244.14741000          0.00202700
         73.06759500          0.01650880
         27.59208100          0.07038230
         11.54651800          0.19114300
          5.04862800          0.32540920
          2.17846500          0.36781990
          0.90025300          0.27446850
  1  2  2  1  1
          0.33732700          1.00000000
  1  2  2  1  1
          0.11690000          1.00000000
  1  3  3  1  1
          0.28810000          1.00000000
  1  0  0  1  1
          0.01439800          1.00000000
  1  1  1  1  1
          0.01930000          1.00000000
  1  2  2  1  1
          0.03870000          1.00000000
  1  3  3  1  1
          0.09800000          1.00000000
# GERMANIUM   (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# GERMANIUM   Diffuse (1s,1p,1d,1f)
GE aug-cc-pVTZ
 14
  1  0  0 18  4
    7447966.80000000          0.00000740         -0.00000230          0.00000000          0.00000000
    1115318.20000000          0.00005740         -0.00001790          0.00000690         -0.00000180
     253842.65000000          0.00030190         -0.00009400          0.00003620         -0.00000930
      71915.28500000          0.00127330         -0.00039640          0.00015280         -0.00003920
      23470.18100000          0.00461230         -0.00144250          0.00055630         -0.00014260
       8477.49180000          0.01482140         -0.00466750          0.00180180         -0.00046210
       3308.39080000          0.04255360         -0.01371530          0.00530850         -0.00136140
       1372.60540000          0.10730550         -0.03617970          0.01408770         -0.00361750
        598.22007000          0.22451780         -0.08416790          0.03320130         -0.00853590
        271.38602000          0.34531310         -0.15887670          0.06446210         -0.01665060
        126.97795000          0.30452610         -0.20338070          0.08695400         -0.02259110
         60.22206500          0.09906700         -0.02514100          0.01187450         -0.00321470
         28.01858200          0.00413170          0.45751520         -0.27245340          0.07449980
         13.51752200          0.00103470          0.55719390         -0.50014520          0.14403330
          6.30940600         -0.00048560          0.13970550          0.01085540         -0.00808150
          2.90453400          0.00018050          0.00226450          0.72164690         -0.27041630
          1.28755600         -0.00009120          0.00209270          0.48052130         -0.34016070
          0.16773200         -0.00002660          0.00032810         -0.01022970          0.61906570
  1  0  0  1  1
          0.33655200          1.00000000
  1  0  0  1  1
          0.07106900          1.00000000
  1  1  1 11  3
       6979.59820000          0.00045690         -0.00017560          0.00003480
       1654.16480000          0.00395620         -0.00153050          0.00030140
        536.02865000          0.02131430         -0.00831450          0.00164870
        203.53713000          0.08187150         -0.03287180          0.00649820
         85.23753000          0.22237320         -0.09316610          0.01863830
         37.84196200          0.39056590         -0.17555420          0.03506130
         17.40651200          0.35604150         -0.14679120          0.02958920
          7.88149200          0.10703120          0.18629340         -0.04724580
          3.53321300          0.00369410          0.52648620         -0.12498470
          1.52147300          0.00192190          0.39708590         -0.12108010
          0.19909300          0.00019170         -0.00334780          0.57547300
  1  1  1  1  1
          0.56270400          1.00000000
  1  1  1  1  1
          0.06703100          1.00000000
  1  2  2  7  1
        282.23911000          0.00182750
         84.54995700          0.01515450
         32.07365600          0.06604600
         13.49749500          0.18394700
          5.95855000          0.32278720
          2.61078800          0.37294590
          1.10398700          0.27517300
  1  2  2  1  1
          0.42404900          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
  1  3  3  1  1
          0.34580000          1.00000000
  1  0  0  1  1
          0.02737000          1.00000000
  1  1  1  1  1
          0.02136800          1.00000000
  1  2  2  1  1
          0.05280000          1.00000000
  1  3  3  1  1
          0.13230000          1.00000000
# ARSENIC     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# ARSENIC     Diffuse (1s,1p,1d,1f)
AS aug-cc-pVTZ
 14
  1  0  0 18  4
    8482339.60000000          0.00000680         -0.00000210          0.00000000          0.00000000
    1270150.90000000          0.00005280         -0.00001650          0.00000640         -0.00000180
     289056.96000000          0.00027740         -0.00008660          0.00003370         -0.00000930
      81879.84900000          0.00117020         -0.00036530          0.00014230         -0.00003920
      26716.56400000          0.00424210         -0.00133090          0.00051880         -0.00014290
       9647.58420000          0.01365570         -0.00430930          0.00168020         -0.00046290
       3764.11950000          0.03933990         -0.01269730          0.00496770         -0.00136870
       1561.56560000          0.09992920         -0.03361600          0.01321150         -0.00364400
        680.81467000          0.21215550         -0.07894700          0.03145660         -0.00868840
        309.24119000          0.33638660         -0.15144580          0.06184460         -0.01715560
        145.25736000          0.31551250         -0.20420140          0.08795660         -0.02455140
         69.73904800          0.11813120         -0.05573670          0.02575480         -0.00735240
         31.77032500          0.00800760          0.41876070         -0.24554590          0.07200870
         15.39175700          0.00032930          0.57587620         -0.50905720          0.15762540
          7.34152600         -0.00015230          0.16968420         -0.05557490          0.01420740
          3.32371600          0.00002470          0.00606620          0.70837960         -0.28515930
          1.48586700         -0.00003660          0.00176050          0.52310270         -0.38853470
          0.21150000         -0.00000940          0.00023160         -0.01111760          0.64953370
  1  0  0  1  1
          0.42108600          1.00000000
  1  0  0  1  1
          0.08897400          1.00000000
  1  1  1 11  3
       7423.86140000          0.00045990         -0.00017940          0.00003990
       1759.51660000          0.00398230         -0.00156410          0.00034880
        570.22916000          0.02146380         -0.00849990          0.00189530
        216.57997000          0.08246170         -0.03363270          0.00753250
         90.73425200          0.22389020         -0.09532280          0.02143150
         40.30879100          0.39207040         -0.17936260          0.04078070
         18.55550200          0.35422380         -0.14666820          0.03252490
          8.39654300          0.10486410          0.19660160         -0.05488320
          3.76736700          0.00336640          0.53720880         -0.15119220
          1.62970100          0.00184950          0.38573610         -0.12490110
          0.22250300          0.00022970         -0.00540060          0.58552930
  1  1  1  1  1
          0.56826300          1.00000000
  1  1  1  1  1
          0.08040500          1.00000000
  1  2  2  7  1
        321.01961000          0.00168400
         96.24930500          0.01415860
         36.64496300          0.06282590
         15.49396500          0.17849930
          6.89113800          0.32094520
          3.05483100          0.37735150
          1.31424100          0.27502310
  1  2  2  1  1
          0.51343000          1.00000000
  1  2  2  1  1
          0.18770000          1.00000000
  1  3  3  1  1
          0.41580000          1.00000000
  1  0  0  1  1
          0.03340700          1.00000000
  1  1  1  1  1
          0.02679900          1.00000000
  1  2  2  1  1
          0.07000000          1.00000000
  1  3  3  1  1
          0.16900000          1.00000000
# SELENIUM    (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# SELENIUM    Diffuse (1s,1p,1d,1f)
SE aug-cc-pVTZ
 14
  1  0  0 18  4
    9563600.00000000          0.00000630         -0.00000200          0.00000000          0.00000000
    1432100.00000000          0.00004890         -0.00001530          0.00000600         -0.00000180
     325910.00000000          0.00025740         -0.00008060          0.00003170         -0.00000930
      92312.00000000          0.00108610         -0.00034000          0.00013370         -0.00003910
      30116.00000000          0.00393990         -0.00123970          0.00048830         -0.00014280
      10872.00000000          0.01270410         -0.00401770          0.00158210         -0.00046270
       4240.10000000          0.03671560         -0.01186720          0.00469190         -0.00137220
       1758.40000000          0.09386720         -0.03153400          0.01250980         -0.00366280
        766.59000000          0.20176770         -0.07464390          0.03003810         -0.00880610
        348.43000000          0.32805400         -0.14521790          0.05972710         -0.01758670
        164.03000000          0.32383340         -0.20384410          0.08846960         -0.02620740
         79.14200000          0.13523370         -0.07887110          0.03639200         -0.01099640
         35.52400000          0.01170750          0.38458250         -0.22353290          0.06956970
         17.30500000         -0.00034360          0.58652700         -0.51224620          0.16839470
          8.37840000          0.00016650          0.19735910         -0.10842240          0.03461600
          3.74050000         -0.00011880          0.01001020          0.69363720         -0.29787020
          1.68900000          0.00002040          0.00131600          0.55587110         -0.43225690
          0.25520000          0.00000830          0.00011090         -0.01138320          0.67572170
  1  0  0  1  1
          0.50927000          1.00000000
  1  0  0  1  1
          0.10651000          1.00000000
  1  1  1 11  3
       8004.30000000          0.00045050         -0.00017830          0.00004300
       1896.90000000          0.00390490         -0.00155540          0.00037700
        614.71000000          0.02109010         -0.00847270          0.00204650
        233.50000000          0.08129200         -0.03362450          0.00818990
         97.85600000          0.22178410         -0.09582670          0.02333560
         43.51400000          0.39072700         -0.18139070          0.04498130
         20.06300000          0.35597140         -0.15031520          0.03574750
          9.11270000          0.10732720          0.19482630         -0.05868660
          4.10630000          0.00369850          0.54155540         -0.17095730
          1.79490000          0.00180320          0.38372990         -0.12935830
          0.24615000          0.00022080         -0.00501320          0.57780690
  1  1  1  1  1
          0.62432000          1.00000000
  1  1  1  1  1
          0.08891700          1.00000000
  1  2  2  7  1
        361.85000000          0.00156550
        108.55000000          0.01332620
         41.43300000          0.06015270
         17.57900000          0.17402930
          7.86270000          0.31956900
          3.51800000          0.38120290
          1.53480000          0.27460860
  1  2  2  1  1
          0.60813000          1.00000000
  1  2  2  1  1
          0.22200000          1.00000000
  1  3  3  1  1
          0.46200000          1.00000000
  1  0  0  1  1
          0.03920100          1.00000000
  1  1  1  1  1
          0.03025100          1.00000000
  1  2  2  1  1
          0.08370000          1.00000000
  1  3  3  1  1
          0.18800000          1.00000000
# BROMINE     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# BROMINE     Diffuse (1s,1p,1d,1f)
BR aug-cc-pVTZ
 14
  1  0  0 18  4
   10639000.00000000          0.00000590         -0.00000190          0.00000000          0.00000000
    1593400.00000000          0.00004610         -0.00001450          0.00000570         -0.00000180
     362610.00000000          0.00024220         -0.00007610          0.00003030         -0.00000930
     102700.00000000          0.00102260         -0.00032100          0.00012750         -0.00003910
      33501.00000000          0.00371130         -0.00117090          0.00046590         -0.00014280
      12093.00000000          0.01197850         -0.00379680          0.00150960         -0.00046280
       4715.90000000          0.03469270         -0.01123070          0.00448520         -0.00137500
       1955.60000000          0.08912390         -0.02992770          0.01198350         -0.00367840
        852.61000000          0.19345570         -0.07127060          0.02895710         -0.00889810
        387.67000000          0.32090190         -0.14031360          0.05815660         -0.01795290
        182.68000000          0.32992330         -0.20307630          0.08881330         -0.02757320
         88.24500000          0.14941210         -0.09609850          0.04452440         -0.01409530
         39.26300000          0.01499380          0.35580860         -0.20603870          0.06725610
         19.23400000         -0.00091650          0.59217920         -0.51270170          0.17669280
          9.40570000          0.00043800          0.22159770         -0.15093490          0.05288610
          4.16010000         -0.00023980          0.01376480          0.67892030         -0.30759550
          1.89950000          0.00007360          0.00083950          0.58176970         -0.47006580
          0.30114000          0.00002390         -0.00000850         -0.01118250          0.69803410
  1  0  0  1  1
          0.60472000          1.00000000
  1  0  0  1  1
          0.12515000          1.00000000
  1  1  1 11  3
       8676.50000000          0.00043570         -0.00017480          0.00004510
       2055.90000000          0.00378150         -0.00152630          0.00039640
        666.23000000          0.02047820         -0.00833990          0.00215550
        253.10000000          0.07928340         -0.03322030          0.00867200
        106.12000000          0.21784730         -0.09541800          0.02486800
         47.24200000          0.38785850         -0.18240260          0.04854720
         21.82500000          0.35943500         -0.15583080          0.03961560
          9.96840000          0.11219950          0.18678990         -0.06057490
          4.51710000          0.00438740          0.54277330         -0.18716990
          1.99820000          0.00178090          0.38733090         -0.13777570
          0.28145000          0.00021220         -0.00437840          0.57608960
  1  1  1  1  1
          0.70988000          1.00000000
  1  1  1  1  1
          0.10204000          1.00000000
  1  2  2  7  1
        403.83000000          0.00147320
        121.17000000          0.01267250
         46.34500000          0.05804510
         19.72100000          0.17051030
          8.86240000          0.31859580
          3.99620000          0.38450230
          1.76360000          0.27377370
  1  2  2  1  1
          0.70619000          1.00000000
  1  2  2  1  1
          0.26390000          1.00000000
  1  3  3  1  1
          0.55150000          1.00000000
  1  0  0  1  1
          0.04559300          1.00000000
  1  1  1  1  1
          0.03514200          1.00000000
  1  2  2  1  1
          0.10470000          1.00000000
  1  3  3  1  1
          0.25800000          1.00000000
# KRYPTON     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# KRYPTON     Diffuse (1s,1p,1d,1f)
KR aug-cc-pVTZ
 14
  1  0  0 18  4
   11718113.00000000          0.00000560         -0.00000180          0.00000000          0.00000000
    1754604.40000000          0.00004380         -0.00001380          0.00000550         -0.00000180
     399281.32000000          0.00023050         -0.00007260          0.00002920         -0.00000930
     113084.57000000          0.00097330         -0.00030630          0.00012280         -0.00003910
      36885.92500000          0.00353370         -0.00111770          0.00044910         -0.00014300
      13312.20900000          0.01141670         -0.00362700          0.00145570         -0.00046390
       5189.98830000          0.03313250         -0.01074320          0.00433190         -0.00138010
       2151.65970000          0.08544640         -0.02869920          0.01159650         -0.00370010
        938.03251000          0.18691240         -0.06866790          0.02815850         -0.00899210
        426.55732000          0.31497610         -0.13651550          0.05703390         -0.01830210
        201.06660000          0.33433340         -0.20224580          0.08913560         -0.02875590
         97.09760500          0.16088100         -0.10905690          0.05084210         -0.01673240
         42.99872400          0.01784350          0.33187680         -0.19210300          0.06524100
         21.17707500         -0.00137930          0.59482500         -0.51210400          0.18344220
         10.42675200          0.00065720          0.24248250         -0.18570070          0.06921830
          4.58500800         -0.00033880          0.01722410          0.66541190         -0.31560340
          2.11760300          0.00012110          0.00036850          0.60239250         -0.50315010
          0.34922500          0.00003660         -0.00011530         -0.01064530          0.71715710
  1  0  0  1  1
          0.70705700          1.00000000
  1  0  0  1  1
          0.14482100          1.00000000
  1  1  1 11  3
       9366.30900000          0.00042310         -0.00017200          0.00004660
       2219.55430000          0.00367430         -0.00150250          0.00041000
        719.45288000          0.01993120         -0.00822690          0.00223280
        273.46446000          0.07742220         -0.03285660          0.00901440
        114.75225000          0.21403860         -0.09501350          0.02601150
         51.15556900          0.38485560         -0.18331060          0.05133400
         23.68267600          0.36263400         -0.16121610          0.04309290
         10.87548400          0.11708180          0.17876440         -0.06150400
          4.95513100          0.00512100          0.54378850         -0.20034240
          2.21726700          0.00175390          0.39133870         -0.14573640
          0.32215400          0.00021990         -0.00478000          0.57645810
  1  1  1  1  1
          0.80641000          1.00000000
  1  1  1  1  1
          0.11761900          1.00000000
  1  2  2  7  1
        446.16133000          0.00140440
        133.96477000          0.01217150
         51.34590700          0.05639190
         21.91690600          0.16764300
          9.89372500          0.31773680
          4.49252700          0.38726470
          2.00229300          0.27280060
  1  2  2  1  1
          0.80840900          1.00000000
  1  2  2  1  1
          0.30060000          1.00000000
  1  3  3  1  1
          0.66220000          1.00000000
  1  0  0  1  1
          0.05198500          1.00000000
  1  1  1  1  1
          0.04003300          1.00000000
  1  2  2  1  1
          0.12570000          1.00000000
  1  3  3  1  1
          0.32800000          1.00000000
# BASIS="aug-cc-pVQZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (6s,3p,2d,1f) -> [4s,3p,2d,1f]
# HYDROGEN    Diffuse (1s,1p,1d,1f)
H  aug-cc-pVQZ
 14
  1  0  0  3  1
         82.64000000          0.00200600
         12.41000000          0.01534300
          2.82400000          0.07557900
  1  0  0  1  1
          0.79770000          1.00000000
  1  0  0  1  1
          0.25810000          1.00000000
  1  0  0  1  1
          0.08989000          1.00000000
  1  1  1  1  1
          2.29200000          1.00000000
  1  1  1  1  1
          0.83800000          1.00000000
  1  1  1  1  1
          0.29200000          1.00000000
  1  2  2  1  1
          2.06200000          1.00000000
  1  2  2  1  1
          0.66200000          1.00000000
  1  3  3  1  1
          1.39700000          1.00000000
  1  0  0  1  1
          0.02363000          1.00000000
  1  1  1  1  1
          0.08480000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          0.36000000          1.00000000
# HELIUM      (7s,3p,2d,1f) -> [4s,3p,2d,1f]
# HELIUM      Diffuse (1s,1p,1d,1f)
HE aug-cc-pVQZ
 14
  1  0  0  4  1
        528.50000000          0.00094000
         79.31000000          0.00721400
         18.05000000          0.03597500
          5.08500000          0.12778200
  1  0  0  1  1
          1.60900000          1.00000000
  1  0  0  1  1
          0.53630000          1.00000000
  1  0  0  1  1
          0.18330000          1.00000000
  1  1  1  1  1
          5.99400000          1.00000000
  1  1  1  1  1
          1.74500000          1.00000000
  1  1  1  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          4.29900000          1.00000000
  1  2  2  1  1
          1.22300000          1.00000000
  1  3  3  1  1
          2.68000000          1.00000000
  1  0  0  1  1
          0.04819000          1.00000000
  1  1  1  1  1
          0.16260000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  3  3  1  1
          0.69060000          1.00000000
# BORON       (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# BORON       Diffuse (1s,1p,1d,1f,1g)
B  aug-cc-pVQZ
 19
  1  0  0  9  2
      23870.00000000          0.00008800         -0.00001800
       3575.00000000          0.00068700         -0.00013900
        812.80000000          0.00360000         -0.00072500
        229.70000000          0.01494900         -0.00306300
         74.69000000          0.05143500         -0.01058100
         26.81000000          0.14330200         -0.03136500
         10.32000000          0.30093500         -0.07101200
          4.17800000          0.40352600         -0.13210300
          1.72700000          0.22534000         -0.12307200
  1  0  0  1  1
          0.47040000          1.00000000
  1  0  0  1  1
          0.18960000          1.00000000
  1  0  0  1  1
          0.07394000          1.00000000
  1  1  1  3  1
         22.26000000          0.00509500
          5.05800000          0.03320600
          1.48700000          0.13231400
  1  1  1  1  1
          0.50710000          1.00000000
  1  1  1  1  1
          0.18120000          1.00000000
  1  1  1  1  1
          0.06463000          1.00000000
  1  2  2  1  1
          1.11000000          1.00000000
  1  2  2  1  1
          0.40200000          1.00000000
  1  2  2  1  1
          0.14500000          1.00000000
  1  3  3  1  1
          0.88200000          1.00000000
  1  3  3  1  1
          0.31100000          1.00000000
  1  4  4  1  1
          0.67300000          1.00000000
  1  0  0  1  1
          0.02721000          1.00000000
  1  1  1  1  1
          0.01878000          1.00000000
  1  2  2  1  1
          0.04660000          1.00000000
  1  3  3  1  1
          0.11300000          1.00000000
  1  4  4  1  1
          0.27300000          1.00000000
# CARBON      (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# CARBON      Diffuse (1s,1p,1d,1f,1g)
C  aug-cc-pVQZ
 19
  1  0  0  9  2
      33980.00000000          0.00009100         -0.00001900
       5089.00000000          0.00070400         -0.00015100
       1157.00000000          0.00369300         -0.00078500
        326.60000000          0.01536000         -0.00332400
        106.10000000          0.05292900         -0.01151200
         38.11000000          0.14704300         -0.03416000
         14.75000000          0.30563100         -0.07717300
          6.03500000          0.39934500         -0.14149300
          2.53000000          0.21705100         -0.11801900
  1  0  0  1  1
          0.73550000          1.00000000
  1  0  0  1  1
          0.29050000          1.00000000
  1  0  0  1  1
          0.11110000          1.00000000
  1  1  1  3  1
         34.51000000          0.00537800
          7.91500000          0.03613200
          2.36800000          0.14249300
  1  1  1  1  1
          0.81320000          1.00000000
  1  1  1  1  1
          0.28900000          1.00000000
  1  1  1  1  1
          0.10070000          1.00000000
  1  2  2  1  1
          1.84800000          1.00000000
  1  2  2  1  1
          0.64900000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
  1  3  3  1  1
          1.41900000          1.00000000
  1  3  3  1  1
          0.48500000          1.00000000
  1  4  4  1  1
          1.01100000          1.00000000
  1  0  0  1  1
          0.04145000          1.00000000
  1  1  1  1  1
          0.03218000          1.00000000
  1  2  2  1  1
          0.07660000          1.00000000
  1  3  3  1  1
          0.18700000          1.00000000
  1  4  4  1  1
          0.42400000          1.00000000
# NITROGEN    (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# NITROGEN    Diffuse (1s,1p,1d,1f,1g)
N  aug-cc-pVQZ
 19
  1  0  0  9  2
      45840.00000000          0.00009200         -0.00002000
       6868.00000000          0.00071700         -0.00015900
       1563.00000000          0.00374900         -0.00082400
        442.40000000          0.01553200         -0.00347800
        144.30000000          0.05314600         -0.01196600
         52.18000000          0.14678700         -0.03538800
         20.34000000          0.30466300         -0.08007700
          8.38100000          0.39768400         -0.14672200
          3.52900000          0.21764100         -0.11636000
  1  0  0  1  1
          1.05400000          1.00000000
  1  0  0  1  1
          0.41180000          1.00000000
  1  0  0  1  1
          0.15520000          1.00000000
  1  1  1  3  1
         49.33000000          0.00553300
         11.37000000          0.03796200
          3.43500000          0.14902800
  1  1  1  1  1
          1.18200000          1.00000000
  1  1  1  1  1
          0.41730000          1.00000000
  1  1  1  1  1
          0.14280000          1.00000000
  1  2  2  1  1
          2.83700000          1.00000000
  1  2  2  1  1
          0.96800000          1.00000000
  1  2  2  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          2.02700000          1.00000000
  1  3  3  1  1
          0.68500000          1.00000000
  1  4  4  1  1
          1.42700000          1.00000000
  1  0  0  1  1
          0.05464000          1.00000000
  1  1  1  1  1
          0.04402000          1.00000000
  1  2  2  1  1
          0.11100000          1.00000000
  1  3  3  1  1
          0.24500000          1.00000000
  1  4  4  1  1
          0.55900000          1.00000000
# OXYGEN      (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# OXYGEN      Diffuse (1s,1p,1d,1f,1g)
O  aug-cc-pVQZ
 19
  1  0  0  9  2
      61420.00000000          0.00009000         -0.00002000
       9199.00000000          0.00069800         -0.00015900
       2091.00000000          0.00366400         -0.00082900
        590.90000000          0.01521800         -0.00350800
        192.30000000          0.05242300         -0.01215600
         69.32000000          0.14592100         -0.03626100
         26.97000000          0.30525800         -0.08299200
         11.10000000          0.39850800         -0.15209000
          4.68200000          0.21698000         -0.11533100
  1  0  0  1  1
          1.42800000          1.00000000
  1  0  0  1  1
          0.55470000          1.00000000
  1  0  0  1  1
          0.20670000          1.00000000
  1  1  1  3  1
         63.42000000          0.00604400
         14.66000000          0.04179900
          4.45900000          0.16114300
  1  1  1  1  1
          1.53100000          1.00000000
  1  1  1  1  1
          0.53020000          1.00000000
  1  1  1  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          3.77500000          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.44400000          1.00000000
  1  3  3  1  1
          2.66600000          1.00000000
  1  3  3  1  1
          0.85900000          1.00000000
  1  4  4  1  1
          1.84600000          1.00000000
  1  0  0  1  1
          0.06959000          1.00000000
  1  1  1  1  1
          0.05348000          1.00000000
  1  2  2  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.32400000          1.00000000
  1  4  4  1  1
          0.71400000          1.00000000
# FLUORINE    (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# FLUORINE    Diffuse (1s,1p,1d,1f,1g)
F  aug-cc-pVQZ
 19
  1  0  0  9  2
      74530.00000000          0.00009500         -0.00002200
      11170.00000000          0.00073800         -0.00017200
       2543.00000000          0.00385800         -0.00089100
        721.00000000          0.01592600         -0.00374800
        235.90000000          0.05428900         -0.01286200
         85.60000000          0.14951300         -0.03806100
         33.55000000          0.30825200         -0.08623900
         13.93000000          0.39485300         -0.15586500
          5.91500000          0.21103100         -0.11091400
  1  0  0  1  1
          1.84300000          1.00000000
  1  0  0  1  1
          0.71240000          1.00000000
  1  0  0  1  1
          0.26370000          1.00000000
  1  1  1  3  1
         80.39000000          0.00634700
         18.63000000          0.04420400
          5.69400000          0.16851400
  1  1  1  1  1
          1.95300000          1.00000000
  1  1  1  1  1
          0.67020000          1.00000000
  1  1  1  1  1
          0.21660000          1.00000000
  1  2  2  1  1
          5.01400000          1.00000000
  1  2  2  1  1
          1.72500000          1.00000000
  1  2  2  1  1
          0.58600000          1.00000000
  1  3  3  1  1
          3.56200000          1.00000000
  1  3  3  1  1
          1.14800000          1.00000000
  1  4  4  1  1
          2.37600000          1.00000000
  1  0  0  1  1
          0.08594000          1.00000000
  1  1  1  1  1
          0.06568000          1.00000000
  1  2  2  1  1
          0.20700000          1.00000000
  1  3  3  1  1
          0.46000000          1.00000000
  1  4  4  1  1
          0.92400000          1.00000000
# NEON        (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# NEON        Diffuse (1s,1p,1d,1f,1g)
NE aug-cc-pVQZ
 19
  1  0  0  9  2
      99920.00000000          0.00008600         -0.00002000
      14960.00000000          0.00066900         -0.00015800
       3399.00000000          0.00351800         -0.00082400
        958.90000000          0.01466700         -0.00350000
        311.20000000          0.05096200         -0.01223300
        111.70000000          0.14374400         -0.03701700
         43.32000000          0.30456200         -0.08611300
         17.80000000          0.40010500         -0.15838100
          7.50300000          0.21864400         -0.11428800
  1  0  0  1  1
          2.33700000          1.00000000
  1  0  0  1  1
          0.90010000          1.00000000
  1  0  0  1  1
          0.33010000          1.00000000
  1  1  1  3  1
         99.68000000          0.00656600
         23.15000000          0.04597900
          7.10800000          0.17341900
  1  1  1  1  1
          2.44100000          1.00000000
  1  1  1  1  1
          0.83390000          1.00000000
  1  1  1  1  1
          0.26620000          1.00000000
  1  2  2  1  1
          6.47100000          1.00000000
  1  2  2  1  1
          2.21300000          1.00000000
  1  2  2  1  1
          0.74700000          1.00000000
  1  3  3  1  1
          4.65700000          1.00000000
  1  3  3  1  1
          1.52400000          1.00000000
  1  4  4  1  1
          2.98300000          1.00000000
  1  0  0  1  1
          0.10540000          1.00000000
  1  1  1  1  1
          0.08178000          1.00000000
  1  2  2  1  1
          0.27300000          1.00000000
  1  3  3  1  1
          0.68900000          1.00000000
  1  4  4  1  1
          1.22400000          1.00000000
# ALUMINUM    (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# ALUMINUM    Diffuse (1s,1p,1d,1f,1g)
AL aug-cc-pVQZ
 19
  1  0  0 13  3
     419600.00000000          0.00002782         -0.00000724          0.00000167
      62830.00000000          0.00021633         -0.00005617          0.00001296
      14290.00000000          0.00113754         -0.00029653          0.00006851
       4038.00000000          0.00479635         -0.00124913          0.00028827
       1312.00000000          0.01723890         -0.00455101          0.00105276
        470.50000000          0.05380660         -0.01443930          0.00333878
        181.80000000          0.14132600         -0.04034640          0.00939217
         74.46000000          0.28926800         -0.09226180          0.02160470
         31.90000000          0.38482500         -0.16451000          0.03958730
         13.96000000          0.23285200         -0.14129600          0.03491800
          5.18000000          0.02933300          0.19536500         -0.05284150
          2.26500000         -0.00300574          0.57247500         -0.19187800
          0.96640000          0.00166673          0.37404100         -0.25411500
  1  0  0  1  1
          0.24470000          1.00000000
  1  0  0  1  1
          0.11840000          1.00000000
  1  0  0  1  1
          0.05021000          1.00000000
  1  1  1  8  2
        891.30000000          0.00049175         -0.00008887
        211.30000000          0.00415843         -0.00074582
         68.28000000          0.02125380         -0.00387025
         25.70000000          0.07640580         -0.01393500
         10.63000000          0.19427700         -0.03668600
          4.60200000          0.33442800         -0.06277970
          2.01500000          0.37502600         -0.07896020
          0.87060000          0.20404100         -0.02885890
  1  1  1  1  1
          0.29720000          1.00000000
  1  1  1  1  1
          0.11000000          1.00000000
  1  1  1  1  1
          0.03989000          1.00000000
  1  2  2  1  1
          0.08040000          1.00000000
  1  2  2  1  1
          0.19900000          1.00000000
  1  2  2  1  1
          0.49400000          1.00000000
  1  3  3  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.40100000          1.00000000
  1  4  4  1  1
          0.35700000          1.00000000
  1  0  0  1  1
          0.01830000          1.00000000
  1  1  1  1  1
          0.01210000          1.00000000
  1  2  2  1  1
          0.02820000          1.00000000
  1  3  3  1  1
          0.05820000          1.00000000
  1  4  4  1  1
          0.15300000          1.00000000
# SILICON     (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# SILICON     Diffuse (1s,1p,1d,1f,1g)
SI aug-cc-pVQZ
 19
  1  0  0 13  3
     513000.00000000          0.00002609         -0.00000695          0.00000178
      76820.00000000          0.00020291         -0.00005396          0.00001381
      17470.00000000          0.00106715         -0.00028472          0.00007300
       4935.00000000          0.00450597         -0.00120203          0.00030767
       1602.00000000          0.01623590         -0.00438397          0.00112563
        574.10000000          0.05089130         -0.01397760          0.00358435
        221.50000000          0.13515500         -0.03935160          0.01017280
         90.54000000          0.28129200         -0.09142830          0.02375200
         38.74000000          0.38533600         -0.16560900          0.04434830
         16.95000000          0.24565100         -0.15250500          0.04190410
          6.45200000          0.03431450          0.16852400         -0.05025040
          2.87400000         -0.00334884          0.56928400         -0.21657800
          1.25000000          0.00187625          0.39805600         -0.28644800
  1  0  0  1  1
          0.35990000          1.00000000
  1  0  0  1  1
          0.16990000          1.00000000
  1  0  0  1  1
          0.07066000          1.00000000
  1  1  1  8  2
       1122.00000000          0.00044814         -0.00009649
        266.00000000          0.00381639         -0.00081197
         85.92000000          0.01981050         -0.00430087
         32.33000000          0.07270170         -0.01575020
         13.37000000          0.18983900         -0.04295410
          5.80000000          0.33567200         -0.07525740
          2.55900000          0.37936500         -0.09714460
          1.12400000          0.20119300         -0.02275070
  1  1  1  1  1
          0.39880000          1.00000000
  1  1  1  1  1
          0.15330000          1.00000000
  1  1  1  1  1
          0.05728000          1.00000000
  1  2  2  1  1
          0.12000000          1.00000000
  1  2  2  1  1
          0.30200000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  3  3  1  1
          0.21200000          1.00000000
  1  3  3  1  1
          0.54100000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
  1  0  0  1  1
          0.02750000          1.00000000
  1  1  1  1  1
          0.02000000          1.00000000
  1  2  2  1  1
          0.04350000          1.00000000
  1  3  3  1  1
          0.08460000          1.00000000
  1  4  4  1  1
          0.21200000          1.00000000
# PHOSPHORUS  (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# PHOSPHORUS  Diffuse (1s,1p,1d,1f,1g)
P  aug-cc-pVQZ
 19
  1  0  0 13  3
     615200.00000000          0.00002475         -0.00000672          0.00000185
      92120.00000000          0.00019247         -0.00005223          0.00001434
      20950.00000000          0.00101202         -0.00027536          0.00007572
       5920.00000000          0.00427261         -0.00116307          0.00031921
       1922.00000000          0.01541610         -0.00424281          0.00116851
        688.00000000          0.04859760         -0.01361140          0.00374267
        265.00000000          0.13006000         -0.03851140          0.01068170
        108.20000000          0.27451400         -0.09066430          0.02526570
         46.22000000          0.38540200         -0.16658400          0.04792830
         20.23000000          0.25593400         -0.16144700          0.04770960
          7.85900000          0.03912370          0.14678100         -0.04665250
          3.54700000         -0.00368010          0.56668200         -0.23496800
          1.56400000          0.00208211          0.41643300         -0.31133700
  1  0  0  1  1
          0.48880000          1.00000000
  1  0  0  1  1
          0.22660000          1.00000000
  1  0  0  1  1
          0.09331000          1.00000000
  1  1  1  8  2
       1367.00000000          0.00042102         -0.00010083
        324.00000000          0.00360985         -0.00085450
        104.60000000          0.01892170         -0.00457116
         39.37000000          0.07055600         -0.01703270
         16.26000000          0.18815700         -0.04752040
          7.05600000          0.33870900         -0.08527860
          3.13000000          0.38194300         -0.10967600
          1.39400000          0.19526100         -0.01611810
  1  1  1  1  1
          0.51790000          1.00000000
  1  1  1  1  1
          0.20320000          1.00000000
  1  1  1  1  1
          0.07698000          1.00000000
  1  2  2  1  1
          0.16500000          1.00000000
  1  2  2  1  1
          0.41300000          1.00000000
  1  2  2  1  1
          1.03600000          1.00000000
  1  3  3  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          0.70300000          1.00000000
  1  4  4  1  1
          0.59700000          1.00000000
  1  0  0  1  1
          0.03540000          1.00000000
  1  1  1  1  1
          0.02720000          1.00000000
  1  2  2  1  1
          0.05940000          1.00000000
  1  3  3  1  1
          0.10900000          1.00000000
  1  4  4  1  1
          0.25000000          1.00000000
# SULFUR      (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# SULFUR      Diffuse (1s,1p,1d,1f,1g)
S  aug-cc-pVQZ
 19
  1  0  0 13  3
     727800.00000000          0.00002360         -0.00000652          0.00000189
     109000.00000000          0.00018348         -0.00005066          0.00001469
      24800.00000000          0.00096428         -0.00026683          0.00007755
       7014.00000000          0.00406537         -0.00112601          0.00032651
       2278.00000000          0.01469730         -0.00411186          0.00119686
        814.70000000          0.04650810         -0.01324540          0.00384799
        313.40000000          0.12550800         -0.03770040          0.01105390
        127.70000000          0.26843300         -0.08985540          0.02646450
         54.48000000          0.38480900         -0.16709800          0.05087710
         23.85000000          0.26537200         -0.16935400          0.05300300
          9.42800000          0.04373260          0.12782400         -0.04255180
          4.29000000         -0.00378807          0.56486200         -0.25085300
          1.90900000          0.00218083          0.43176700         -0.33315200
  1  0  0  1  1
          0.62700000          1.00000000
  1  0  0  1  1
          0.28730000          1.00000000
  1  0  0  1  1
          0.11720000          1.00000000
  1  1  1  8  2
       1546.00000000          0.00044118         -0.00011311
        366.40000000          0.00377571         -0.00095858
        118.40000000          0.01983600         -0.00513471
         44.53000000          0.07420630         -0.01926410
         18.38000000          0.19732700         -0.05359800
          7.96500000          0.35185100         -0.09603330
          3.54100000          0.37868700         -0.11818300
          1.59100000          0.17093100          0.00923194
  1  1  1  1  1
          0.62050000          1.00000000
  1  1  1  1  1
          0.24200000          1.00000000
  1  1  1  1  1
          0.09014000          1.00000000
  1  2  2  1  1
          0.20300000          1.00000000
  1  2  2  1  1
          0.50400000          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
  1  3  3  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          0.86900000          1.00000000
  1  4  4  1  1
          0.68300000          1.00000000
  1  0  0  1  1
          0.04280000          1.00000000
  1  1  1  1  1
          0.03170000          1.00000000
  1  2  2  1  1
          0.07480000          1.00000000
  1  3  3  1  1
          0.14000000          1.00000000
  1  4  4  1  1
          0.29700000          1.00000000
# CHLORINE    (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# CHLORINE    Diffuse (1s,1p,1d,1f,1g)
CL aug-cc-pVQZ
 19
  1  0  0 13  3
     834900.00000000          0.00002317         -0.00000650          0.00000197
     125000.00000000          0.00018015         -0.00005049          0.00001526
      28430.00000000          0.00094778         -0.00026611          0.00008061
       8033.00000000          0.00400139         -0.00112499          0.00033996
       2608.00000000          0.01446290         -0.00410497          0.00124551
        933.90000000          0.04565860         -0.01319870          0.00399612
        360.00000000          0.12324800         -0.03753420          0.01147510
        147.00000000          0.26436900         -0.08972330          0.02755040
         62.88000000          0.38298900         -0.16767100          0.05329170
         27.60000000          0.27093400         -0.17476300          0.05712460
         11.08000000          0.04714040          0.11490900         -0.03952010
          5.07500000         -0.00371766          0.56361800         -0.26434300
          2.27800000          0.00219158          0.44160600         -0.34929100
  1  0  0  1  1
          0.77750000          1.00000000
  1  0  0  1  1
          0.35270000          1.00000000
  1  0  0  1  1
          0.14310000          1.00000000
  1  1  1  8  2
       1703.00000000          0.00047404         -0.00012827
        403.60000000          0.00406412         -0.00109356
        130.30000000          0.02133550         -0.00583429
         49.05000000          0.07946110         -0.02192580
         20.26000000          0.20892700         -0.06013850
          8.78700000          0.36494500         -0.10692900
          3.91900000          0.37172500         -0.12245400
          1.76500000          0.14629200          0.03836190
  1  1  1  1  1
          0.72070000          1.00000000
  1  1  1  1  1
          0.28390000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  2  2  1  1
          0.25400000          1.00000000
  1  2  2  1  1
          0.62800000          1.00000000
  1  2  2  1  1
          1.55100000          1.00000000
  1  3  3  1  1
          0.42300000          1.00000000
  1  3  3  1  1
          1.08900000          1.00000000
  1  4  4  1  1
          0.82700000          1.00000000
  1  0  0  1  1
          0.05190000          1.00000000
  1  1  1  1  1
          0.03760000          1.00000000
  1  2  2  1  1
          0.09520000          1.00000000
  1  3  3  1  1
          0.21700000          1.00000000
  1  4  4  1  1
          0.37800000          1.00000000
# ARGON       (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# ARGON       Diffuse (1s,1p,1d,1f,1g)
AR aug-cc-pVQZ
 19
  1  0  0 13  3
     950600.00000000          0.00002275         -0.00000646          0.00000202
     142300.00000000          0.00017695         -0.00005023          0.00001569
      32360.00000000          0.00093128         -0.00026480          0.00008286
       9145.00000000          0.00392860         -0.00111895          0.00034926
       2970.00000000          0.01420640         -0.00408276          0.00127976
       1064.00000000          0.04481140         -0.01312160          0.00410365
        410.80000000          0.12100100         -0.03728550          0.01177890
        168.00000000          0.26057900         -0.08947090          0.02838680
         71.99000000          0.38136400         -0.16805400          0.05524060
         31.67000000          0.27605800         -0.17959400          0.06074920
         12.89000000          0.05051790          0.10295300         -0.03620120
          5.92900000         -0.00359866          0.56263000         -0.27539800
          2.67800000          0.00218798          0.45035500         -0.36284500
  1  0  0  1  1
          0.94160000          1.00000000
  1  0  0  1  1
          0.42390000          1.00000000
  1  0  0  1  1
          0.17140000          1.00000000
  1  1  1  8  2
       1890.00000000          0.00049575         -0.00013886
        447.80000000          0.00425172         -0.00118870
        144.60000000          0.02232770         -0.00632553
         54.46000000          0.08308780         -0.02388130
         22.51000000          0.21711000         -0.06492380
          9.77400000          0.37450700         -0.11544400
          4.36800000          0.36644500         -0.12365100
          1.95900000          0.12924500          0.06490550
  1  1  1  1  1
          0.82600000          1.00000000
  1  1  1  1  1
          0.32970000          1.00000000
  1  1  1  1  1
          0.12420000          1.00000000
  1  2  2  1  1
          0.31100000          1.00000000
  1  2  2  1  1
          0.76300000          1.00000000
  1  2  2  1  1
          1.87300000          1.00000000
  1  3  3  1  1
          0.54300000          1.00000000
  1  3  3  1  1
          1.32500000          1.00000000
  1  4  4  1  1
          1.00700000          1.00000000
  1  0  0  1  1
          0.06100000          1.00000000
  1  1  1  1  1
          0.04350000          1.00000000
  1  2  2  1  1
          0.11600000          1.00000000
  1  3  3  1  1
          0.29400000          1.00000000
  1  4  4  1  1
          0.45900000          1.00000000
# GALLIUM     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# GALLIUM     Diffuse (1s,1p,1d,1f,1g)
GA aug-cc-pVQZ
 20
  1  0  0 18  4
   11274496.00000000          0.00000410         -0.00000130          0.00000000          0.00000000
    1688053.40000000          0.00003160         -0.00000980          0.00000370          0.00000000
     384140.83000000          0.00016620         -0.00005150          0.00001970         -0.00000460
     108807.03000000          0.00070170         -0.00021760          0.00008300         -0.00001930
      35497.69100000          0.00255080         -0.00079320          0.00030290         -0.00007050
      12815.10400000          0.00826530         -0.00258210          0.00098500         -0.00022900
       4998.10870000          0.02419500         -0.00766520          0.00293410         -0.00068350
       2072.88480000          0.06365720         -0.02075670          0.00795720         -0.00185050
        903.74582000          0.14576510         -0.05077580          0.01967610         -0.00459300
        410.44307000          0.27033130         -0.10738020          0.04217830         -0.00983430
        192.60636000          0.34915710         -0.18065200          0.07386450         -0.01738490
         92.04967800          0.23744330         -0.17367010          0.07475310         -0.01757520
         42.04781100          0.04808330          0.11082510         -0.05341080          0.01252540
         21.06921700         -0.00229660          0.54183660         -0.35739190          0.09034000
         10.44791500          0.00179040          0.44678990         -0.42507130          0.11047210
          4.77765800         -0.00082760          0.07621050          0.20109920         -0.06121190
          2.28256600          0.00035430         -0.00093710          0.71459660         -0.25617680
          1.03530300         -0.00014110          0.00178060          0.36881490         -0.26037720
  1  0  0  1  1
          0.25767400          1.00000000
  1  0  0  1  1
          0.11917900          1.00000000
  1  0  0  1  1
          0.05129400          1.00000000
  1  1  1 13  3
      22059.77100000          0.00005470         -0.00002070          0.00000340
       5222.31290000          0.00048650         -0.00018460          0.00003000
       1696.06010000          0.00279900         -0.00106400          0.00017500
        648.76573000          0.01223960         -0.00469460          0.00076420
        275.10267000          0.04274760         -0.01664860          0.00274580
        125.34634000          0.11871870         -0.04781140          0.00781400
         60.05433400          0.24858280         -0.10453030          0.01742150
         29.72376800          0.36016220         -0.16129650          0.02648520
         15.03978100          0.29501710         -0.11431700          0.01939500
          7.57227300          0.09847940          0.14590560         -0.03131290
          3.73867600          0.00876710          0.42719890         -0.08016340
          1.79678800          0.00139610          0.42404150         -0.10017290
          0.82991000          0.00007700          0.15994400         -0.01058780
  1  1  1  1  1
          0.27287400          1.00000000
  1  1  1  1  1
          0.10154000          1.00000000
  1  1  1  1  1
          0.03765800          1.00000000
  1  2  2  9  1
        766.43696000          0.00017450
        231.00425000          0.00165770
         89.78123800          0.00928990
         39.54668100          0.03489050
         18.60758300          0.09634530
          9.15128700          0.19557030
          4.56500500          0.28359420
          2.25306600          0.30825150
          1.08672300          0.25196200
  1  2  2  1  1
          0.50330400          1.00000000
  1  2  2  1  1
          0.21228300          1.00000000
  1  2  2  1  1
          0.08280000          1.00000000
  1  3  3  1  1
          0.18100000          1.00000000
  1  3  3  1  1
          0.47100000          1.00000000
  1  4  4  1  1
          0.40320000          1.00000000
  1  0  0  1  1
          0.01847500          1.00000000
  1  1  1  1  1
          0.01140600          1.00000000
  1  2  2  1  1
          0.02790000          1.00000000
  1  3  3  1  1
          0.06550000          1.00000000
  1  4  4  1  1
          0.16800000          1.00000000
# GERMANIUM   (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# GERMANIUM   Diffuse (1s,1p,1d,1f,1g)
GE aug-cc-pVQZ
 20
  1  0  0 18  4
   12360507.00000000          0.00000390         -0.00000120          0.00000000          0.00000000
    1850697.80000000          0.00003050         -0.00000950          0.00000370          0.00000000
     421131.42000000          0.00016050         -0.00004990          0.00001920         -0.00000490
     119278.26000000          0.00067760         -0.00021090          0.00008130         -0.00002080
      38912.27700000          0.00246370         -0.00076860          0.00029650         -0.00007610
      14048.68200000          0.00798350         -0.00250250          0.00096480         -0.00024720
       5480.69920000          0.02337740         -0.00742590          0.00287150         -0.00073730
       2274.20550000          0.06157420         -0.02012490          0.00779730         -0.00199810
        992.24129000          0.14150760         -0.04929860          0.01929220         -0.00496400
        450.99966000          0.26469420         -0.10486830          0.04162000         -0.01069300
        211.82024000          0.34832570         -0.17832750          0.07353680         -0.01908430
        101.41102000          0.24541960         -0.17895810          0.07783200         -0.02016430
         46.91409000          0.05356460          0.08738420         -0.04235820          0.01083620
         23.50895000         -0.00183800          0.52709200         -0.34475370          0.09621100
         11.68131100          0.00180490          0.46795510         -0.44567130          0.12799790
          5.43452600         -0.00084760          0.08922060          0.15115440         -0.05060650
          2.60880800          0.00036680         -0.00034230          0.71742950         -0.28529170
          1.19844200         -0.00015420          0.00191440          0.40356340         -0.30653590
  1  0  0  1  1
          0.32980800          1.00000000
  1  0  0  1  1
          0.15543300          1.00000000
  1  0  0  1  1
          0.06691300          1.00000000
  1  1  1 13  3
      24017.46600000          0.00005310         -0.00002040          0.00000400
       5685.71750000          0.00047200         -0.00018180          0.00003570
       1846.48590000          0.00271870         -0.00104910          0.00020800
        706.24981000          0.01191450         -0.00463920          0.00091210
        299.45610000          0.04176250         -0.01650900          0.00328230
        136.43904000          0.11658940         -0.04766090          0.00941390
         65.39015500          0.24583380         -0.10496780          0.02109170
         32.39373500          0.35912610         -0.16337450          0.03250000
         16.41561600          0.29779290         -0.11809980          0.02399720
          8.28778700          0.10177080          0.14201780         -0.03711860
          4.11263400          0.00940720          0.42743240         -0.09881300
          1.99885400          0.00143500          0.42561670         -0.12356590
          0.94429100          0.00003540          0.15820340         -0.01101330
  1  1  1  1  1
          0.34121100          1.00000000
  1  1  1  1  1
          0.13435000          1.00000000
  1  1  1  1  1
          0.05173500          1.00000000
  1  2  2  9  1
        864.67411000          0.00016450
        261.03763000          0.00156540
        101.77030000          0.00879540
         45.11664100          0.03318520
         21.43068600          0.09195370
         10.65986100          0.18920170
          5.39228700          0.28058920
          2.70449700          0.31174740
          1.32854400          0.25541970
  1  2  2  1  1
          0.62645200          1.00000000
  1  2  2  1  1
          0.26601300          1.00000000
  1  2  2  1  1
          0.10630000          1.00000000
  1  3  3  1  1
          0.54920000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  4  4  1  1
          0.46810000          1.00000000
  1  0  0  1  1
          0.02639000          1.00000000
  1  1  1  1  1
          0.01855000          1.00000000
  1  2  2  1  1
          0.03970000          1.00000000
  1  3  3  1  1
          0.08840000          1.00000000
  1  4  4  1  1
          0.21430000          1.00000000
# ARSENIC     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# ARSENIC     Diffuse (1s,1p,1d,1f,1g)
AS aug-cc-pVQZ
 20
  1  0  0 18  4
   13600341.00000000          0.00000380         -0.00000120          0.00000000          0.00000000
    2036507.30000000          0.00002920         -0.00000910          0.00000360         -0.00000100
     463432.78000000          0.00015380         -0.00004800          0.00001870         -0.00000520
     131259.94000000          0.00064960         -0.00020280          0.00007900         -0.00002170
      42819.19200000          0.00236250         -0.00073920          0.00028810         -0.00007940
      15457.01900000          0.00766090         -0.00240890          0.00093860         -0.00025830
       6028.45830000          0.02246720         -0.00715380          0.00279460         -0.00077090
       2500.55990000          0.05934250         -0.01943330          0.00760980         -0.00209460
       1090.61490000          0.13710150         -0.04774710          0.01886990         -0.00521640
        495.62154000          0.25894720         -0.10226390          0.04100630         -0.01131630
        232.81669000          0.34728470         -0.17583260          0.07312750         -0.02039350
        111.63118000          0.25342470         -0.18374940          0.08071940         -0.02246640
         52.26995000          0.05962660          0.06482760         -0.03163000          0.00855900
         26.14987800         -0.00118610          0.51092810         -0.33173760          0.09956920
         13.01875700          0.00177910          0.48731430         -0.46382210          0.14345010
          6.15543200         -0.00084550          0.10336360          0.10369900         -0.03719010
          2.95912700          0.00036600          0.00063550          0.71829860         -0.30853680
          1.37387400         -0.00016220          0.00197660          0.43533050         -0.34786490
  1  0  0  1  1
          0.40885000          1.00000000
  1  0  0  1  1
          0.19451100          1.00000000
  1  0  0  1  1
          0.08364100          1.00000000
  1  1  1 13  3
      25570.41800000          0.00005330         -0.00002080          0.00000460
       6052.92370000          0.00047440         -0.00018550          0.00004120
       1965.70020000          0.00273300         -0.00107040          0.00023930
        751.77229000          0.01198710         -0.00473920          0.00105310
        318.68140000          0.04207660         -0.01688850          0.00378630
        145.14749000          0.11758910         -0.04884450          0.01091010
         69.54116200          0.24787470         -0.10759890          0.02438530
         34.45137600          0.36051480         -0.16693760          0.03764820
         17.46061000          0.29559210         -0.11692140          0.02651370
          8.80860900          0.09921630          0.15145050         -0.04454640
          4.37864600          0.00878660          0.43717310         -0.11676810
          2.14440500          0.00144620          0.41970780         -0.14094410
          1.02935000         -0.00004470          0.14376360         -0.00121210
  1  1  1  1  1
          0.40463600          1.00000000
  1  1  1  1  1
          0.16562200          1.00000000
  1  1  1  1  1
          0.06561000          1.00000000
  1  2  2  9  1
        996.97960000          0.00014620
        300.98518000          0.00140340
        117.23473000          0.00801950
         51.95690400          0.03100480
         24.68944000          0.08784780
         12.29517100          0.18522500
          6.24465200          0.28082510
          3.15546000          0.31631980
          1.56804900          0.25711920
  1  2  2  1  1
          0.74864700          1.00000000
  1  2  2  1  1
          0.31912500          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          0.26400000          1.00000000
  1  3  3  1  1
          0.64400000          1.00000000
  1  4  4  1  1
          0.54650000          1.00000000
  1  0  0  1  1
          0.03249900          1.00000000
  1  1  1  1  1
          0.02369800          1.00000000
  1  2  2  1  1
          0.05310000          1.00000000
  1  3  3  1  1
          0.11320000          1.00000000
  1  4  4  1  1
          0.23900000          1.00000000
# SELENIUM    (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# SELENIUM    Diffuse (1s,1p,1d,1f,1g)
SE aug-cc-pVQZ
 20
  1  0  0 18  4
   15011000.00000000          0.00000360         -0.00000110          0.00000000          0.00000000
    2247500.00000000          0.00002790         -0.00000870          0.00000340         -0.00000100
     511450.00000000          0.00014660         -0.00004590          0.00001810         -0.00000530
     144870.00000000          0.00061900         -0.00019390          0.00007630         -0.00002230
      47261.00000000          0.00225140         -0.00070640          0.00027810         -0.00008140
      17062.00000000          0.00730300         -0.00230300          0.00090680         -0.00026490
       6654.50000000          0.02144420         -0.00684250          0.00269990         -0.00079060
       2759.80000000          0.05681220         -0.01863350          0.00737260         -0.00215390
       1203.20000000          0.13208070         -0.04595120          0.01833600         -0.00538120
        546.53000000          0.25234690         -0.09921930          0.04018120         -0.01176940
        256.63000000          0.34592960         -0.17288130          0.07248640         -0.02146290
        123.14000000          0.26238900         -0.18849730          0.08356260         -0.02469040
         58.26300000          0.06679380          0.04226100         -0.02075920          0.00577740
         29.02300000         -0.00033320          0.49367910         -0.31835350          0.10152090
         14.46500000          0.00172750          0.50528180         -0.47983330          0.15785700
          6.93480000         -0.00082990          0.11841500          0.05928190         -0.02242190
          3.32990000          0.00035780          0.00195670          0.71741160         -0.32907760
          1.56000000         -0.00016660          0.00196480          0.46386360         -0.38734430
  1  0  0  1  1
          0.49291000          1.00000000
  1  0  0  1  1
          0.23525000          1.00000000
  1  0  0  1  1
          0.10037000          1.00000000
  1  1  1 13  3
      25217.00000000          0.00006100         -0.00002410          0.00000580
       5969.90000000          0.00054240         -0.00021520          0.00005200
       1938.90000000          0.00311740         -0.00123860          0.00029980
        741.66000000          0.01359770         -0.00546070          0.00132010
        314.50000000          0.04727880         -0.01929360          0.00468570
        143.31000000          0.12978560         -0.05497150          0.01337370
         68.65000000          0.26573830         -0.11779520          0.02892450
         33.99500000          0.36735440         -0.17407820          0.04294540
         17.18500000          0.27478050         -0.09557980          0.02232720
          8.57400000          0.07916790          0.20597140         -0.06360310
          4.22060000          0.00513490          0.47354310         -0.14361470
          2.05210000          0.00133190          0.38319220         -0.14472930
          0.96156000         -0.00020330          0.09208720          0.06303800
  1  1  1  1  1
          0.42151000          1.00000000
  1  1  1  1  1
          0.17626000          1.00000000
  1  1  1  1  1
          0.07066300          1.00000000
  1  2  2  9  1
       1143.40000000          0.00013010
        345.33000000          0.00125730
        134.46000000          0.00728820
         59.56700000          0.02886470
         28.28300000          0.08389870
         14.06100000          0.18197710
          7.13900000          0.28260570
          3.61480000          0.32204530
          1.80720000          0.25816330
  1  2  2  1  1
          0.86944000          1.00000000
  1  2  2  1  1
          0.37036000          1.00000000
  1  2  2  1  1
          0.15300000          1.00000000
  1  3  3  1  1
          0.28400000          1.00000000
  1  3  3  1  1
          0.70970000          1.00000000
  1  4  4  1  1
          0.57300000          1.00000000
  1  0  0  1  1
          0.03815200          1.00000000
  1  1  1  1  1
          0.02656900          1.00000000
  1  2  2  1  1
          0.06190000          1.00000000
  1  3  3  1  1
          0.12400000          1.00000000
  1  4  4  1  1
          0.26300000          1.00000000
# BROMINE     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# BROMINE     Diffuse (1s,1p,1d,1f,1g)
BR aug-cc-pVQZ
 20
  1  0  0 18  4
   16475000.00000000          0.00000340         -0.00000110          0.00000000          0.00000000
    2466600.00000000          0.00002670         -0.00000840          0.00000330         -0.00000100
     561310.00000000          0.00014040         -0.00004410          0.00001750         -0.00000540
     158990.00000000          0.00059270         -0.00018620          0.00007400         -0.00002270
      51869.00000000          0.00215610         -0.00067830          0.00026970         -0.00008270
      18726.00000000          0.00699590         -0.00221220          0.00087990         -0.00026940
       7303.60000000          0.02056450         -0.00657520          0.00261980         -0.00080420
       3029.10000000          0.05458930         -0.01793280          0.00716710         -0.00219490
       1320.80000000          0.12752260         -0.04433210          0.01785610         -0.00549390
        600.03000000          0.24597800         -0.09634780          0.03939600         -0.01209600
        281.90000000          0.34365080         -0.16968140          0.07171020         -0.02226230
        135.54000000          0.27025300         -0.19207690          0.08588770         -0.02660630
         64.87000000          0.07447950          0.02087310         -0.01038610          0.00275800
         32.12900000          0.00087870          0.47449960         -0.30401350          0.10168030
         16.03700000          0.00157550          0.52149070         -0.49331780          0.17041320
          7.78490000         -0.00076020          0.13480010          0.01608900         -0.00622200
          3.72470000          0.00032110          0.00366140          0.71466860         -0.34525700
          1.75830000         -0.00015860          0.00188400          0.49047950         -0.42348400
  1  0  0  1  1
          0.58331000          1.00000000
  1  0  0  1  1
          0.27856000          1.00000000
  1  0  0  1  1
          0.11829000          1.00000000
  1  1  1 13  3
      26607.00000000          0.00006190         -0.00002480          0.00000640
       6298.20000000          0.00054990         -0.00022120          0.00005720
       2045.20000000          0.00316200         -0.00127360          0.00032970
        782.16000000          0.01379790         -0.00561790          0.00145620
        331.63000000          0.04798120         -0.01986000          0.00515910
        151.11000000          0.13157100         -0.05655310          0.01476170
         72.39200000          0.26858610         -0.12094790          0.03176940
         35.86200000          0.36834730         -0.17730980          0.04706800
         18.13400000          0.27113630         -0.09214720          0.02238710
          9.04300000          0.07622220          0.21876830         -0.07202540
          4.45000000          0.00467490          0.48546700         -0.16264290
          2.16610000          0.00125650          0.37219700         -0.14965030
          0.99628000         -0.00023570          0.07769070          0.10645170
  1  1  1  1  1
          0.45443000          1.00000000
  1  1  1  1  1
          0.19404000          1.00000000
  1  1  1  1  1
          0.07899700          1.00000000
  1  2  2  9  1
       1289.60000000          0.00011900
        389.75000000          0.00115510
        151.76000000          0.00676480
         67.22300000          0.02730170
         31.91300000          0.08092980
         15.85700000          0.17940110
          8.05450000          0.28400860
          4.08870000          0.32667970
          2.05560000          0.25849000
  1  2  2  1  1
          0.99509000          1.00000000
  1  2  2  1  1
          0.42313000          1.00000000
  1  2  2  1  1
          0.17790000          1.00000000
  1  3  3  1  1
          0.34070000          1.00000000
  1  3  3  1  1
          0.82570000          1.00000000
  1  4  4  1  1
          0.64910000          1.00000000
  1  0  0  1  1
          0.04427000          1.00000000
  1  1  1  1  1
          0.03051300          1.00000000
  1  2  2  1  1
          0.08290000          1.00000000
  1  3  3  1  1
          0.17480000          1.00000000
  1  4  4  1  1
          0.31100000          1.00000000
# KRYPTON     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# KRYPTON     Diffuse (1s,1p,1d,1f,1g)
KR aug-cc-pVQZ
 20
  1  0  0 18  4
   18226108.00000000          0.00000320         -0.00000100          0.00000000          0.00000000
    2728802.50000000          0.00002520         -0.00000790          0.00000320         -0.00000100
     620997.71000000          0.00013280         -0.00004180          0.00001680         -0.00000530
     175899.58000000          0.00056070         -0.00017660          0.00007090         -0.00002260
      57387.49700000          0.00204010         -0.00064340          0.00025820         -0.00008230
      20717.18100000          0.00662350         -0.00209990          0.00084330         -0.00026840
       8078.88990000          0.01949960         -0.00624530          0.00251150         -0.00080140
       3349.51700000          0.05193640         -0.01708040          0.00689210         -0.00219370
       1459.78120000          0.12211660         -0.04238150          0.01722200         -0.00550740
        662.89391000          0.23836530         -0.09286790          0.03831590         -0.01222660
        311.39215000          0.34070510         -0.16573900          0.07054380         -0.02276170
        149.93751000          0.27928550         -0.19550880          0.08807170         -0.02836060
         72.49824900          0.08409920         -0.00164090          0.00063280         -0.00075650
         35.56935400          0.00250420          0.45300710         -0.28810650          0.10013650
         17.76663300          0.00135740          0.53707510         -0.50497970          0.18153320
          8.71238300         -0.00065910          0.15289710         -0.02677730          0.01118670
          4.14497100          0.00027010          0.00574110          0.70987180         -0.35758430
          1.96964900         -0.00014360          0.00174140          0.51580200         -0.45723050
  1  0  0  1  1
          0.67995200          1.00000000
  1  0  0  1  1
          0.32450200          1.00000000
  1  0  0  1  1
          0.13744100          1.00000000
  1  1  1 13  3
      28600.83100000          0.00006050         -0.00002460          0.00000670
       6770.99120000          0.00053780         -0.00021920          0.00005960
       2199.04890000          0.00309340         -0.00126280          0.00034320
        841.17957000          0.01351500         -0.00557560          0.00151900
        356.76633000          0.04709590         -0.01975460          0.00538810
        162.63620000          0.12962000         -0.05644880          0.01549350
         77.96603500          0.26611080         -0.12149230          0.03351760
         38.66148900          0.36780580         -0.17949070          0.05019110
         19.57679100          0.27403720         -0.09623140          0.02445500
          9.79176100          0.07871130          0.21631900         -0.07529530
          4.83538300          0.00498420          0.48997210         -0.17605340
          2.36812500          0.00122670          0.37267580         -0.15707240
          1.08999600         -0.00024480          0.07500880          0.13045790
  1  1  1  1  1
          0.50458800          1.00000000
  1  1  1  1  1
          0.21845500          1.00000000
  1  1  1  1  1
          0.08995900          1.00000000
  1  2  2  9  1
       1437.77920000          0.00011080
        434.26846000          0.00108280
        168.92699000          0.00640650
         74.77753500          0.02623790
         35.51602400          0.07882350
         17.67105100          0.17706770
          9.00461100          0.28396220
          4.59477300          0.32947020
          2.32648600          0.25890010
  1  2  2  1  1
          1.13324700          1.00000000
  1  2  2  1  1
          0.48130700          1.00000000
  1  2  2  1  1
          0.20530000          1.00000000
  1  3  3  1  1
          0.41300000          1.00000000
  1  3  3  1  1
          0.95570000          1.00000000
  1  4  4  1  1
          0.73950000          1.00000000
  1  0  0  1  1
          0.05038800          1.00000000
  1  1  1  1  1
          0.03445700          1.00000000
  1  2  2  1  1
          0.10390000          1.00000000
  1  3  3  1  1
          0.22560000          1.00000000
  1  4  4  1  1
          0.35900000          1.00000000
#  aug-cc-pV5Z  EMSL  Basis Set Exchange Library  6/6/08 12:02 AM
# Elements                             References
# --------                             ----------
# H      : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He     : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
# Li     : Unofficial set from D. Feller.
# B  - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# Na - Mg: Unofficial set from D. Feller.
# Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
# Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#
# Elements                             References
# --------                             ---------
#  H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#          Diffuse s exponent - S. Mielke
#  He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
#  B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#          6796 (1992).
# Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN
H  aug-cc-pV5Z
 16
  1  0  0  8  5
        402.00000000          0.00027900          0.00000000          0.00000000          0.00000000          0.00000000
         60.24000000          0.00216500          0.00000000          0.00000000          0.00000000          0.00000000
         13.73000000          0.01120100          0.00000000          0.00000000          0.00000000          0.00000000
          3.90500000          0.04487800          0.00000000          0.00000000          0.00000000          0.00000000
          1.28300000          0.14229900          1.00000000          0.00000000          0.00000000          0.00000000
          0.46550000          0.33097900          0.00000000          1.00000000          0.00000000          0.00000000
          0.18110000          0.43626900          0.00000000          0.00000000          1.00000000          0.00000000
          0.07279000          0.17644000          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  1  1
          4.51600000          1.00000000
  1  1  1  1  1
          1.71200000          1.00000000
  1  1  1  1  1
          0.64900000          1.00000000
  1  1  1  1  1
          0.24600000          1.00000000
  1  2  2  1  1
          2.95000000          1.00000000
  1  2  2  1  1
          1.20600000          1.00000000
  1  2  2  1  1
          0.49300000          1.00000000
  1  3  3  1  1
          2.50600000          1.00000000
  1  3  3  1  1
          0.87500000          1.00000000
  1  4  4  1  1
          2.35800000          1.00000000
  1  0  0  1  1
          0.02070000          1.00000000
  1  1  1  1  1
          0.07440000          1.00000000
  1  2  2  1  1
          0.15600000          1.00000000
  1  3  3  1  1
          0.27400000          1.00000000
  1  4  4  1  1
          0.54300000          1.00000000
# HELIUM
He aug-cc-pV5Z
 16
  1  0  0  8  5
       1145.00000000          0.00035900          0.00000000          0.00000000          0.00000000          0.00000000
        171.70000000          0.00277100          0.00000000          0.00000000          0.00000000          0.00000000
         39.07000000          0.01425100          0.00000000          0.00000000          0.00000000          0.00000000
         11.04000000          0.05556600          0.00000000          0.00000000          0.00000000          0.00000000
          3.56600000          0.16209100          1.00000000          0.00000000          0.00000000          0.00000000
          1.24000000          0.33219700          0.00000000          1.00000000          0.00000000          0.00000000
          0.44730000          0.41961500          0.00000000          0.00000000          1.00000000          0.00000000
          0.16400000          0.18612800          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  1  1
         10.15300000          1.00000000
  1  1  1  1  1
          3.62700000          1.00000000
  1  1  1  1  1
          1.29600000          1.00000000
  1  1  1  1  1
          0.46300000          1.00000000
  1  2  2  1  1
          7.66600000          1.00000000
  1  2  2  1  1
          2.64700000          1.00000000
  1  2  2  1  1
          0.91400000          1.00000000
  1  3  3  1  1
          5.41100000          1.00000000
  1  3  3  1  1
          1.70700000          1.00000000
  1  4  4  1  1
          3.43000000          1.00000000
  1  0  0  1  1
          0.04664000          1.00000000
  1  1  1  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.28920000          1.00000000
  1  3  3  1  1
          0.53450000          1.00000000
  1  4  4  1  1
          0.78990000          1.00000000
# BORON
B  aug-cc-pV5Z
 18
  1  0  0 14  6
      68260.00000000          0.00002400         -0.00000500          0.00000000          0.00000000          0.00000000          0.00000000
      10230.00000000          0.00018500         -0.00003700          0.00000000          0.00000000          0.00000000          0.00000000
       2328.00000000          0.00097000         -0.00019600          0.00000000          0.00000000          0.00000000          0.00000000
        660.40000000          0.00405600         -0.00082400          0.00000000          0.00000000          0.00000000          0.00000000
        216.20000000          0.01439900         -0.00292300          0.00000000          0.00000000          0.00000000          0.00000000
         78.60000000          0.04390100         -0.00913800          0.00000000          0.00000000          0.00000000          0.00000000
         30.98000000          0.11305700         -0.02410500          0.00000000          0.00000000          0.00000000          0.00000000
         12.96000000          0.23382500         -0.05475500          0.00000000          0.00000000          0.00000000          0.00000000
          5.65900000          0.35396000         -0.09694300          0.00000000          0.00000000          0.00000000          0.00000000
          2.55600000          0.30154700         -0.13748500          0.00000000          0.00000000          0.00000000          0.00000000
          1.17500000          0.08752100         -0.04456500          1.00000000          0.00000000          0.00000000          0.00000000
          0.42490000          0.00281900          0.32434500          0.00000000          1.00000000          0.00000000          0.00000000
          0.17120000          0.00004300          0.57041400          0.00000000          0.00000000          1.00000000          0.00000000
          0.06913000          0.00007800          0.24344400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
         66.44000000          0.00083800          0.00000000          0.00000000          0.00000000          0.00000000
         15.71000000          0.00640900          0.00000000          0.00000000          0.00000000          0.00000000
          4.93600000          0.02808100          0.00000000          0.00000000          0.00000000          0.00000000
          1.77000000          0.09215200          0.00000000          0.00000000          0.00000000          0.00000000
          0.70080000          0.22416400          1.00000000          0.00000000          0.00000000          0.00000000
          0.29010000          0.36991500          0.00000000          1.00000000          0.00000000          0.00000000
          0.12110000          0.37444100          0.00000000          0.00000000          1.00000000          0.00000000
          0.04973000          0.13908600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          2.01000000          1.00000000
  1  2  2  1  1
          0.79600000          1.00000000
  1  2  2  1  1
          0.31600000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  3  3  1  1
          1.21500000          1.00000000
  1  3  3  1  1
          0.52500000          1.00000000
  1  3  3  1  1
          0.22700000          1.00000000
  1  4  4  1  1
          1.12400000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
  1  5  5  1  1
          0.83400000          1.00000000
  1  0  0  1  1
          0.02610000          1.00000000
  1  1  1  1  1
          0.01570000          1.00000000
  1  2  2  1  1
          0.04310000          1.00000000
  1  3  3  1  1
          0.08430000          1.00000000
  1  4  4  1  1
          0.20200000          1.00000000
  1  5  5  1  1
          0.38400000          1.00000000
# CARBON
C  aug-cc-pV5Z
 18
  1  0  0 14  6
      96770.00000000          0.00002500         -0.00000500          0.00000000          0.00000000          0.00000000          0.00000000
      14500.00000000          0.00019000         -0.00004100          0.00000000          0.00000000          0.00000000          0.00000000
       3300.00000000          0.00100000         -0.00021300          0.00000000          0.00000000          0.00000000          0.00000000
        935.80000000          0.00418300         -0.00089700          0.00000000          0.00000000          0.00000000          0.00000000
        306.20000000          0.01485900         -0.00318700          0.00000000          0.00000000          0.00000000          0.00000000
        111.30000000          0.04530100         -0.00996100          0.00000000          0.00000000          0.00000000          0.00000000
         43.90000000          0.11650400         -0.02637500          0.00000000          0.00000000          0.00000000          0.00000000
         18.40000000          0.24024900         -0.06000100          0.00000000          0.00000000          0.00000000          0.00000000
          8.05400000          0.35879900         -0.10682500          0.00000000          0.00000000          0.00000000          0.00000000
          3.63700000          0.29394100         -0.14416600          0.00000000          0.00000000          0.00000000          0.00000000
          1.65600000          0.07766500         -0.02464420          1.00000000          0.00000000          0.00000000          0.00000000
          0.63330000          0.00233300          0.34900900          0.00000000          1.00000000          0.00000000          0.00000000
          0.25450000          0.00050500          0.55873700          0.00000000          0.00000000          1.00000000          0.00000000
          0.10190000          0.00003000          0.22810200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        101.80000000          0.00089100          0.00000000          0.00000000          0.00000000          0.00000000
         24.04000000          0.00697600          0.00000000          0.00000000          0.00000000          0.00000000
          7.57100000          0.03166900          0.00000000          0.00000000          0.00000000          0.00000000
          2.73200000          0.10400600          0.00000000          0.00000000          0.00000000          0.00000000
          1.08500000          0.24163300          1.00000000          0.00000000          0.00000000          0.00000000
          0.44960000          0.37194600          0.00000000          1.00000000          0.00000000          0.00000000
          0.18760000          0.35420000          0.00000000          0.00000000          1.00000000          0.00000000
          0.07606000          0.13156800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          3.13400000          1.00000000
  1  2  2  1  1
          1.23300000          1.00000000
  1  2  2  1  1
          0.48500000          1.00000000
  1  2  2  1  1
          0.19100000          1.00000000
  1  3  3  1  1
          2.00600000          1.00000000
  1  3  3  1  1
          0.83800000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.75300000          1.00000000
  1  4  4  1  1
          0.67800000          1.00000000
  1  5  5  1  1
          1.25900000          1.00000000
  1  0  0  1  1
          0.03940000          1.00000000
  1  1  1  1  1
          0.02720000          1.00000000
  1  2  2  1  1
          0.07010000          1.00000000
  1  3  3  1  1
          0.13800000          1.00000000
  1  4  4  1  1
          0.31900000          1.00000000
  1  5  5  1  1
          0.58600000          1.00000000
# NITROGEN
N  aug-cc-pV5Z
 18
  1  0  0 14  6
     129200.00000000          0.00002500         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      19350.00000000          0.00019700         -0.00004300          0.00000000          0.00000000          0.00000000          0.00000000
       4404.00000000          0.00103200         -0.00022700          0.00000000          0.00000000          0.00000000          0.00000000
       1248.00000000          0.00432500         -0.00095800          0.00000000          0.00000000          0.00000000          0.00000000
        408.00000000          0.01538000         -0.00341600          0.00000000          0.00000000          0.00000000          0.00000000
        148.20000000          0.04686700         -0.01066700          0.00000000          0.00000000          0.00000000          0.00000000
         58.50000000          0.12011600         -0.02827900          0.00000000          0.00000000          0.00000000          0.00000000
         24.59000000          0.24569500         -0.06402000          0.00000000          0.00000000          0.00000000          0.00000000
         10.81000000          0.36137900         -0.11393200          0.00000000          0.00000000          0.00000000          0.00000000
          4.88200000          0.28728300         -0.14699500          0.00000000          0.00000000          0.00000000          0.00000000
          2.19500000          0.07017100         -0.00725100          1.00000000          0.00000000          0.00000000          0.00000000
          0.87150000          0.00183100          0.36618300          0.00000000          1.00000000          0.00000000          0.00000000
          0.35040000          0.00083500          0.54790800          0.00000000          0.00000000          1.00000000          0.00000000
          0.13970000         -0.00000600          0.21664500          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        147.00000000          0.00089200          0.00000000          0.00000000          0.00000000          0.00000000
         34.76000000          0.00708200          0.00000000          0.00000000          0.00000000          0.00000000
         11.00000000          0.03281600          0.00000000          0.00000000          0.00000000          0.00000000
          3.99500000          0.10820900          0.00000000          0.00000000          0.00000000          0.00000000
          1.58700000          0.24809400          1.00000000          0.00000000          0.00000000          0.00000000
          0.65330000          0.37451300          0.00000000          1.00000000          0.00000000          0.00000000
          0.26860000          0.34841400          0.00000000          0.00000000          1.00000000          0.00000000
          0.10670000          0.12834000          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          4.64700000          1.00000000
  1  2  2  1  1
          1.81300000          1.00000000
  1  2  2  1  1
          0.70700000          1.00000000
  1  2  2  1  1
          0.27600000          1.00000000
  1  3  3  1  1
          2.94200000          1.00000000
  1  3  3  1  1
          1.20400000          1.00000000
  1  3  3  1  1
          0.49300000          1.00000000
  1  4  4  1  1
          2.51100000          1.00000000
  1  4  4  1  1
          0.94200000          1.00000000
  1  5  5  1  1
          1.76800000          1.00000000
  1  0  0  1  1
          0.05180000          1.00000000
  1  1  1  1  1
          0.03690000          1.00000000
  1  2  2  1  1
          0.09710000          1.00000000
  1  3  3  1  1
          0.19200000          1.00000000
  1  4  4  1  1
          0.43600000          1.00000000
  1  5  5  1  1
          0.78800000          1.00000000
# OXYGEN
O  aug-cc-pV5Z
 18
  1  0  0 14  6
     164200.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      24590.00000000          0.00020500         -0.00004600          0.00000000          0.00000000          0.00000000          0.00000000
       5592.00000000          0.00107600         -0.00024400          0.00000000          0.00000000          0.00000000          0.00000000
       1582.00000000          0.00452200         -0.00103100          0.00000000          0.00000000          0.00000000          0.00000000
        516.10000000          0.01610800         -0.00368800          0.00000000          0.00000000          0.00000000          0.00000000
        187.20000000          0.04908500         -0.01151400          0.00000000          0.00000000          0.00000000          0.00000000
         73.93000000          0.12485700         -0.03043500          0.00000000          0.00000000          0.00000000          0.00000000
         31.22000000          0.25168600         -0.06814700          0.00000000          0.00000000          0.00000000          0.00000000
         13.81000000          0.36242000         -0.12036800          0.00000000          0.00000000          0.00000000          0.00000000
          6.25600000          0.27905100         -0.14826000          0.00000000          0.00000000          0.00000000          0.00000000
          2.77600000          0.06355200          0.00990500          1.00000000          0.00000000          0.00000000          0.00000000
          1.13800000          0.00106300          0.38428600          0.00000000          1.00000000          0.00000000          0.00000000
          0.46000000          0.00114400          0.53680500          0.00000000          0.00000000          1.00000000          0.00000000
          0.18290000         -0.00004000          0.20268700          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        195.50000000          0.00091800          0.00000000          0.00000000          0.00000000          0.00000000
         46.16000000          0.00738800          0.00000000          0.00000000          0.00000000          0.00000000
         14.58000000          0.03495800          0.00000000          0.00000000          0.00000000          0.00000000
          5.29600000          0.11543100          0.00000000          0.00000000          0.00000000          0.00000000
          2.09400000          0.25680300          1.00000000          0.00000000          0.00000000          0.00000000
          0.84710000          0.37393800          0.00000000          1.00000000          0.00000000          0.00000000
          0.33680000          0.34344700          0.00000000          0.00000000          1.00000000          0.00000000
          0.12850000          0.12970600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          5.87900000          1.00000000
  1  2  2  1  1
          2.30700000          1.00000000
  1  2  2  1  1
          0.90500000          1.00000000
  1  2  2  1  1
          0.35500000          1.00000000
  1  3  3  1  1
          4.01600000          1.00000000
  1  3  3  1  1
          1.55400000          1.00000000
  1  3  3  1  1
          0.60100000          1.00000000
  1  4  4  1  1
          3.35000000          1.00000000
  1  4  4  1  1
          1.18900000          1.00000000
  1  5  5  1  1
          2.31900000          1.00000000
  1  0  0  1  1
          0.06550000          1.00000000
  1  1  1  1  1
          0.04460000          1.00000000
  1  2  2  1  1
          0.13100000          1.00000000
  1  3  3  1  1
          0.23700000          1.00000000
  1  4  4  1  1
          0.51700000          1.00000000
  1  5  5  1  1
          1.02400000          1.00000000
# FLUORINE
F  aug-cc-pV5Z
 18
  1  0  0 14  6
     211400.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      31660.00000000          0.00020100         -0.00004700          0.00000000          0.00000000          0.00000000          0.00000000
       7202.00000000          0.00105600         -0.00024400          0.00000000          0.00000000          0.00000000          0.00000000
       2040.00000000          0.00443200         -0.00103100          0.00000000          0.00000000          0.00000000          0.00000000
        666.40000000          0.01576600         -0.00368300          0.00000000          0.00000000          0.00000000          0.00000000
        242.00000000          0.04811200         -0.01151300          0.00000000          0.00000000          0.00000000          0.00000000
         95.53000000          0.12323200         -0.03066300          0.00000000          0.00000000          0.00000000          0.00000000
         40.23000000          0.25151900         -0.06957200          0.00000000          0.00000000          0.00000000          0.00000000
         17.72000000          0.36452500         -0.12399200          0.00000000          0.00000000          0.00000000          0.00000000
          8.00500000          0.27976600         -0.15021400          0.00000000          0.00000000          0.00000000          0.00000000
          3.53800000          0.06354500          0.01646000          1.00000000          0.00000000          0.00000000          0.00000000
          1.45800000          0.00111100          0.39255000          0.00000000          1.00000000          0.00000000          0.00000000
          0.58870000          0.00125800          0.53216400          0.00000000          0.00000000          1.00000000          0.00000000
          0.23240000         -0.00003500          0.19652400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        241.90000000          0.00100200          0.00000000          0.00000000          0.00000000          0.00000000
         57.17000000          0.00805400          0.00000000          0.00000000          0.00000000          0.00000000
         18.13000000          0.03804800          0.00000000          0.00000000          0.00000000          0.00000000
          6.62400000          0.12377900          0.00000000          0.00000000          0.00000000          0.00000000
          2.62200000          0.26606000          1.00000000          0.00000000          0.00000000          0.00000000
          1.05700000          0.37179600          0.00000000          1.00000000          0.00000000          0.00000000
          0.41760000          0.33289000          0.00000000          0.00000000          1.00000000          0.00000000
          0.15740000          0.12849100          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          7.76000000          1.00000000
  1  2  2  1  1
          3.03200000          1.00000000
  1  2  2  1  1
          1.18500000          1.00000000
  1  2  2  1  1
          0.46300000          1.00000000
  1  3  3  1  1
          5.39800000          1.00000000
  1  3  3  1  1
          2.07800000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  4  4  1  1
          4.33800000          1.00000000
  1  4  4  1  1
          1.51300000          1.00000000
  1  5  5  1  1
          2.99500000          1.00000000
  1  0  0  1  1
          0.08060000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  2  2  1  1
          0.17200000          1.00000000
  1  3  3  1  1
          0.33100000          1.00000000
  1  4  4  1  1
          0.66300000          1.00000000
  1  5  5  1  1
          1.32600000          1.00000000
# NEON
Ne aug-cc-pV5Z
 18
  1  0  0 14  6
     262700.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      39350.00000000          0.00020000         -0.00004700          0.00000000          0.00000000          0.00000000          0.00000000
       8955.00000000          0.00105000         -0.00024700          0.00000000          0.00000000          0.00000000          0.00000000
       2538.00000000          0.00440000         -0.00103800          0.00000000          0.00000000          0.00000000          0.00000000
        829.90000000          0.01564900         -0.00371100          0.00000000          0.00000000          0.00000000          0.00000000
        301.50000000          0.04775800         -0.01159300          0.00000000          0.00000000          0.00000000          0.00000000
        119.00000000          0.12294300         -0.03108600          0.00000000          0.00000000          0.00000000          0.00000000
         50.00000000          0.25248300         -0.07097200          0.00000000          0.00000000          0.00000000          0.00000000
         21.98000000          0.36631400         -0.12726600          0.00000000          0.00000000          0.00000000          0.00000000
          9.89100000          0.27961700         -0.15123100          0.00000000          0.00000000          0.00000000          0.00000000
          4.32700000          0.06165100          0.02466600          1.00000000          0.00000000          0.00000000          0.00000000
          1.80400000          0.00093400          0.39961200          0.00000000          1.00000000          0.00000000          0.00000000
          0.72880000          0.00136700          0.52661600          0.00000000          0.00000000          1.00000000          0.00000000
          0.28670000         -0.00003800          0.19085400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        299.10000000          0.00103800          0.00000000          0.00000000          0.00000000          0.00000000
         70.73000000          0.00837500          0.00000000          0.00000000          0.00000000          0.00000000
         22.48000000          0.03969300          0.00000000          0.00000000          0.00000000          0.00000000
          8.24600000          0.12805600          0.00000000          0.00000000          0.00000000          0.00000000
          3.26900000          0.27032500          1.00000000          0.00000000          0.00000000          0.00000000
          1.31500000          0.37096300          0.00000000          1.00000000          0.00000000          0.00000000
          0.51580000          0.32849900          0.00000000          0.00000000          1.00000000          0.00000000
          0.19180000          0.12758800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          9.83700000          1.00000000
  1  2  2  1  1
          3.84400000          1.00000000
  1  2  2  1  1
          1.50200000          1.00000000
  1  2  2  1  1
          0.58700000          1.00000000
  1  3  3  1  1
          7.09000000          1.00000000
  1  3  3  1  1
          2.73800000          1.00000000
  1  3  3  1  1
          1.05700000          1.00000000
  1  4  4  1  1
          5.46000000          1.00000000
  1  4  4  1  1
          1.88000000          1.00000000
  1  5  5  1  1
          3.77600000          1.00000000
  1  0  0  1  1
          0.09570000          1.00000000
  1  1  1  1  1
          0.06540000          1.00000000
  1  2  2  1  1
          0.21300000          1.00000000
  1  3  3  1  1
          0.42500000          1.00000000
  1  4  4  1  1
          0.80900000          1.00000000
  1  5  5  1  1
          1.62800000          1.00000000
# ALUMINUM
Al aug-cc-pV5Z
 18
  1  0  0 20  7
    3269000.00000000          0.00000214         -0.00000056          0.00000013          0.00000000          0.00000000          0.00000000          0.00000000
     489400.00000000          0.00001663         -0.00000432          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000
     111400.00000000          0.00008752         -0.00002274          0.00000525          0.00000000          0.00000000          0.00000000          0.00000000
      31560.00000000          0.00036899         -0.00009601          0.00002214          0.00000000          0.00000000          0.00000000          0.00000000
      10320.00000000          0.00133903         -0.00034838          0.00008055          0.00000000          0.00000000          0.00000000          0.00000000
       3731.00000000          0.00435636         -0.00113836          0.00026251          0.00000000          0.00000000          0.00000000          0.00000000
       1456.00000000          0.01289550         -0.00338744          0.00078422          0.00000000          0.00000000          0.00000000          0.00000000
        604.10000000          0.03482010         -0.00931505          0.00215039          0.00000000          0.00000000          0.00000000          0.00000000
        263.50000000          0.08435300         -0.02330230          0.00541974          0.00000000          0.00000000          0.00000000          0.00000000
        119.80000000          0.17590700         -0.05234860          0.01216860          0.00000000          0.00000000          0.00000000          0.00000000
         56.32000000          0.29209100         -0.09994990          0.02368230          0.00000000          0.00000000          0.00000000          0.00000000
         27.19000000          0.32822000         -0.15056000          0.03609370          0.00000000          0.00000000          0.00000000          0.00000000
         13.26000000          0.18692700         -0.11912100          0.03032840          0.00000000          0.00000000          0.00000000          0.00000000
          6.05200000          0.03104300          0.10809100         -0.03090340          0.00000000          0.00000000          0.00000000          0.00000000
          2.98100000         -0.00050892          0.41112900         -0.11912600          0.00000000          0.00000000          0.00000000          0.00000000
          1.47600000          0.00148836          0.45721400         -0.21114500          0.00000000          0.00000000          0.00000000          0.00000000
          0.73340000         -0.00027824          0.17593800         -0.15794400          1.00000000          0.00000000          0.00000000          0.00000000
          0.24470000          0.00011875          0.00770610          0.33903800          0.00000000          1.00000000          0.00000000          0.00000000
          0.10880000         -0.00006615         -0.00166168          0.61309700          0.00000000          0.00000000          1.00000000          0.00000000
          0.04672000          0.00001760          0.00044535          0.23516800          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       1461.00000000          0.00020861         -0.00003719          0.00000000          0.00000000          0.00000000          0.00000000
        346.20000000          0.00181005         -0.00032856          0.00000000          0.00000000          0.00000000          0.00000000
        112.20000000          0.00973433         -0.00174264          0.00000000          0.00000000          0.00000000          0.00000000
         42.51000000          0.03782660         -0.00694828          0.00000000          0.00000000          0.00000000          0.00000000
         17.72000000          0.11089800         -0.02028070          0.00000000          0.00000000          0.00000000          0.00000000
          7.85200000          0.23429500         -0.04486570          0.00000000          0.00000000          0.00000000          0.00000000
          3.57100000          0.34524500         -0.06432780          0.00000000          0.00000000          0.00000000          0.00000000
          1.63700000          0.33143000         -0.07526660          0.00000000          0.00000000          0.00000000          0.00000000
          0.73820000          0.14706400          0.00061601          1.00000000          0.00000000          0.00000000          0.00000000
          0.25770000          0.01214110          0.28781900          0.00000000          1.00000000          0.00000000          0.00000000
          0.09773000         -0.00087164          0.54303000          0.00000000          0.00000000          1.00000000          0.00000000
          0.03690000          0.00043796          0.30186500          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          1.31700000          1.00000000
  1  2  2  1  1
          0.52600000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  2  2  1  1
          0.08400000          1.00000000
  1  3  3  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          0.25800000          1.00000000
  1  3  3  1  1
          0.51300000          1.00000000
  1  4  4  1  1
          0.25200000          1.00000000
  1  4  4  1  1
          0.54300000          1.00000000
  1  5  5  1  1
          0.44600000          1.00000000
  1  0  0  1  1
          0.01770000          1.00000000
  1  1  1  1  1
          0.01150000          1.00000000
  1  2  2  1  1
          0.02940000          1.00000000
  1  3  3  1  1
          0.05090000          1.00000000
  1  4  4  1  1
          0.10690000          1.00000000
  1  5  5  1  1
          0.22700000          1.00000000
# SILICON
Si aug-cc-pV5Z
 18
  1  0  0 20  7
    3948000.00000000          0.00000204         -0.00000054          0.00000014          0.00000000          0.00000000          0.00000000          0.00000000
     591100.00000000          0.00001584         -0.00000422          0.00000108          0.00000000          0.00000000          0.00000000          0.00000000
     134500.00000000          0.00008336         -0.00002218          0.00000569          0.00000000          0.00000000          0.00000000          0.00000000
      38120.00000000          0.00035136         -0.00009360          0.00002395          0.00000000          0.00000000          0.00000000          0.00000000
      12460.00000000          0.00127660         -0.00034012          0.00008724          0.00000000          0.00000000          0.00000000          0.00000000
       4504.00000000          0.00415191         -0.00111061          0.00028416          0.00000000          0.00000000          0.00000000          0.00000000
       1758.00000000          0.01230300         -0.00330878          0.00084984          0.00000000          0.00000000          0.00000000          0.00000000
        729.10000000          0.03331020         -0.00911602          0.00233527          0.00000000          0.00000000          0.00000000          0.00000000
        318.00000000          0.08098450         -0.02287900          0.00590466          0.00000000          0.00000000          0.00000000          0.00000000
        144.60000000          0.17029000         -0.05171190          0.01334610          0.00000000          0.00000000          0.00000000          0.00000000
         67.97000000          0.28687900         -0.09990910          0.02628890          0.00000000          0.00000000          0.00000000          0.00000000
         32.82000000          0.33034000         -0.15274700          0.04074260          0.00000000          0.00000000          0.00000000          0.00000000
         16.03000000          0.19660200         -0.12750800          0.03614760          0.00000000          0.00000000          0.00000000          0.00000000
          7.39600000          0.03545350          0.09469630         -0.03039230          0.00000000          0.00000000          0.00000000          0.00000000
          3.66100000         -0.00053520          0.41403600         -0.13596100          0.00000000          0.00000000          0.00000000          0.00000000
          1.82300000          0.00161465          0.46793400         -0.25014400          0.00000000          0.00000000          0.00000000          0.00000000
          0.91470000         -0.00037274          0.17392700         -0.15805000          1.00000000          0.00000000          0.00000000          0.00000000
          0.33930000          0.00014623          0.00843895          0.36965500          0.00000000          1.00000000          0.00000000          0.00000000
          0.15000000         -0.00007894         -0.00099807          0.61771800          0.00000000          0.00000000          1.00000000          0.00000000
          0.06438000          0.00001928          0.00036210          0.22251400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       1780.00000000          0.00020121         -0.00004272          0.00000000          0.00000000          0.00000000          0.00000000
        421.80000000          0.00174937         -0.00037704          0.00000000          0.00000000          0.00000000          0.00000000
        136.70000000          0.00948141         -0.00202240          0.00000000          0.00000000          0.00000000          0.00000000
         51.81000000          0.03723130         -0.00812833          0.00000000          0.00000000          0.00000000          0.00000000
         21.60000000          0.11076300         -0.02422720          0.00000000          0.00000000          0.00000000          0.00000000
          9.56300000          0.23793300         -0.05438250          0.00000000          0.00000000          0.00000000          0.00000000
          4.35000000          0.35369100         -0.07990510          0.00000000          0.00000000          0.00000000          0.00000000
          2.00600000          0.32883900         -0.08889580          0.00000000          0.00000000          0.00000000          0.00000000
          0.92050000          0.13237300          0.01839970          1.00000000          0.00000000          0.00000000          0.00000000
          0.35000000          0.01033000          0.33509600          0.00000000          1.00000000          0.00000000          0.00000000
          0.13810000         -0.00015030          0.53228800          0.00000000          0.00000000          1.00000000          0.00000000
          0.05338000          0.00026581          0.25437400          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.12600000          1.00000000
  1  2  2  1  1
          0.32100000          1.00000000
  1  2  2  1  1
          0.81700000          1.00000000
  1  2  2  1  1
          2.08200000          1.00000000
  1  3  3  1  1
          0.16900000          1.00000000
  1  3  3  1  1
          0.34100000          1.00000000
  1  3  3  1  1
          0.68800000          1.00000000
  1  4  4  1  1
          0.32000000          1.00000000
  1  4  4  1  1
          0.70500000          1.00000000
  1  5  5  1  1
          0.58300000          1.00000000
  1  0  0  1  1
          0.02600000          1.00000000
  1  1  1  1  1
          0.01920000          1.00000000
  1  2  2  1  1
          0.04680000          1.00000000
  1  3  3  1  1
          0.07350000          1.00000000
  1  4  4  1  1
          0.15100000          1.00000000
  1  5  5  1  1
          0.32300000          1.00000000
# PHOSPHOROUS
P  aug-cc-pV5Z
 18
  1  0  0 20  7
    4666000.00000000          0.00000197         -0.00000053          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     698600.00000000          0.00001530         -0.00000415          0.00000114          0.00000000          0.00000000          0.00000000          0.00000000
     159000.00000000          0.00008048         -0.00002185          0.00000601          0.00000000          0.00000000          0.00000000          0.00000000
      45040.00000000          0.00033974         -0.00009233          0.00002534          0.00000000          0.00000000          0.00000000          0.00000000
      14720.00000000          0.00123291         -0.00033511          0.00009216          0.00000000          0.00000000          0.00000000          0.00000000
       5323.00000000          0.00401345         -0.00109508          0.00030056          0.00000000          0.00000000          0.00000000          0.00000000
       2076.00000000          0.01191240         -0.00326798          0.00089988          0.00000000          0.00000000          0.00000000          0.00000000
        861.10000000          0.03225110         -0.00899951          0.00247354          0.00000000          0.00000000          0.00000000          0.00000000
        375.70000000          0.07866430         -0.02265280          0.00626812          0.00000000          0.00000000          0.00000000          0.00000000
        170.80000000          0.16645800         -0.05146500          0.01425980          0.00000000          0.00000000          0.00000000          0.00000000
         80.29000000          0.28303900         -0.10018600          0.02827690          0.00000000          0.00000000          0.00000000          0.00000000
         38.77000000          0.33194200         -0.15507500          0.04451240          0.00000000          0.00000000          0.00000000          0.00000000
         18.93000000          0.20335200         -0.13381800          0.04072170          0.00000000          0.00000000          0.00000000          0.00000000
          8.79600000          0.03831830          0.08783610         -0.03019080          0.00000000          0.00000000          0.00000000          0.00000000
          4.35800000         -0.00038472          0.42258100         -0.15289400          0.00000000          0.00000000          0.00000000          0.00000000
          2.17400000          0.00158744          0.47489900         -0.28241100          0.00000000          0.00000000          0.00000000          0.00000000
          1.09500000         -0.00041338          0.16500200         -0.14852200          1.00000000          0.00000000          0.00000000          0.00000000
          0.44000000          0.00015284          0.00846862          0.39356300          0.00000000          1.00000000          0.00000000          0.00000000
          0.19450000         -0.00008270         -0.00029176          0.61732700          0.00000000          0.00000000          1.00000000          0.00000000
          0.08376000          0.00001841          0.00028534          0.21461200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2010.00000000          0.00021592         -0.00005114          0.00000000          0.00000000          0.00000000          0.00000000
        476.30000000          0.00187536         -0.00044836          0.00000000          0.00000000          0.00000000          0.00000000
        154.40000000          0.01017420         -0.00242340          0.00000000          0.00000000          0.00000000          0.00000000
         58.51000000          0.03998560         -0.00969826          0.00000000          0.00000000          0.00000000          0.00000000
         24.40000000          0.11856300         -0.02909650          0.00000000          0.00000000          0.00000000          0.00000000
         10.80000000          0.25181600         -0.06417260          0.00000000          0.00000000          0.00000000          0.00000000
          4.91300000          0.36656500         -0.09450710          0.00000000          0.00000000          0.00000000          0.00000000
          2.26900000          0.31617700         -0.09347000          0.00000000          0.00000000          0.00000000          0.00000000
          1.04300000          0.10470000          0.05206110          1.00000000          0.00000000          0.00000000          0.00000000
          0.43130000          0.00609862          0.37462400          0.00000000          1.00000000          0.00000000          0.00000000
          0.17670000          0.00050208          0.50909700          0.00000000          0.00000000          1.00000000          0.00000000
          0.07009000         -0.00002956          0.21511600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.16600000          1.00000000
  1  2  2  1  1
          0.41800000          1.00000000
  1  2  2  1  1
          1.05400000          1.00000000
  1  2  2  1  1
          2.65600000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.92300000          1.00000000
  1  4  4  1  1
          0.41200000          1.00000000
  1  4  4  1  1
          0.90300000          1.00000000
  1  5  5  1  1
          0.74500000          1.00000000
  1  0  0  1  1
          0.03350000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  2  2  1  1
          0.06240000          1.00000000
  1  3  3  1  1
          0.09500000          1.00000000
  1  4  4  1  1
          0.18400000          1.00000000
  1  5  5  1  1
          0.37200000          1.00000000
# SULFUR
S  aug-cc-pV5Z
 18
  1  0  0 20  7
    5481000.00000000          0.00000189         -0.00000052          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     820600.00000000          0.00001472         -0.00000407          0.00000118          0.00000000          0.00000000          0.00000000          0.00000000
     186700.00000000          0.00007751         -0.00002141          0.00000622          0.00000000          0.00000000          0.00000000          0.00000000
      52880.00000000          0.00032722         -0.00009045          0.00002624          0.00000000          0.00000000          0.00000000          0.00000000
      17250.00000000          0.00119365         -0.00033008          0.00009590          0.00000000          0.00000000          0.00000000          0.00000000
       6226.00000000          0.00388393         -0.00107782          0.00031268          0.00000000          0.00000000          0.00000000          0.00000000
       2429.00000000          0.01153360         -0.00321874          0.00093632          0.00000000          0.00000000          0.00000000          0.00000000
       1007.00000000          0.03127480         -0.00887217          0.00257790          0.00000000          0.00000000          0.00000000          0.00000000
        439.50000000          0.07643870         -0.02237710          0.00654121          0.00000000          0.00000000          0.00000000          0.00000000
        199.80000000          0.16270000         -0.05105770          0.01496300          0.00000000          0.00000000          0.00000000          0.00000000
         93.92000000          0.27932800         -0.10022500          0.02989400          0.00000000          0.00000000          0.00000000          0.00000000
         45.34000000          0.33314500         -0.15679500          0.04769460          0.00000000          0.00000000          0.00000000          0.00000000
         22.15000000          0.20983600         -0.13974800          0.04495560          0.00000000          0.00000000          0.00000000          0.00000000
         10.34000000          0.04159740          0.08100590         -0.02930090          0.00000000          0.00000000          0.00000000          0.00000000
          5.11900000         -0.00045055          0.43088300         -0.16891600          0.00000000          0.00000000          0.00000000          0.00000000
          2.55300000          0.00168855          0.48168800         -0.31101400          0.00000000          0.00000000          0.00000000          0.00000000
          1.28200000         -0.00051724          0.15686200         -0.13649100          1.00000000          0.00000000          0.00000000          0.00000000
          0.54500000          0.00018877          0.00788814          0.42319500          0.00000000          1.00000000          0.00000000          0.00000000
          0.24110000         -0.00009977          0.00039353          0.61388800          0.00000000          0.00000000          1.00000000          0.00000000
          0.10350000          0.00002090          0.00022376          0.20047300          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2200.00000000          0.00023905         -0.00006086          0.00000000          0.00000000          0.00000000          0.00000000
        521.40000000          0.00207686         -0.00053042          0.00000000          0.00000000          0.00000000          0.00000000
        169.00000000          0.01123630         -0.00287915          0.00000000          0.00000000          0.00000000          0.00000000
         64.05000000          0.04406900         -0.01143970          0.00000000          0.00000000          0.00000000          0.00000000
         26.72000000          0.12916800         -0.03427640          0.00000000          0.00000000          0.00000000          0.00000000
         11.83000000          0.26908300         -0.07358110          0.00000000          0.00000000          0.00000000          0.00000000
          5.37800000          0.37861100         -0.10778200          0.00000000          0.00000000          0.00000000          0.00000000
          2.48200000          0.29677900         -0.08797690          0.00000000          0.00000000          0.00000000          0.00000000
          1.11600000          0.07796760          0.10826100          1.00000000          0.00000000          0.00000000          0.00000000
          0.48480000          0.00205193          0.40708200          0.00000000          1.00000000          0.00000000          0.00000000
          0.20060000          0.00143602          0.46899400          0.00000000          0.00000000          1.00000000          0.00000000
          0.07951000         -0.00005960          0.18487700          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.20500000          1.00000000
  1  2  2  1  1
          0.51200000          1.00000000
  1  2  2  1  1
          1.28100000          1.00000000
  1  2  2  1  1
          3.20300000          1.00000000
  1  3  3  1  1
          0.25500000          1.00000000
  1  3  3  1  1
          0.52900000          1.00000000
  1  3  3  1  1
          1.09600000          1.00000000
  1  4  4  1  1
          0.46300000          1.00000000
  1  4  4  1  1
          1.07100000          1.00000000
  1  5  5  1  1
          0.87200000          1.00000000
  1  0  0  1  1
          0.04200000          1.00000000
  1  1  1  1  1
          0.02940000          1.00000000
  1  2  2  1  1
          0.07940000          1.00000000
  1  3  3  1  1
          0.11880000          1.00000000
  1  4  4  1  1
          0.22000000          1.00000000
  1  5  5  1  1
          0.47200000          1.00000000
# CHLORINE
Cl aug-cc-pV5Z
 18
  1  0  0 20  7
    6410000.00000000          0.00000181         -0.00000051          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     959600.00000000          0.00001411         -0.00000396          0.00000120          0.00000000          0.00000000          0.00000000          0.00000000
     218300.00000000          0.00007424         -0.00002081          0.00000630          0.00000000          0.00000000          0.00000000          0.00000000
      61810.00000000          0.00031413         -0.00008812          0.00002664          0.00000000          0.00000000          0.00000000          0.00000000
      20140.00000000          0.00114642         -0.00032174          0.00009742          0.00000000          0.00000000          0.00000000          0.00000000
       7264.00000000          0.00373888         -0.00105277          0.00031836          0.00000000          0.00000000          0.00000000          0.00000000
       2832.00000000          0.01109460         -0.00314183          0.00095238          0.00000000          0.00000000          0.00000000          0.00000000
       1175.00000000          0.03011520         -0.00866363          0.00262430          0.00000000          0.00000000          0.00000000          0.00000000
        512.60000000          0.07391450         -0.02193530          0.00668160          0.00000000          0.00000000          0.00000000          0.00000000
        233.00000000          0.15825800         -0.05025840          0.01535950          0.00000000          0.00000000          0.00000000          0.00000000
        109.50000000          0.27475300         -0.09954140          0.03094320          0.00000000          0.00000000          0.00000000          0.00000000
         52.86000000          0.33406600         -0.15764700          0.05006380          0.00000000          0.00000000          0.00000000          0.00000000
         25.84000000          0.21758900         -0.14602400          0.04897820          0.00000000          0.00000000          0.00000000          0.00000000
         12.17000000          0.04572780          0.06922300         -0.02608070          0.00000000          0.00000000          0.00000000          0.00000000
          6.03000000         -0.00013474          0.43041200         -0.17842600          0.00000000          0.00000000          0.00000000          0.00000000
          3.01200000          0.00163933          0.49080200         -0.33232400          0.00000000          0.00000000          0.00000000          0.00000000
          1.51100000         -0.00052221          0.15839000         -0.13200800          1.00000000          0.00000000          0.00000000          0.00000000
          0.66040000          0.00018065          0.00839885          0.44055600          0.00000000          1.00000000          0.00000000          0.00000000
          0.29260000         -0.00009993          0.00076848          0.61189100          0.00000000          0.00000000          1.00000000          0.00000000
          0.12540000          0.00001922          0.00022715          0.19317200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2548.00000000          0.00023570         -0.00006354          0.00000000          0.00000000          0.00000000          0.00000000
        603.70000000          0.00205158         -0.00055326          0.00000000          0.00000000          0.00000000          0.00000000
        195.60000000          0.01115430         -0.00302795          0.00000000          0.00000000          0.00000000          0.00000000
         74.15000000          0.04398160         -0.01206500          0.00000000          0.00000000          0.00000000          0.00000000
         30.94000000          0.12999400         -0.03663480          0.00000000          0.00000000          0.00000000          0.00000000
         13.69000000          0.27295900         -0.07907640          0.00000000          0.00000000          0.00000000          0.00000000
          6.22900000          0.38369000         -0.11742200          0.00000000          0.00000000          0.00000000          0.00000000
          2.87800000          0.29187000         -0.08609430          0.00000000          0.00000000          0.00000000          0.00000000
          1.28200000          0.07044640          0.14030800          1.00000000          0.00000000          0.00000000          0.00000000
          0.56410000          0.00128761          0.42233600          0.00000000          1.00000000          0.00000000          0.00000000
          0.23480000          0.00182623          0.44636300          0.00000000          0.00000000          1.00000000          0.00000000
          0.09312000          0.00001990          0.16663400          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.61800000          1.00000000
  1  2  2  1  1
          1.52900000          1.00000000
  1  2  2  1  1
          3.78100000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  3  3  1  1
          0.65600000          1.00000000
  1  3  3  1  1
          1.34500000          1.00000000
  1  4  4  1  1
          0.55600000          1.00000000
  1  4  4  1  1
          1.30200000          1.00000000
  1  5  5  1  1
          1.05300000          1.00000000
  1  0  0  1  1
          0.04790000          1.00000000
  1  1  1  1  1
          0.03480000          1.00000000
  1  2  2  1  1
          0.10030000          1.00000000
  1  3  3  1  1
          0.16400000          1.00000000
  1  4  4  1  1
          0.27700000          1.00000000
  1  5  5  1  1
          0.60700000          1.00000000
# ARGON
Ar aug-cc-pV5Z
 18
  1  0  0 20  7
    7401000.00000000          0.00000175         -0.00000050          0.00000016          0.00000000          0.00000000          0.00000000          0.00000000
    1108000.00000000          0.00001361         -0.00000387          0.00000121          0.00000000          0.00000000          0.00000000          0.00000000
     252100.00000000          0.00007163         -0.00002034          0.00000636          0.00000000          0.00000000          0.00000000          0.00000000
      71380.00000000          0.00030303         -0.00008609          0.00002689          0.00000000          0.00000000          0.00000000          0.00000000
      23260.00000000          0.00110608         -0.00031444          0.00009834          0.00000000          0.00000000          0.00000000          0.00000000
       8390.00000000          0.00360671         -0.00102841          0.00032129          0.00000000          0.00000000          0.00000000          0.00000000
       3271.00000000          0.01071321         -0.00307267          0.00096200          0.00000000          0.00000000          0.00000000          0.00000000
       1357.00000000          0.02910677         -0.00847532          0.00265245          0.00000000          0.00000000          0.00000000          0.00000000
        592.00000000          0.07166011         -0.02152008          0.00677035          0.00000000          0.00000000          0.00000000          0.00000000
        269.10000000          0.15414053         -0.04944932          0.01561727          0.00000000          0.00000000          0.00000000          0.00000000
        126.50000000          0.27041707         -0.09877592          0.03171666          0.00000000          0.00000000          0.00000000          0.00000000
         61.03000000          0.33485470         -0.15830822          0.05199742          0.00000000          0.00000000          0.00000000          0.00000000
         29.86000000          0.22434631         -0.15140298          0.05247514          0.00000000          0.00000000          0.00000000          0.00000000
         14.17000000          0.05000284          0.05824264         -0.02264147          0.00000000          0.00000000          0.00000000          0.00000000
          7.02200000          0.00006459          0.42938305         -0.18606229          0.00000000          0.00000000          0.00000000          0.00000000
          3.51100000          0.00168641          0.49908884         -0.35014547          0.00000000          0.00000000          0.00000000          0.00000000
          1.75800000         -0.00058096          0.16027837         -0.12768281          1.00000000          0.00000000          0.00000000          0.00000000
          0.78410000          0.00019670          0.00883960          0.45334533          0.00000000          1.00000000          0.00000000          0.00000000
          0.34800000         -0.00011125          0.00113130          0.60988242          0.00000000          0.00000000          1.00000000          0.00000000
          0.14910000          0.00002061          0.00022377          0.18809921          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2927.00000000          0.00023199         -0.00006491          0.00000000          0.00000000          0.00000000          0.00000000
        693.50000000          0.00202329         -0.00056531          0.00000000          0.00000000          0.00000000          0.00000000
        224.70000000          0.01103401         -0.00310988          0.00000000          0.00000000          0.00000000          0.00000000
         85.17000000          0.04383970         -0.01246964          0.00000000          0.00000000          0.00000000          0.00000000
         35.53000000          0.13035904         -0.03822465          0.00000000          0.00000000          0.00000000          0.00000000
         15.73000000          0.27574991         -0.08307918          0.00000000          0.00000000          0.00000000          0.00000000
          7.16500000          0.38764330         -0.12459409          0.00000000          0.00000000          0.00000000          0.00000000
          3.32200000          0.28740741         -0.08329713          0.00000000          0.00000000          0.00000000          0.00000000
          1.47800000          0.06575812          0.16398246          1.00000000          0.00000000          0.00000000          0.00000000
          0.65520000          0.00014739          0.43143123          0.00000000          1.00000000          0.00000000          0.00000000
          0.27510000          0.00113879          0.42904059          0.00000000          0.00000000          1.00000000          0.00000000
          0.10970000         -0.00025253          0.15400104          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.30900000          1.00000000
  1  2  2  1  1
          0.77000000          1.00000000
  1  2  2  1  1
          1.91700000          1.00000000
  1  2  2  1  1
          4.77600000          1.00000000
  1  3  3  1  1
          0.40800000          1.00000000
  1  3  3  1  1
          0.82500000          1.00000000
  1  3  3  1  1
          1.66800000          1.00000000
  1  4  4  1  1
          0.66500000          1.00000000
  1  4  4  1  1
          1.56200000          1.00000000
  1  5  5  1  1
          1.26400000          1.00000000
  1  0  0  1  1
          0.05380000          1.00000000
  1  1  1  1  1
          0.04020000          1.00000000
  1  2  2  1  1
          0.12100000          1.00000000
  1  3  3  1  1
          0.20900000          1.00000000
  1  4  4  1  1
          0.33400000          1.00000000
  1  5  5  1  1
          0.74200000          1.00000000
# GALLIUM
Ga aug-cc-pV5Z
 16
  1  0  0 26  8
  108615220.00000000          0.00000024         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   16264540.00000000          0.00000186         -0.00000058          0.00000022         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    3700111.60000000          0.00000980         -0.00000303          0.00000116         -0.00000027          0.00000000          0.00000000          0.00000000          0.00000000
    1047169.10000000          0.00004152         -0.00001287          0.00000491         -0.00000114          0.00000000          0.00000000          0.00000000          0.00000000
     341067.57000000          0.00015205         -0.00004714          0.00001798         -0.00000418          0.00000000          0.00000000          0.00000000          0.00000000
     122771.54000000          0.00050077         -0.00015530          0.00005920         -0.00001378          0.00000000          0.00000000          0.00000000          0.00000000
      47659.57800000          0.00151870         -0.00047180          0.00018010         -0.00004188          0.00000000          0.00000000          0.00000000          0.00000000
      19633.35400000          0.00430250         -0.00134050          0.00051140         -0.00011902          0.00000000          0.00000000          0.00000000          0.00000000
       8488.73470000          0.01145230         -0.00359550          0.00137400         -0.00031960          0.00000000          0.00000000          0.00000000          0.00000000
       3823.13810000          0.02856400         -0.00910160          0.00348180         -0.00081070          0.00000000          0.00000000          0.00000000          0.00000000
       1784.47550000          0.06574850         -0.02163600          0.00831690         -0.00193600          0.00000000          0.00000000          0.00000000          0.00000000
        860.05305000          0.13528950         -0.04733650          0.01831800         -0.00427220          0.00000000          0.00000000          0.00000000          0.00000000
        426.69867000          0.23455140         -0.09249970          0.03639030         -0.00849450          0.00000000          0.00000000          0.00000000          0.00000000
        217.26161000          0.30783510         -0.15043510          0.06080830         -0.01427090          0.00000000          0.00000000          0.00000000          0.00000000
        112.96987000          0.25299470         -0.17212270          0.07329390         -0.01726810          0.00000000          0.00000000          0.00000000          0.00000000
         59.44944100          0.09601040         -0.04401790          0.01974160         -0.00477820          0.00000000          0.00000000          0.00000000          0.00000000
         30.78225600          0.00978850          0.29738280         -0.16129700          0.03949270          0.00000000          0.00000000          0.00000000          0.00000000
         16.42321200          0.00059120          0.52797480         -0.40219480          0.10272000          0.00000000          0.00000000          0.00000000          0.00000000
          8.75788900         -0.00005540          0.30089050         -0.29272480          0.07735290          0.00000000          0.00000000          0.00000000          0.00000000
          4.40962900          0.00001380          0.04588190          0.27069420         -0.08495650          0.00000000          0.00000000          0.00000000          0.00000000
          2.24944900         -0.00006420          0.00128280          0.63597590         -0.22198340          0.00000000          0.00000000          0.00000000          0.00000000
          1.12611500          0.00001690          0.00125880          0.37024890         -0.25320890          0.00000000          0.00000000          0.00000000          0.00000000
          0.51548600         -0.00001160         -0.00020110          0.04028250         -0.03209540          1.00000000          0.00000000          0.00000000          0.00000000
          0.24257800          0.00000586          0.00011730         -0.00155540          0.43100170          0.00000000          1.00000000          0.00000000          0.00000000
          0.10708600         -0.00000229         -0.00004740          0.00055340          0.57776890          0.00000000          0.00000000          1.00000000          0.00000000
          0.04698800          0.00000061          0.00001120         -0.00007790          0.18148420          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      32152.19000000          0.00002830         -0.00001070          0.00000170          0.00000000          0.00000000          0.00000000          0.00000000
       7609.38420000          0.00025290         -0.00009580          0.00001580          0.00000000          0.00000000          0.00000000          0.00000000
       2471.47440000          0.00146860         -0.00055820          0.00009080          0.00000000          0.00000000          0.00000000          0.00000000
        946.06363000          0.00656270         -0.00250400          0.00041200          0.00000000          0.00000000          0.00000000          0.00000000
        401.94711000          0.02380230         -0.00919960          0.00149840          0.00000000          0.00000000          0.00000000          0.00000000
        183.64688000          0.07089450         -0.02799730          0.00462520          0.00000000          0.00000000          0.00000000          0.00000000
         88.53326400          0.16763840         -0.06887460          0.01127130          0.00000000          0.00000000          0.00000000          0.00000000
         44.27035500          0.29597540         -0.12738430          0.02132120          0.00000000          0.00000000          0.00000000          0.00000000
         22.72308300          0.34886100         -0.15858890          0.02595230          0.00000000          0.00000000          0.00000000          0.00000000
         11.82314100          0.21754960         -0.04249680          0.00663200          0.00000000          0.00000000          0.00000000          0.00000000
          6.04213500          0.05205110          0.24414400         -0.05017040          0.00000000          0.00000000          0.00000000          0.00000000
          3.03175400          0.00343780          0.44591110         -0.08429770          0.00000000          0.00000000          0.00000000          0.00000000
          1.49336600          0.00098330          0.35295220         -0.09030230          0.00000000          0.00000000          0.00000000          0.00000000
          0.70972700          0.00003910          0.10494460          0.01847270          1.00000000          0.00000000          0.00000000          0.00000000
          0.24859300          0.00004490          0.00524990          0.31232250          0.00000000          1.00000000          0.00000000          0.00000000
          0.09439500         -0.00001910         -0.00012190          0.53648160          0.00000000          0.00000000          1.00000000          0.00000000
          0.03588700          0.00000530          0.00012630          0.28316500          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1040.50460000          0.00008920          0.00000000          0.00000000          0.00000000
        314.59714000          0.00086250          0.00000000          0.00000000          0.00000000
        122.78760000          0.00500940          0.00000000          0.00000000          0.00000000
         54.76036900          0.01996490          0.00000000          0.00000000          0.00000000
         26.29894400          0.05832140          0.00000000          0.00000000          0.00000000
         13.26344500          0.13168680          0.00000000          0.00000000          0.00000000
          6.88506500          0.22186760          0.00000000          0.00000000          0.00000000
          3.57952500          0.28250590          0.00000000          0.00000000          0.00000000
          1.83156400          0.28319890          0.00000000          0.00000000          0.00000000
          0.91290900          0.21582510          1.00000000          0.00000000          0.00000000
          0.43534000          0.10524360          0.00000000          1.00000000          0.00000000
          0.18851800          0.02072320          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.07580000          1.00000000
  1  3  3  1  1
          0.13400000          1.00000000
  1  3  3  1  1
          0.28260000          1.00000000
  1  3  3  1  1
          0.59600000          1.00000000
  1  4  4  1  1
          0.27500000          1.00000000
  1  4  4  1  1
          0.61460000          1.00000000
  1  5  5  1  1
          0.49860000          1.00000000
  1  0  0  1  1
          0.01730100          1.00000000
  1  1  1  1  1
          0.01105000          1.00000000
  1  2  2  1  1
          0.02600000          1.00000000
  1  3  3  1  1
          0.05110000          1.00000000
  1  4  4  1  1
          0.11400000          1.00000000
  1  5  5  1  1
          0.25400000          1.00000000
# GERMANIUM
Ge aug-cc-pV5Z
 16
  1  0  0 26  8
  122001190.00000000          0.00000022         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   18257470.00000000          0.00000175         -0.00000054          0.00000021         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    4150821.50000000          0.00000920         -0.00000286          0.00000110         -0.00000028          0.00000000          0.00000000          0.00000000          0.00000000
    1174101.80000000          0.00003899         -0.00001213          0.00000467         -0.00000112          0.00000000          0.00000000          0.00000000          0.00000000
     382309.15000000          0.00014280         -0.00004443          0.00001713         -0.00000439          0.00000000          0.00000000          0.00000000          0.00000000
     137607.96000000          0.00047030         -0.00014640          0.00005640         -0.00001446          0.00000000          0.00000000          0.00000000          0.00000000
      53419.24200000          0.00142670         -0.00044470          0.00017150         -0.00004396          0.00000000          0.00000000          0.00000000          0.00000000
      22005.75600000          0.00404340         -0.00126370          0.00048720         -0.00012490          0.00000000          0.00000000          0.00000000          0.00000000
       9513.84790000          0.01077320         -0.00339200          0.00130970         -0.00033580          0.00000000          0.00000000          0.00000000          0.00000000
       4284.17560000          0.02692730         -0.00859790          0.00332320         -0.00085250          0.00000000          0.00000000          0.00000000          0.00000000
       1999.16640000          0.06223740         -0.02049640          0.00795910         -0.00204240          0.00000000          0.00000000          0.00000000          0.00000000
        963.24716000          0.12903820         -0.04505710          0.01760970         -0.00452450          0.00000000          0.00000000          0.00000000          0.00000000
        477.80500000          0.22673120         -0.08879220          0.03525760         -0.00907440          0.00000000          0.00000000          0.00000000          0.00000000
        243.31589000          0.30489030         -0.14662990          0.05976870         -0.01544830          0.00000000          0.00000000          0.00000000          0.00000000
        126.63999000          0.26176620         -0.17431400          0.07474060         -0.01943380          0.00000000          0.00000000          0.00000000          0.00000000
         66.78357900          0.10763480         -0.06116560          0.02778630         -0.00732890          0.00000000          0.00000000          0.00000000          0.00000000
         34.41608400          0.01262340          0.27166900         -0.14728780          0.03964850          0.00000000          0.00000000          0.00000000          0.00000000
         18.37281400          0.00039180          0.52802260         -0.39742020          0.11217960          0.00000000          0.00000000          0.00000000          0.00000000
          9.80546100          0.00008120          0.32401380         -0.32056660          0.09356860          0.00000000          0.00000000          0.00000000          0.00000000
          4.96940300         -0.00004890          0.05441770          0.23319680         -0.08064590          0.00000000          0.00000000          0.00000000          0.00000000
          2.54862300         -0.00003170          0.00144630          0.64248900         -0.25011090          0.00000000          0.00000000          0.00000000          0.00000000
          1.28459400         -0.00000109          0.00142480          0.39666840         -0.29780990          0.00000000          0.00000000          0.00000000          0.00000000
          0.58335300         -0.00000297         -0.00028400          0.04476960         -0.02201710          1.00000000          0.00000000          0.00000000          0.00000000
          0.29343900          0.00000185          0.00015850         -0.00260500          0.47231340          0.00000000          1.00000000          0.00000000          0.00000000
          0.13267200         -0.00000054         -0.00006560          0.00093570          0.56922160          0.00000000          0.00000000          1.00000000          0.00000000
          0.05923900          0.00000018          0.00001400         -0.00011330          0.16424980          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      32314.97000000          0.00003160         -0.00001220          0.00000240          0.00000000          0.00000000          0.00000000          0.00000000
       7648.20020000          0.00028200         -0.00010840          0.00002140          0.00000000          0.00000000          0.00000000          0.00000000
       2484.21140000          0.00163530         -0.00063110          0.00012430          0.00000000          0.00000000          0.00000000          0.00000000
        951.00305000          0.00728640         -0.00282430          0.00055890          0.00000000          0.00000000          0.00000000          0.00000000
        404.04833000          0.02629310         -0.01033170          0.00203830          0.00000000          0.00000000          0.00000000          0.00000000
        184.60354000          0.07759430         -0.03121020          0.00620160          0.00000000          0.00000000          0.00000000          0.00000000
         88.96412800          0.18036530         -0.07559540          0.01501060          0.00000000          0.00000000          0.00000000          0.00000000
         44.44774200          0.30953540         -0.13629440          0.02741270          0.00000000          0.00000000          0.00000000          0.00000000
         22.79907500          0.34547520         -0.15901500          0.03177960          0.00000000          0.00000000          0.00000000          0.00000000
         11.83592800          0.19632900         -0.01498050          0.00092280          0.00000000          0.00000000          0.00000000          0.00000000
          6.01129400          0.04090680          0.28682250         -0.06983420          0.00000000          0.00000000          0.00000000          0.00000000
          2.99578400          0.00241970          0.46266560         -0.11196000          0.00000000          0.00000000          0.00000000          0.00000000
          1.46957000          0.00080030          0.31685050         -0.09935650          0.00000000          0.00000000          0.00000000          0.00000000
          0.69068100         -0.00001860          0.06853800          0.05773180          1.00000000          0.00000000          0.00000000          0.00000000
          0.28616000          0.00004180          0.00190910          0.37395740          0.00000000          1.00000000          0.00000000          0.00000000
          0.11774200         -0.00001980          0.00068000          0.51165530          0.00000000          0.00000000          1.00000000          0.00000000
          0.04738500          0.00000470         -0.00007750          0.21535210          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1226.79820000          0.00007630          0.00000000          0.00000000          0.00000000
        371.23223000          0.00074250          0.00000000          0.00000000          0.00000000
        144.89099000          0.00437560          0.00000000          0.00000000          0.00000000
         64.60413000          0.01792570          0.00000000          0.00000000          0.00000000
         31.03973700          0.05392530          0.00000000          0.00000000          0.00000000
         15.64387000          0.12571910          0.00000000          0.00000000          0.00000000
          8.12582200          0.21915660          0.00000000          0.00000000          0.00000000
          4.23976200          0.28606620          0.00000000          0.00000000          0.00000000
          2.18638600          0.28965040          0.00000000          0.00000000          0.00000000
          1.10387100          0.21596980          1.00000000          0.00000000          0.00000000
          0.53381100          0.09761640          0.00000000          1.00000000          0.00000000
          0.23135500          0.01676540          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.09530000          1.00000000
  1  3  3  1  1
          0.16300000          1.00000000
  1  3  3  1  1
          0.32970000          1.00000000
  1  3  3  1  1
          0.67090000          1.00000000
  1  4  4  1  1
          0.31600000          1.00000000
  1  4  4  1  1
          0.70340000          1.00000000
  1  5  5  1  1
          0.58150000          1.00000000
  1  0  0  1  1
          0.02427400          1.00000000
  1  1  1  1  1
          0.01759300          1.00000000
  1  2  2  1  1
          0.03640000          1.00000000
  1  3  3  1  1
          0.07050000          1.00000000
  1  4  4  1  1
          0.14600000          1.00000000
  1  5  5  1  1
          0.32000000          1.00000000
# ARSENIC
As aug-cc-pV5Z
 16
  1  0  0 26  8
  137507530.00000000          0.00000021         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   20515052.00000000          0.00000163         -0.00000051          0.00000020         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    4648716.40000000          0.00000865         -0.00000270          0.00000105         -0.00000029          0.00000000          0.00000000          0.00000000          0.00000000
    1311264.60000000          0.00003676         -0.00001147          0.00000447         -0.00000123          0.00000000          0.00000000          0.00000000          0.00000000
     426185.86000000          0.00013488         -0.00004210          0.00001640         -0.00000452          0.00000000          0.00000000          0.00000000          0.00000000
     153237.06000000          0.00044460         -0.00013880          0.00005404         -0.00001488          0.00000000          0.00000000          0.00000000          0.00000000
      59459.40400000          0.00134880         -0.00042180          0.00016430         -0.00004527          0.00000000          0.00000000          0.00000000          0.00000000
      24492.81200000          0.00382310         -0.00119840          0.00046690         -0.00012858          0.00000000          0.00000000          0.00000000          0.00000000
      10590.25300000          0.01019080         -0.00321740          0.00125520         -0.00034580          0.00000000          0.00000000          0.00000000          0.00000000
       4769.78410000          0.02550270         -0.00815980          0.00318690         -0.00087803          0.00000000          0.00000000          0.00000000          0.00000000
       2226.36980000          0.05911040         -0.01948340          0.00764320         -0.00210730          0.00000000          0.00000000          0.00000000          0.00000000
       1073.08620000          0.12328880         -0.04297870          0.01696690         -0.00468170          0.00000000          0.00000000          0.00000000          0.00000000
        532.50059000          0.21917430         -0.08529870          0.03419090         -0.00945580          0.00000000          0.00000000          0.00000000          0.00000000
        271.29755000          0.30136120         -0.14284020          0.05872870         -0.01629900          0.00000000          0.00000000          0.00000000          0.00000000
        141.31195000          0.26948920         -0.17572820          0.07588560         -0.02121380          0.00000000          0.00000000          0.00000000          0.00000000
         74.58443300          0.11912700         -0.07641270          0.03506140         -0.00989440          0.00000000          0.00000000          0.00000000          0.00000000
         38.29833800          0.01569800          0.24665750         -0.13386230          0.03863790          0.00000000          0.00000000          0.00000000          0.00000000
         20.46913000          0.00020470          0.52538240         -0.39136340          0.11888930          0.00000000          0.00000000          0.00000000          0.00000000
         10.93957800          0.00022360          0.34597240         -0.34628200          0.10889900          0.00000000          0.00000000          0.00000000          0.00000000
          5.59036700         -0.00011680          0.06395330          0.19413270         -0.07220790          0.00000000          0.00000000          0.00000000          0.00000000
          2.88285900          0.00000419          0.00182990          0.64519860         -0.27180000          0.00000000          0.00000000          0.00000000          0.00000000
          1.46608600         -0.00002167          0.00156450          0.42348130         -0.33716620          0.00000000          0.00000000          0.00000000          0.00000000
          0.67483900          0.00000804         -0.00034470          0.05165530         -0.01395500          1.00000000          0.00000000          0.00000000          0.00000000
          0.34639900         -0.00000390          0.00017840         -0.00282610          0.49921120          0.00000000          1.00000000          0.00000000          0.00000000
          0.15928900          0.00000176         -0.00007883          0.00120780          0.56392840          0.00000000          0.00000000          1.00000000          0.00000000
          0.07210900         -0.00000035          0.00001558         -0.00012428          0.15398550          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      34166.16100000          0.00003220         -0.00001260          0.00000280          0.00000000          0.00000000          0.00000000          0.00000000
       8086.56080000          0.00028680         -0.00011190          0.00002490          0.00000000          0.00000000          0.00000000          0.00000000
       2626.51140000          0.00166330         -0.00065160          0.00014510          0.00000000          0.00000000          0.00000000          0.00000000
       1005.39500000          0.00741250         -0.00291730          0.00065040          0.00000000          0.00000000          0.00000000          0.00000000
        427.12735000          0.02675120         -0.01067380          0.00238180          0.00000000          0.00000000          0.00000000          0.00000000
        195.15113000          0.07889440         -0.03224550          0.00722070          0.00000000          0.00000000          0.00000000          0.00000000
         94.05430800          0.18299160         -0.07797310          0.01753180          0.00000000          0.00000000          0.00000000          0.00000000
         46.99988000          0.31249410         -0.14010380          0.03174140          0.00000000          0.00000000          0.00000000          0.00000000
         24.11745700          0.34453220         -0.16071320          0.03654490          0.00000000          0.00000000          0.00000000          0.00000000
         12.51998200          0.19164360         -0.00767030         -0.00160240          0.00000000          0.00000000          0.00000000          0.00000000
          6.35732500          0.03871360          0.30079830         -0.08246440          0.00000000          0.00000000          0.00000000          0.00000000
          3.16805200          0.00224180          0.47158780         -0.13443720          0.00000000          0.00000000          0.00000000          0.00000000
          1.55348100          0.00072090          0.30320640         -0.10516860          0.00000000          0.00000000          0.00000000          0.00000000
          0.71032500         -0.00004340          0.05434640          0.10005870          1.00000000          0.00000000          0.00000000          0.00000000
          0.32095500          0.00004340         -0.00021780          0.41389930          0.00000000          1.00000000          0.00000000          0.00000000
          0.13935700         -0.00002080          0.00094540          0.47845530          0.00000000          0.00000000          1.00000000          0.00000000
          0.05841000          0.00000520         -0.00023010          0.17147690          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1424.45060000          0.00006660          0.00000000          0.00000000          0.00000000
        431.06676000          0.00065370          0.00000000          0.00000000          0.00000000
        168.12864000          0.00390410          0.00000000          0.00000000          0.00000000
         74.86672400          0.01639190          0.00000000          0.00000000          0.00000000
         35.94585500          0.05062320          0.00000000          0.00000000          0.00000000
         18.09847400          0.12110210          0.00000000          0.00000000          0.00000000
          9.40578000          0.21681690          0.00000000          0.00000000          0.00000000
          4.92390400          0.28874520          0.00000000          0.00000000          0.00000000
          2.55649300          0.29477690          0.00000000          0.00000000          0.00000000
          1.30423300          0.21559980          1.00000000          0.00000000          0.00000000
          0.63711800          0.09175750          0.00000000          1.00000000          0.00000000
          0.27579500          0.01430220          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.11530000          1.00000000
  1  3  3  1  1
          0.19600000          1.00000000
  1  3  3  1  1
          0.38590000          1.00000000
  1  3  3  1  1
          0.75990000          1.00000000
  1  4  4  1  1
          0.37000000          1.00000000
  1  4  4  1  1
          0.80920000          1.00000000
  1  5  5  1  1
          0.67730000          1.00000000
  1  0  0  1  1
          0.02941800          1.00000000
  1  1  1  1  1
          0.02204300          1.00000000
  1  2  2  1  1
          0.04880000          1.00000000
  1  3  3  1  1
          0.08990000          1.00000000
  1  4  4  1  1
          0.16550000          1.00000000
  1  5  5  1  1
          0.36680000          1.00000000
# SELENIUM
Se aug-cc-pV5Z
 16
  1  0  0 26  8
  154432250.00000000          0.00000019         -0.00000006          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   23129212.00000000          0.00000151         -0.00000047          0.00000019         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    5261792.90000000          0.00000796         -0.00000249          0.00000098         -0.00000029          0.00000000          0.00000000          0.00000000          0.00000000
    1488816.70000000          0.00003375         -0.00001056          0.00000415         -0.00000121          0.00000000          0.00000000          0.00000000          0.00000000
     484656.56000000          0.00012372         -0.00003873          0.00001524         -0.00000446          0.00000000          0.00000000          0.00000000          0.00000000
     174270.63000000          0.00040839         -0.00012786          0.00005031         -0.00001471          0.00000000          0.00000000          0.00000000          0.00000000
      67529.09000000          0.00124310         -0.00038980          0.00015346         -0.00004487          0.00000000          0.00000000          0.00000000          0.00000000
      27750.83700000          0.00353890         -0.00111230          0.00043780         -0.00012799          0.00000000          0.00000000          0.00000000          0.00000000
      11964.21600000          0.00948220         -0.00300070          0.00118270         -0.00034570          0.00000000          0.00000000          0.00000000          0.00000000
       5370.71480000          0.02389010         -0.00765630          0.00302080         -0.00088340          0.00000000          0.00000000          0.00000000          0.00000000
       2497.31940000          0.05587570         -0.01842210          0.00729920         -0.00213630          0.00000000          0.00000000          0.00000000          0.00000000
       1198.76790000          0.11791040         -0.04101840          0.01635280         -0.00478920          0.00000000          0.00000000          0.00000000          0.00000000
        592.58026000          0.21279620         -0.08230260          0.03329620         -0.00977580          0.00000000          0.00000000          0.00000000          0.00000000
        300.97708000          0.29893040         -0.13988400          0.05801390         -0.01708770          0.00000000          0.00000000          0.00000000          0.00000000
        156.46024000          0.27656510         -0.17703370          0.07702330         -0.02286560          0.00000000          0.00000000          0.00000000          0.00000000
         82.47608600          0.12929410         -0.08877610          0.04110650         -0.01230280          0.00000000          0.00000000          0.00000000          0.00000000
         42.27088700          0.01858750          0.22515370         -0.12257820          0.03752540          0.00000000          0.00000000          0.00000000          0.00000000
         22.63022000          0.00007730          0.52071710         -0.38533970          0.12443420          0.00000000          0.00000000          0.00000000          0.00000000
         12.12237400          0.00034270          0.36450930         -0.36750730          0.12311950          0.00000000          0.00000000          0.00000000          0.00000000
          6.24917000         -0.00017530          0.07361690          0.15743400         -0.06243300          0.00000000          0.00000000          0.00000000          0.00000000
          3.24267800          0.00003570          0.00235400          0.64408720         -0.28948340          0.00000000          0.00000000          0.00000000          0.00000000
          1.66636200         -0.00004065          0.00169470          0.44822090         -0.37443990          0.00000000          0.00000000          0.00000000          0.00000000
          0.78726400          0.00001819         -0.00039450          0.05999890         -0.00953280          1.00000000          0.00000000          0.00000000          0.00000000
          0.40297200         -0.00000883          0.00018307         -0.00219790          0.52692250          0.00000000          1.00000000          0.00000000          0.00000000
          0.18709600          0.00000375         -0.00008751          0.00131780          0.55925390          0.00000000          0.00000000          1.00000000          0.00000000
          0.08470600         -0.00000078          0.00001559         -0.00008922          0.14330280          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      36511.33700000          0.00003200         -0.00001270          0.00000310          0.00000000          0.00000000          0.00000000          0.00000000
       8640.55100000          0.00028540         -0.00011300          0.00002730          0.00000000          0.00000000          0.00000000          0.00000000
       2805.69110000          0.00165670         -0.00065820          0.00015930          0.00000000          0.00000000          0.00000000          0.00000000
       1073.49610000          0.00739550         -0.00295280          0.00071360          0.00000000          0.00000000          0.00000000          0.00000000
        455.77475000          0.02675430         -0.01082890          0.00262600          0.00000000          0.00000000          0.00000000          0.00000000
        208.09432000          0.07909890         -0.03281240          0.00796670          0.00000000          0.00000000          0.00000000          0.00000000
        100.23111000          0.18379670         -0.07950700          0.01944400          0.00000000          0.00000000          0.00000000          0.00000000
         50.07352200          0.31380410         -0.14302740          0.03513280          0.00000000          0.00000000          0.00000000          0.00000000
         25.70026200          0.34436500         -0.16277870          0.04040280          0.00000000          0.00000000          0.00000000          0.00000000
         13.34679200          0.18985910         -0.00429830         -0.00339690          0.00000000          0.00000000          0.00000000          0.00000000
          6.78705100          0.03791930          0.30918290         -0.09209990          0.00000000          0.00000000          0.00000000          0.00000000
          3.39165400          0.00217810          0.47760130         -0.15350900          0.00000000          0.00000000          0.00000000          0.00000000
          1.67032700          0.00065900          0.29285260         -0.10587050          0.00000000          0.00000000          0.00000000          0.00000000
          0.75259900         -0.00005240          0.04664190          0.15280370          1.00000000          0.00000000          0.00000000          0.00000000
          0.34681300          0.00003570         -0.00072780          0.43738130          0.00000000          1.00000000          0.00000000          0.00000000
          0.15185500         -0.00002220          0.00126660          0.43993060          0.00000000          0.00000000          1.00000000          0.00000000
          0.06385600          0.00000370         -0.00015320          0.14758170          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1635.06630000          0.00005910          0.00000000          0.00000000          0.00000000
        494.67266000          0.00058400          0.00000000          0.00000000          0.00000000
        192.84388000          0.00352560          0.00000000          0.00000000          0.00000000
         85.78219500          0.01511270          0.00000000          0.00000000          0.00000000
         41.14996600          0.04784460          0.00000000          0.00000000          0.00000000
         20.67817000          0.11743450          0.00000000          0.00000000          0.00000000
         10.72638600          0.21590740          0.00000000          0.00000000          0.00000000
          5.61245400          0.29292160          0.00000000          0.00000000          0.00000000
          2.92037600          0.30008640          0.00000000          0.00000000          0.00000000
          1.49818400          0.21367190          1.00000000          0.00000000          0.00000000
          0.73599900          0.08498330          0.00000000          1.00000000          0.00000000
          0.31600400          0.01180120          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.13310000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.42110000          1.00000000
  1  3  3  1  1
          0.84420000          1.00000000
  1  4  4  1  1
          0.38500000          1.00000000
  1  4  4  1  1
          0.86590000          1.00000000
  1  5  5  1  1
          0.72350000          1.00000000
  1  0  0  1  1
          0.03393500          1.00000000
  1  1  1  1  1
          0.02497500          1.00000000
  1  2  2  1  1
          0.05480000          1.00000000
  1  3  3  1  1
          0.09920000          1.00000000
  1  4  4  1  1
          0.18300000          1.00000000
  1  5  5  1  1
          0.40200000          1.00000000
# BROMINE
Br aug-cc-pV5Z
 16
  1  0  0 26  8
  165735150.00000000          0.00000019         -0.00000006          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   24774379.00000000          0.00000149         -0.00000047          0.00000019         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    5628202.00000000          0.00000788         -0.00000247          0.00000098         -0.00000030          0.00000000          0.00000000          0.00000000          0.00000000
    1591899.70000000          0.00003339         -0.00001048          0.00000416         -0.00000128          0.00000000          0.00000000          0.00000000          0.00000000
     518263.80000000          0.00012231         -0.00003840          0.00001526         -0.00000468          0.00000000          0.00000000          0.00000000          0.00000000
     186490.92000000          0.00040321         -0.00012660          0.00005031         -0.00001542          0.00000000          0.00000000          0.00000000          0.00000000
      72332.49300000          0.00122564         -0.00038545          0.00015325         -0.00004697          0.00000000          0.00000000          0.00000000          0.00000000
      29761.13500000          0.00348235         -0.00109761          0.00043637         -0.00013372          0.00000000          0.00000000          0.00000000          0.00000000
      12851.71200000          0.00930856         -0.00295379          0.00117580         -0.00036049          0.00000000          0.00000000          0.00000000          0.00000000
       5780.94300000          0.02338830         -0.00751460          0.00299460         -0.00091798          0.00000000          0.00000000          0.00000000          0.00000000
       2695.00980000          0.05455300         -0.01802300          0.00721190         -0.00221290          0.00000000          0.00000000          0.00000000          0.00000000
       1297.66040000          0.11494790         -0.04002550          0.01611510         -0.00494730          0.00000000          0.00000000          0.00000000          0.00000000
        643.63493000          0.20792250         -0.08029190          0.03279430         -0.01009510          0.00000000          0.00000000          0.00000000          0.00000000
        327.95194000          0.29515960         -0.13721660          0.05743090         -0.01773240          0.00000000          0.00000000          0.00000000          0.00000000
        170.92262000          0.27987660         -0.17694390          0.07761870         -0.02416530          0.00000000          0.00000000          0.00000000          0.00000000
         90.25014100          0.13697520         -0.09770330          0.04564640         -0.01431800          0.00000000          0.00000000          0.00000000          0.00000000
         46.29246700          0.02121540          0.20676330         -0.11311710          0.03628120          0.00000000          0.00000000          0.00000000          0.00000000
         24.84866100         -0.00002540          0.51484190         -0.37955960          0.12865520          0.00000000          0.00000000          0.00000000          0.00000000
         13.34713700          0.00045700          0.37992060         -0.38514940          0.13568880          0.00000000          0.00000000          0.00000000          0.00000000
          6.94825800         -0.00023480          0.08301280          0.12368510         -0.05167640          0.00000000          0.00000000          0.00000000          0.00000000
          3.62507500          0.00006858          0.00321570          0.64061380         -0.30307240          0.00000000          0.00000000          0.00000000          0.00000000
          1.88215300         -0.00006116          0.00171290          0.47074360         -0.40738380          0.00000000          0.00000000          0.00000000          0.00000000
          0.91082200          0.00002905         -0.00038970          0.06907320         -0.00903930          1.00000000          0.00000000          0.00000000          0.00000000
          0.46395700         -0.00001366          0.00015530         -0.00130600          0.54552490          0.00000000          1.00000000          0.00000000          0.00000000
          0.21693300          0.00000573         -0.00008575          0.00141480          0.55826500          0.00000000          0.00000000          1.00000000          0.00000000
          0.09840600         -0.00000120          0.00001312         -0.00005245          0.13789010          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      39391.53000000          0.00003120         -0.00001250          0.00000320          0.00000000          0.00000000          0.00000000          0.00000000
       9325.22250000          0.00027800         -0.00011160          0.00002880          0.00000000          0.00000000          0.00000000          0.00000000
       3028.99430000          0.00161380         -0.00064990          0.00016840          0.00000000          0.00000000          0.00000000          0.00000000
       1159.51450000          0.00720490         -0.00291590          0.00075430          0.00000000          0.00000000          0.00000000          0.00000000
        492.68131000          0.02608730         -0.01070090          0.00278010          0.00000000          0.00000000          0.00000000          0.00000000
        225.17451000          0.07729710         -0.03249510          0.00844620          0.00000000          0.00000000          0.00000000          0.00000000
        108.59326000          0.18047750         -0.07911230          0.02073760          0.00000000          0.00000000          0.00000000          0.00000000
         54.33607900          0.31061260         -0.14352520          0.03775420          0.00000000          0.00000000          0.00000000          0.00000000
         27.93665000          0.34542970         -0.16582480          0.04420620          0.00000000          0.00000000          0.00000000          0.00000000
         14.53962600          0.19485150         -0.01065910         -0.00217750          0.00000000          0.00000000          0.00000000          0.00000000
          7.42130700          0.04038600          0.30506620         -0.09795300          0.00000000          0.00000000          0.00000000          0.00000000
          3.73038900          0.00230910          0.48135630         -0.16926560          0.00000000          0.00000000          0.00000000          0.00000000
          1.85412700          0.00067150          0.29427690         -0.11174900          0.00000000          0.00000000          0.00000000          0.00000000
          0.84533700         -0.00007170          0.04670190          0.17844220          1.00000000          0.00000000          0.00000000          0.00000000
          0.39215200          0.00003590         -0.00025850          0.44996580          0.00000000          1.00000000          0.00000000          0.00000000
          0.17276700         -0.00002790          0.00147790          0.42155970          0.00000000          0.00000000          1.00000000          0.00000000
          0.07290800          0.00000310         -0.00005130          0.13503800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1850.63540000          0.00005380          0.00000000          0.00000000          0.00000000
        557.07125000          0.00054020          0.00000000          0.00000000          0.00000000
        216.48687000          0.00330120          0.00000000          0.00000000          0.00000000
         96.13885000          0.01435510          0.00000000          0.00000000          0.00000000
         46.12638000          0.04611680          0.00000000          0.00000000          0.00000000
         23.20116400          0.11478730          0.00000000          0.00000000          0.00000000
         12.05592600          0.21453690          0.00000000          0.00000000          0.00000000
          6.32554500          0.29531310          0.00000000          0.00000000          0.00000000
          3.30492200          0.30409380          0.00000000          0.00000000          0.00000000
          1.70425300          0.21213150          1.00000000          0.00000000          0.00000000
          0.83994000          0.07978040          0.00000000          1.00000000          0.00000000
          0.35695300          0.01007360          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
  1  3  3  1  1
          0.25500000          1.00000000
  1  3  3  1  1
          0.49550000          1.00000000
  1  3  3  1  1
          0.96270000          1.00000000
  1  4  4  1  1
          0.43900000          1.00000000
  1  4  4  1  1
          0.97680000          1.00000000
  1  5  5  1  1
          0.81930000          1.00000000
  1  0  0  1  1
          0.03910600          1.00000000
  1  1  1  1  1
          0.02905200          1.00000000
  1  2  2  1  1
          0.07810000          1.00000000
  1  3  3  1  1
          0.13880000          1.00000000
  1  4  4  1  1
          0.21900000          1.00000000
  1  5  5  1  1
          0.49100000          1.00000000
# KRYPTON
Kr aug-cc-pV5Z
 16
  1  0  0 26  8
  182822090.00000000          0.00000018         -0.00000057          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   27356156.00000000          0.00000142         -0.00000045          0.00000018         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    6221170.40000000          0.00000746         -0.00000235          0.00000094         -0.00000030          0.00000000          0.00000000          0.00000000          0.00000000
    1760277.90000000          0.00003159         -0.00000994          0.00000399         -0.00000127          0.00000000          0.00000000          0.00000000          0.00000000
     573193.82000000          0.00011575         -0.00003640          0.00001462         -0.00000466          0.00000000          0.00000000          0.00000000          0.00000000
     206258.45000000          0.00038150         -0.00012010          0.00004819         -0.00001535          0.00000000          0.00000000          0.00000000          0.00000000
      80026.66900000          0.00115900         -0.00036540          0.00014670         -0.00004674          0.00000000          0.00000000          0.00000000          0.00000000
      32939.08400000          0.00329340         -0.00104070          0.00041770         -0.00013302          0.00000000          0.00000000          0.00000000          0.00000000
      14222.63300000          0.00881610         -0.00280380          0.00112670         -0.00035906          0.00000000          0.00000000          0.00000000          0.00000000
       6393.07070000          0.02221800         -0.00715090          0.00287690         -0.00091650          0.00000000          0.00000000          0.00000000          0.00000000
       2976.45380000          0.05208810         -0.01722040          0.00695490         -0.00221840          0.00000000          0.00000000          0.00000000          0.00000000
       1430.52540000          0.11063560         -0.03848000          0.01563650         -0.00498830          0.00000000          0.00000000          0.00000000          0.00000000
        707.92621000          0.20253260         -0.07786280          0.03208010         -0.01026610          0.00000000          0.00000000          0.00000000          0.00000000
        359.84847000          0.29263500         -0.13474230          0.05686890         -0.01824450          0.00000000          0.00000000          0.00000000          0.00000000
        187.14965000          0.28512240         -0.17761480          0.07848450         -0.02541100          0.00000000          0.00000000          0.00000000          0.00000000
         98.63452300          0.14550640         -0.10684130          0.05033980         -0.01639310          0.00000000          0.00000000          0.00000000          0.00000000
         50.54786900          0.02399390          0.18961320         -0.10427420          0.03469770          0.00000000          0.00000000          0.00000000          0.00000000
         27.16700400         -0.00009490          0.50918710         -0.37437610          0.13212830          0.00000000          0.00000000          0.00000000          0.00000000
         14.61509800          0.00055780          0.39398590         -0.40111310          0.14709250          0.00000000          0.00000000          0.00000000          0.00000000
          7.65135200         -0.00028700          0.09190320          0.09683880         -0.04182160          0.00000000          0.00000000          0.00000000          0.00000000
          3.99726300          0.00009660          0.00391950          0.64287760         -0.31952400          0.00000000          0.00000000          0.00000000          0.00000000
          2.08585300         -0.00007840          0.00174960          0.48606000         -0.43632860          0.00000000          0.00000000          0.00000000          0.00000000
          1.01479700          0.00003877         -0.00042580          0.07334560          0.00429110          1.00000000          0.00000000          0.00000000          0.00000000
          0.51978800         -0.00001822          0.00015290         -0.00100770          0.56455580          0.00000000          1.00000000          0.00000000          0.00000000
          0.24510300          0.00000763         -0.00009381          0.00160870          0.55028450          0.00000000          0.00000000          1.00000000          0.00000000
          0.11189600         -0.00000159          0.00001326         -0.00004393          0.12977100          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      42993.05600000          0.00002970         -0.00001210          0.00000330          0.00000000          0.00000000          0.00000000          0.00000000
      10173.72300000          0.00026510         -0.00010780          0.00002930          0.00000000          0.00000000          0.00000000          0.00000000
       3303.10570000          0.00154160         -0.00062900          0.00017130          0.00000000          0.00000000          0.00000000          0.00000000
       1263.54000000          0.00690650         -0.00283230          0.00076950          0.00000000          0.00000000          0.00000000          0.00000000
        536.36546000          0.02513970         -0.01044620          0.00285140          0.00000000          0.00000000          0.00000000          0.00000000
        244.87617000          0.07501240         -0.03194000          0.00872040          0.00000000          0.00000000          0.00000000          0.00000000
        117.99117000          0.17674330         -0.07845990          0.02161810          0.00000000          0.00000000          0.00000000          0.00000000
         59.02124800          0.30751350         -0.14397190          0.03980240          0.00000000          0.00000000          0.00000000          0.00000000
         30.35606700          0.34706440         -0.16917030          0.04747750          0.00000000          0.00000000          0.00000000          0.00000000
         15.81997700          0.20028020         -0.01759660         -0.00047730          0.00000000          0.00000000          0.00000000          0.00000000
          8.10458000          0.04305080          0.30026490         -0.10218910          0.00000000          0.00000000          0.00000000          0.00000000
          4.09796400          0.00247720          0.48476610         -0.18236110          0.00000000          0.00000000          0.00000000          0.00000000
          2.05606100          0.00067890          0.29672480         -0.11733630          0.00000000          0.00000000          0.00000000          0.00000000
          0.95214500         -0.00008210          0.04745330          0.19542440          1.00000000          0.00000000          0.00000000          0.00000000
          0.44477400          0.00004690         -0.00047280          0.45901760          0.00000000          1.00000000          0.00000000          0.00000000
          0.19749600         -0.00002210          0.00092530          0.40961740          0.00000000          0.00000000          1.00000000          0.00000000
          0.08382300          0.00000580         -0.00018470          0.12597150          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       2067.43600000          0.00004960          0.00000000          0.00000000          0.00000000
        625.69371000          0.00049440          0.00000000          0.00000000          0.00000000
        243.94679000          0.00302650          0.00000000          0.00000000          0.00000000
        108.42373000          0.01334610          0.00000000          0.00000000          0.00000000
         52.00521600          0.04378690          0.00000000          0.00000000          0.00000000
         26.11540500          0.11143880          0.00000000          0.00000000          0.00000000
         13.54674800          0.21303410          0.00000000          0.00000000          0.00000000
          7.10581000          0.29792410          0.00000000          0.00000000          0.00000000
          3.72155400          0.30796600          0.00000000          0.00000000          0.00000000
          1.92912000          0.21107750          1.00000000          0.00000000          0.00000000
          0.95582600          0.07632610          0.00000000          1.00000000          0.00000000
          0.40519700          0.00917330          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.17410000          1.00000000
  1  3  3  1  1
          0.31500000          1.00000000
  1  3  3  1  1
          0.58700000          1.00000000
  1  3  3  1  1
          1.09400000          1.00000000
  1  4  4  1  1
          0.50100000          1.00000000
  1  4  4  1  1
          1.10400000          1.00000000
  1  5  5  1  1
          0.93030000          1.00000000
  1  0  0  1  1
          0.04427700          1.00000000
  1  1  1  1  1
          0.03312900          1.00000000
  1  2  2  1  1
          0.10140000          1.00000000
  1  3  3  1  1
          0.17840000          1.00000000
  1  4  4  1  1
          0.25500000          1.00000000
  1  5  5  1  1
          0.58000000          1.00000000
# BASIS="IGLO-II"
#W. Kutzelnigg, U. Fleischer, M. Schindler, The IGLO-Method: Ab Initio
#Calculation and Interpretation of NMR Chemical Shifts and Magnetic
#Susceptibilities, Springer-Verlag, Heidelberg, 1990, vol. 23.
#
# HYDROGEN    (5s,1p) -> [3s,1p]
H  IGLO-II
  4
  1  0  0  3  1
         33.64440000          0.00612000
          5.05796000          0.04575000
          1.14680000          0.20572000
  1  0  0  1  1
          0.32114400          1.00000000
  1  0  0  1  1
          0.10130900          1.00000000
  1  1  1  1  1
          0.65000000          1.00000000
# BORON       (9s,5p,1d) -> [5s,4p,1d]
B  IGLO-II
 10
  1  0  0  5  1
       2796.60350000          0.00128223
        420.86799000          0.00976641
         96.91586600          0.04745255
         28.10305800          0.16028625
          9.37843840          0.36191858
  1  0  0  1  1
          3.42809720          1.00000000
  1  0  0  1  1
          1.33539380          1.00000000
  1  0  0  1  1
          0.32384228          1.00000000
  1  0  0  1  1
          0.10202139          1.00000000
  1  1  1  2  1
         11.29072000          0.01444998
          2.42571240          0.08829204
  1  1  1  1  1
          0.68564974          1.00000000
  1  1  1  1  1
          0.21569117          1.00000000
  1  1  1  1  1
          0.07010236          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
# CARBON      (9s,5p,1d) -> [5s,4p,1d]
C  IGLO-II
 10
  1  0  0  5  1
       4240.30980000          0.00121522
        637.77827000          0.00927316
        146.74534000          0.04527924
         42.53142800          0.15492334
         14.18480400          0.35808349
  1  0  0  1  1
          5.17569430          1.00000000
  1  0  0  1  1
          2.00725310          1.00000000
  1  0  0  1  1
          0.49677422          1.00000000
  1  0  0  1  1
          0.15348718          1.00000000
  1  1  1  2  1
         18.09914400          0.01476051
          3.97691450          0.09164935
  1  1  1  1  1
          1.14507680          1.00000000
  1  1  1  1  1
          0.36188831          1.00000000
  1  1  1  1  1
          0.11460548          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# NITROGEN    (9s,5p,1d) -> [5s,4p,1d]
N  IGLO-II
 10
  1  0  0  5  1
       6024.27360000          0.00116038
        906.59577000          0.00885007
        208.44780000          0.04350415
         60.10368300          0.15154374
         19.97334800          0.35487068
  1  0  0  1  1
          7.33419850          1.00000000
  1  0  0  1  1
          2.89381940          1.00000000
  1  0  0  1  1
          0.70806350          1.00000000
  1  0  0  1  1
          0.21581223          1.00000000
  1  1  1  2  1
         26.36260900          0.01490106
          5.87773430          0.09333825
  1  1  1  1  1
          1.71678920          1.00000000
  1  1  1  1  1
          0.54594357          1.00000000
  1  1  1  1  1
          0.16994634          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (9s,5p,1d) -> [5s,4p,1d]
O  IGLO-II
 10
  1  0  0  5  1
       8046.15900000          0.00113460
       1211.98490000          0.00863654
        279.52491000          0.04229787
         80.93299600          0.14760311
         26.93427000          0.35147639
  1  0  0  1  1
          9.83933200          1.00000000
  1  0  0  1  1
          3.83403740          1.00000000
  1  0  0  1  1
          0.95681143          1.00000000
  1  0  0  1  1
          0.28899604          1.00000000
  1  1  1  2  1
         34.90661400          0.01561769
          7.84656390          0.09828103
  1  1  1  1  1
          2.30498550          1.00000000
  1  1  1  1  1
          0.72205670          1.00000000
  1  1  1  1  1
          0.21525878          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# FLUORINE    (9s,5p,1d) -> [5s,4p,1d]
F  IGLO-II
 10
  1  0  0  5  1
      10255.86300000          0.00112926
       1545.55750000          0.00858680
        357.06977000          0.04195714
        103.63143000          0.14649137
         34.50261600          0.35191132
  1  0  0  1  1
         12.54609500          1.00000000
  1  0  0  1  1
          4.83183280          1.00000000
  1  0  0  1  1
          1.23312350          1.00000000
  1  0  0  1  1
          0.36996157          1.00000000
  1  1  1  2  1
         44.60800700          0.01624853
         10.09667300          0.10219615
  1  1  1  1  1
          2.98488130          1.00000000
  1  1  1  1  1
          0.93222839          1.00000000
  1  1  1  1  1
          0.27221117          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# ALUMINUM    (11s,6p,2d) -> [7s,6p,2d]
AL IGLO-II
 15
  1  0  0  5  1
      23491.08200000          0.00101595
       3547.63230000          0.00768970
        823.47199000          0.03763183
        237.67938000          0.13604661
         78.60205900          0.33655292
  1  0  0  1  1
         29.04990600          1.00000000
  1  0  0  1  1
         11.62381200          1.00000000
  1  0  0  1  1
          3.46534310          1.00000000
  1  0  0  1  1
          1.23314290          1.00000000
  1  0  0  1  1
          0.20181005          1.00000000
  1  0  0  1  1
          0.07804797          1.00000000
  1  1  1  2  1
        141.51036000          0.01099731
         33.21762900          0.07398327
  1  1  1  1  1
         10.39301400          1.00000000
  1  1  1  1  1
          3.59258390          1.00000000
  1  1  1  1  1
          1.24210200          1.00000000
  1  1  1  1  1
          0.30402357          1.00000000
  1  1  1  1  1
          0.07628914          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# SILICON     (11s,6p,2d) -> [7s,6p,2d]
SI IGLO-II
 15
  1  0  0  5  1
      26737.38900000          0.00103912
       4076.37860000          0.00773771
        953.29315000          0.03775636
        274.58441000          0.13727615
         90.68198700          0.33903718
  1  0  0  1  1
         33.52905700          1.00000000
  1  0  0  1  1
         13.45762900          1.00000000
  1  0  0  1  1
          4.05069160          1.00000000
  1  0  0  1  1
          1.48418390          1.00000000
  1  0  0  1  1
          0.27044323          1.00000000
  1  0  0  1  1
          0.09932161          1.00000000
  1  1  1  2  1
        163.73270000          0.01165726
         38.35208100          0.07880208
  1  1  1  1  1
         12.02111400          1.43833500
  1  1  1  1  1
          4.18457330          1.00000000
  1  1  1  1  1
          1.48271700          1.00000000
  1  1  1  1  1
          0.33498569          1.00000000
  1  1  1  1  1
          0.09699384          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# PHOSPHORUS  (11s,6p,2d) -> [7s,6p,2d]
P  IGLO-II
 15
  1  0  0  5  1
      30632.37800000          0.00104101
       4684.25210000          0.00774569
       1093.59030000          0.03786800
        315.28033000          0.13740569
        104.11763000          0.34053492
  1  0  0  1  1
         38.41572400          0.13070600
  1  0  0  1  1
         15.44653100          1.00000000
  1  0  0  1  1
          4.65597040          1.00000000
  1  0  0  1  1
          1.75887740          1.00000000
  1  0  0  1  1
          0.34094694          1.00000000
  1  0  0  1  1
          0.12377993          1.00000000
  1  1  1  2  1
        187.73871000          0.01225194
         43.63355000          0.08424910
  1  1  1  1  1
         13.60316900          1.00000000
  1  1  1  1  1
          4.76604610          1.00000000
  1  1  1  1  1
          1.74261850          1.00000000
  1  1  1  1  1
          0.41920305          1.00000000
  1  1  1  1  1
          0.12451394          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# SULFUR      (11s,6p,2d) -> [7s,6p,2d]
S  IGLO-II
 15
  1  0  0  5  1
      35713.98400000          0.00101591
       5396.62770000          0.00768960
       1249.70930000          0.03785909
        359.93426000          0.13697350
        119.17126000          0.33927126
  1  0  0  1  1
         43.98355800          1.00000000
  1  0  0  1  1
         17.62667400          1.00000000
  1  0  0  1  1
          5.42009030          1.00000000
  1  0  0  1  1
          2.07387300          1.00000000
  1  0  0  1  1
          0.42642466          1.00000000
  1  0  0  1  1
          0.15187254          1.00000000
  1  1  1  2  1
        212.86586000          0.01277611
         49.60019500          0.08768841
  1  1  1  1  1
         15.51553800          1.00000000
  1  1  1  1  1
          5.47557110          1.00000000
  1  1  1  1  1
          2.04415270          1.00000000
  1  1  1  1  1
          0.52179721          1.00000000
  1  1  1  1  1
          0.15064449          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          1.60000000          1.00000000
# CHLORINE    (11s,6p,2d) -> [7s,6p,2d]
CL IGLO-II
 15
  1  0  0  5  1
      40847.56400000          0.00099932
       6178.59730000          0.00758054
       1424.64280000          0.03758571
        409.20969000          0.13635939
        135.47646000          0.33796115
  1  0  0  1  1
         50.13194300          1.00000000
  1  0  0  1  1
         20.20993500          1.00000000
  1  0  0  1  1
          6.28271010          1.00000000
  1  0  0  1  1
          2.45955460          1.00000000
  1  0  0  1  1
          0.52706222          1.00000000
  1  0  0  1  1
          0.18840804          1.00000000
  1  1  1  2  1
        240.76687000          0.01310385
         56.56240600          0.08895447
  1  1  1  1  1
         17.84577800          1.00000000
  1  1  1  1  1
          6.34988070          1.00000000
  1  1  1  1  1
          2.40307540          1.00000000
  1  1  1  1  1
          0.64102163          1.00000000
  1  1  1  1  1
          0.18375019          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          1.60000000          1.00000000
# BASIS="IGLO-III"
#W. Kutzelnigg, U. Fleischer, M. Schindler,Al - Cl:  The IGLO-Method: Ab Initio
#Calculation and Interpretation of NMR Chemical Shifts and Magnetic
#Susceptibilities, Springer-Verlag, Heidelberg, 1990, vol. 23.
#
# HYDROGEN    (6s,2p) -> [4s,2p]
H  IGLO-III
  6
  1  0  0  3  1
         68.16000000          0.00255000
         10.24650000          0.01938000
          2.34648000          0.09280000
  1  0  0  1  1
          0.67332000          1.00000000
  1  0  0  1  1
          0.22466000          1.00000000
  1  0  0  1  1
          0.08221700          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
# BORON       (11s,7p,2d) -> [7s,6p,2d]
B  IGLO-III
 15
  1  0  0  5  1
      10624.88800000          0.00024298
       1587.95630000          0.00189462
        357.95831000          0.01002374
         99.26325900          0.04174382
         31.47135600          0.13581952
  1  0  0  1  1
         10.92100300          1.00000000
  1  0  0  1  1
          4.07019350          1.00000000
  1  0  0  1  1
          1.61755990          1.00000000
  1  0  0  1  1
          0.42720825          1.00000000
  1  0  0  1  1
          0.16635220          1.00000000
  1  0  0  1  1
          0.06656824          1.00000000
  1  1  1  2  1
         24.22602800          0.00441052
          5.67794760          0.02756931
  1  1  1  1  1
          1.75378250          1.00000000
  1  1  1  1  1
          0.64115199          1.00000000
  1  1  1  1  1
          0.25505904          1.00000000
  1  1  1  1  1
          0.10423302          1.00000000
  1  1  1  1  1
          0.04275910          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# CARBON      (11s,7p,2d) -> [7s,6p,2d]
C  IGLO-III
 15
  1  0  0  5  1
      16371.07400000          0.00022642
       2426.99250000          0.00178447
        544.54418000          0.00949016
        150.80487000          0.03966052
         47.70814300          0.13134026
  1  0  0  1  1
         16.45724100          1.00000000
  1  0  0  1  1
          6.08455780          1.00000000
  1  0  0  1  1
          2.38246310          1.00000000
  1  0  0  1  1
          0.66198660          1.00000000
  1  0  0  1  1
          0.24698997          1.00000000
  1  0  0  1  1
          0.09498730          1.00000000
  1  1  1  2  1
         40.79042300          0.00409698
          9.50346330          0.02758477
  1  1  1  1  1
          2.94083570          1.00000000
  1  1  1  1  1
          1.07511150          1.00000000
  1  1  1  1  1
          0.42670240          1.00000000
  1  1  1  1  1
          0.17481926          1.00000000
  1  1  1  1  1
          0.07113054          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NITROGEN    (11s,7p,2d) -> [7s,6p,2d]
N  IGLO-III
 15
  1  0  0  5  1
      23274.85700000          0.00021521
       3468.18300000          0.00169214
        777.98843000          0.00899407
        215.71976000          0.03773039
         68.07803100          0.12667110
  1  0  0  1  1
         23.42439700          1.00000000
  1  0  0  1  1
          8.66937660          1.00000000
  1  0  0  1  1
          3.42175330          1.00000000
  1  0  0  1  1
          0.93125652          1.00000000
  1  0  0  1  1
          0.34656886          1.00000000
  1  0  0  1  1
          0.13311530          1.00000000
  1  1  1  2  1
         60.31724000          0.00397658
         14.10081100          0.02764197
  1  1  1  1  1
          4.38771790          1.00000000
  1  1  1  1  1
          1.60827170          1.00000000
  1  1  1  1  1
          0.63885442          1.00000000
  1  1  1  1  1
          0.26035829          1.00000000
  1  1  1  1  1
          0.10396545          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# OXYGEN      (11s,7p,2d) -> [7s,6p,2d]
O  IGLO-III
 15
  1  0  0  5  1
      30664.50300000          0.00021414
       4573.20140000          0.00167798
       1029.55240000          0.00888147
        285.90474000          0.03728134
         90.36965300          0.12518867
  1  0  0  1  1
         31.21957800          1.00000000
  1  0  0  1  1
         11.60776600          1.00000000
  1  0  0  1  1
          4.59275950          1.00000000
  1  0  0  1  1
          1.27117160          1.00000000
  1  0  0  1  1
          0.47214017          1.00000000
  1  0  0  1  1
          0.17896534          1.00000000
  1  1  1  2  1
         78.70294300          0.00424160
         18.40926100          0.02986846
  1  1  1  1  1
          5.75308350          1.00000000
  1  1  1  1  1
          2.11071140          1.00000000
  1  1  1  1  1
          0.83712087          1.00000000
  1  1  1  1  1
          0.33907630          1.00000000
  1  1  1  1  1
          0.13226310          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# FLUORINE    (11s,7p,2d) -> [7s,6p,2d]
F  IGLO-III
 15
  1  0  0  5  1
      37736.00000000          0.00021825
       5867.07910000          0.00163322
       1332.46790000          0.00868178
        369.44060000          0.03654339
        116.84300000          0.12310963
  1  0  0  1  1
         40.34877000          1.00000000
  1  0  0  1  1
         14.96627000          1.00000000
  1  0  0  1  1
          5.87592950          1.00000000
  1  0  0  1  1
          1.65333520          1.00000000
  1  0  0  1  1
          0.61083583          1.00000000
  1  0  0  1  1
          0.23328922          1.00000000
  1  1  1  2  1
        102.26192000          0.00427323
         23.93838100          0.03053431
  1  1  1  1  1
          7.52059140          1.00000000
  1  1  1  1  1
          2.77245660          1.00000000
  1  1  1  1  1
          1.10005140          1.00000000
  1  1  1  1  1
          0.44677512          1.00000000
  1  1  1  1  1
          0.17187009          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# ALUMINUM    (12s,8p,3d) -> [8s,7p,3d]
AL IGLO-III
 18
  1  0  0  5  1
      55112.70000000          0.00035194
       8204.66000000          0.00275036
       1863.56000000          0.01418546
        530.19500000          0.05585327
        174.89500000          0.16789086
  1  0  0  1  1
         64.00900000          1.00000000
  1  0  0  1  1
         25.32310000          1.00000000
  1  0  0  1  1
         10.56390000          1.00000000
  1  0  0  1  1
          3.21260000          1.00000000
  1  0  0  1  1
          1.15432000          1.00000000
  1  0  0  1  1
          0.17812800          1.00000000
  1  0  0  1  1
          0.06588500          1.00000000
  1  1  1  2  1
        352.54595000          0.00241249
         83.01561600          0.01910968
  1  1  1  1  1
         26.00394600          1.00000000
  1  1  1  1  1
          9.23208790          1.00000000
  1  1  1  1  1
          3.35497620          1.00000000
  1  1  1  1  1
          1.18829010          1.00000000
  1  1  1  1  1
          0.27615887          1.00000000
  1  1  1  1  1
          0.07277382          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
# SILICON     (12s,8p,3d) -> [8s,7p,3d]
SI IGLO-III
 18
  1  0  0  5  1
      69989.30000000          0.00031441
      10380.20000000          0.00249143
       2330.01000000          0.01303542
        657.46600000          0.05227004
        214.00400000          0.16151425
  1  0  0  1  1
         77.60640000          1.00000000
  1  0  0  1  1
         30.63950000          1.00000000
  1  0  0  1  1
         12.81560000          1.00000000
  1  0  0  1  1
          3.92714000          1.00000000
  1  0  0  1  1
          1.45221000          1.00000000
  1  0  0  1  1
          0.25764400          1.00000000
  1  0  0  1  1
          0.09440400          1.00000000
  1  1  1  2  1
        401.60490000          0.00260893
         95.35242600          0.02025886
  1  1  1  1  1
         30.33422000          1.43833500
  1  1  1  1  1
         10.94372700          1.00000000
  1  1  1  1  1
          4.04168220          1.00000000
  1  1  1  1  1
          1.46154790          1.00000000
  1  1  1  1  1
          0.33021241          1.00000000
  1  1  1  1  1
          0.09522172          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
# PHOSPHORUS  (12s,8p,3d) -> [8s,7p,3d]
P  IGLO-III
 18
  1  0  0  5  1
      77492.39800000          0.00032906
      11605.79400000          0.00255174
       2645.96280000          0.01313011
        753.97763000          0.05189689
        248.75403000          0.15794319
  1  0  0  1  1
         91.15662300          1.00000000
  1  0  0  1  1
         36.22561800          1.00000000
  1  0  0  1  1
         15.21115500          1.00000000
  1  0  0  1  1
          4.71394850          1.00000000
  1  0  0  1  1
          1.78254320          1.00000000
  1  0  0  1  1
          0.34271273          1.00000000
  1  0  0  1  1
          0.12471095          1.00000000
  1  1  1  2  1
        447.03882000          0.00282929
        108.29827000          0.02130874
  1  1  1  1  1
         34.76738800          1.00000000
  1  1  1  1  1
         12.58337900          1.00000000
  1  1  1  1  1
          4.69885490          1.00000000
  1  1  1  1  1
          1.75275990          1.00000000
  1  1  1  1  1
          0.42209549          1.00000000
  1  1  1  1  1
          0.12532092          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# SULFUR      (12s,8p,3d) -> [8s,7p,3d]
S  IGLO-III
 18
  1  0  0  5  1
      94181.10000000          0.00030557
      13921.80000000          0.00240104
       3168.04000000          0.01235431
        901.84300000          0.04909915
        296.95400000          0.15099018
  1  0  0  1  1
        108.66900000          1.00000000
  1  0  0  1  1
         43.15790000          1.00000000
  1  0  0  1  1
         18.11680000          1.00000000
  1  0  0  1  1
          5.57096000          1.00000000
  1  0  0  1  1
          2.14287000          1.00000000
  1  0  0  1  1
          0.43438900          1.00000000
  1  0  0  1  1
          0.15709300          1.00000000
  1  1  1  2  1
        532.03127000          0.00273507
        126.63701000          0.02160476
  1  1  1  1  1
         39.75234800          1.00000000
  1  1  1  1  1
         14.14024300          1.00000000
  1  1  1  1  1
          5.26069100          1.00000000
  1  1  1  1  1
          2.00635500          1.00000000
  1  1  1  1  1
          0.51597093          1.00000000
  1  1  1  1  1
          0.14946546          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# CHLORINE    (12s,8p,3d) -> [8s,7p,3d]
CL IGLO-III
 18
  1  0  0  5  1
     105818.82000000          0.00030548
      15872.00600000          0.00236515
       3619.65480000          0.01218928
       1030.80380000          0.04841340
        339.90788000          0.14895259
  1  0  0  1  1
        124.53810000          1.00000000
  1  0  0  1  1
         49.51350200          1.00000000
  1  0  0  1  1
         20.80560400          1.00000000
  1  0  0  1  1
          6.46482380          1.00000000
  1  0  0  1  1
          2.52545370          1.00000000
  1  0  0  1  1
          0.53783215          1.00000000
  1  0  0  1  1
          0.19349716          1.00000000
  1  1  1  2  1
        622.02736000          0.00267992
        145.49719000          0.02203724
  1  1  1  1  1
         45.00865900          1.00000000
  1  1  1  1  1
         15.90088900          1.00000000
  1  1  1  1  1
          5.92594370          1.00000000
  1  1  1  1  1
          2.29438220          1.00000000
  1  1  1  1  1
          0.62806550          1.00000000
  1  1  1  1  1
          0.18123318          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# BASIS="Sadlej pVTZ"
#A. J. Sadlej, Collec. Czech. Chem. Commun.  53, 1995 (1988)
# A. J. Sadlej and M. Urban, J. Mol. Struct. (THEOCHEM) 234, 147 (1991)
# A. J. Sadlej, Theor. Chim. Acta 79, 123 (1992)
# A. J. Sadlej, Theor. Chim. Acta 81, 45 (1992)
# A. J. Sadlej, Theor. Chim. Acta 81, 339 (1992)
#
# HYDROGEN    (6S,4P) -> [3S,2P]
H  Sadlej-pVTZ
  5
  1  0  0  4  1
         33.86501400          0.00606800
          5.09478800          0.04531600
          1.15878600          0.20284600
          0.32584000          0.50370900
  1  0  0  1  1
          0.10274100          1.00000000
  1  0  0  1  1
          0.03240000          1.00000000
  1  1  1  2  1
          1.15880000          0.18844000
          0.32580000          0.88242000
  1  1  1  2  1
          0.10270000          0.11780000
          0.03240000          0.00420000
# LITHIUM     (10S,6P,4D) -> [5S,3P,2D]
LI Sadlej-pVTZ
 10
  1  0  0  5  1
       1359.44660000          0.00084400
        204.02647000          0.00648600
         46.54954100          0.03247700
         13.23259400          0.11742000
          4.28614800          0.29458000
  1  0  0  2  1
          1.49554200          0.44951500
          0.54223800          0.54223800
  1  0  0  1  1
          0.07396800          1.00000000
  1  0  0  1  1
          0.02809500          1.00000000
  1  0  0  1  1
          0.01067100          1.00000000
  1  1  1  4  1
          4.17000000          0.00511200
          1.17256000          0.02090700
          0.32927000          0.09167200
          0.09271000          0.44926000
  1  1  1  1  1
          0.02607000          1.00000000
  1  1  1  1  1
          0.00733100          1.00000000
  1  2  2  2  1
          0.32927000          0.15975700
          0.09271000          1.47548400
  1  2  2  2  1
          0.02607000          0.37057800
          0.00733100          0.01784700
# BERYLLIUM   (10S,6P,4D) -> [5S,3P,2D]
BE Sadlej-pVTZ
 10
  1  0  0  5  1
       2732.32810000          0.00074500
        410.31981000          0.00572200
         93.67264800          0.02888000
         26.58795700          0.10707600
          8.62956000          0.28010100
  1  0  0  2  1
          3.05626400          0.44544800
          1.13242400          0.28026200
  1  0  0  1  1
          0.18173200          1.00000000
  1  0  0  1  1
          0.05917000          1.00000000
  1  0  0  1  1
          0.01926500          1.00000000
  1  1  1  4  1
          7.64000000          0.00463000
          1.86360000          0.03296100
          0.45509000          0.12040400
          0.11107000          0.33952300
  1  1  1  1  1
          0.02710800          1.00000000
  1  1  1  1  1
          0.00661600          1.00000000
  1  2  2  2  1
          0.45509000          0.17848000
          0.11107000          1.01876000
  1  2  2  2  1
          0.02710800          0.42236400
          0.00661600          0.06003300
# CARBON      (10S,6P,4D) -> [5S,3P,2D]
C  Sadlej-pVTZ
 10
  1  0  0  5  1
       5240.63530000          0.00093700
        782.20480000          0.00722800
        178.35083000          0.03634400
         50.81594200          0.13060000
         16.82356200          0.31893100
  1  0  0  2  1
          6.17577600          0.43874200
          2.41804900          0.21497400
  1  0  0  1  1
          0.51190000          1.00000000
  1  0  0  1  1
          0.15659000          1.00000000
  1  0  0  1  1
          0.04790000          1.00000000
  1  1  1  4  1
         18.84180000          0.01388700
          4.15924000          0.08627900
          1.20671000          0.28874400
          0.38554000          0.49941100
  1  1  1  1  1
          0.12194000          1.00000000
  1  1  1  1  1
          0.03856800          1.00000000
  1  2  2  2  1
          1.20670000          0.26285000
          0.38550000          0.80430000
  1  2  2  2  1
          0.12190000          0.65350000
          0.03860000          0.86360000
# NITROGEN    (10S,6P,4D) -> [5S,3P,2D]
N  Sadlej-pVTZ
 10
  1  0  0  5  1
       8104.07160000          0.00080200
       1216.02150000          0.00617400
        277.23428000          0.03123300
         76.90402300          0.11519800
         25.87441900          0.29695100
  1  0  0  2  1
          9.34676700          0.44734900
          3.57979400          0.24500300
  1  0  0  1  1
          0.73961000          1.00000000
  1  0  0  1  1
          0.22261700          1.00000000
  1  0  0  1  1
          0.06700600          1.00000000
  1  1  1  4  1
         26.86898700          0.01447800
          5.99122700          0.09115600
          1.75084200          0.29742000
          0.56051100          0.49379600
  1  1  1  1  1
          0.17594800          1.00000000
  1  1  1  1  1
          0.05523100          1.00000000
  1  2  2  2  1
          1.75080000          0.22477000
          0.56050000          0.65956000
  1  2  2  2  1
          0.17959000          0.87136000
          0.05520000          0.70422000
# OXYGEN      (10S,6P,4D) -> [5S,3P,2D]
O  Sadlej-pVTZ
 10
  1  0  0  5  1
      10662.28500000          0.00079900
       1599.70970000          0.00615300
        364.72526000          0.03115700
        103.65179000          0.11559600
         33.90580500          0.30155200
  1  0  0  2  1
         12.28746900          0.44487000
          4.75680500          0.24317200
  1  0  0  1  1
          1.00427100          1.00000000
  1  0  0  1  1
          0.30068600          1.00000000
  1  0  0  1  1
          0.09003000          1.00000000
  1  1  1  4  1
         34.85646300          0.01564800
          7.84313100          0.09819700
          2.30624900          0.30776800
          0.72316400          0.49247000
  1  1  1  1  1
          0.21488200          1.00000000
  1  1  1  1  1
          0.06385000          1.00000000
  1  2  2  2  1
          2.30620000          0.20270000
          0.72320000          0.57910000
  1  2  2  2  1
          0.21490000          0.78545000
          0.06390000          0.53387000
# FLUORINE    (10S,6P,4D) -> [5S,3P,2D]
F  Sadlej-pVTZ
 10
  1  0  0  5  1
      13521.52300000          0.00080100
       2028.69160000          0.00616400
        462.37392000          0.03124400
        131.37366000          0.11608100
         42.97453100          0.30358900
  1  0  0  2  1
         15.57144000          0.44590400
          6.03223200          0.23911500
  1  0  0  1  1
          1.30721500          1.00000000
  1  0  0  1  1
          0.38886900          1.00000000
  1  0  0  1  1
          0.11568000          1.00000000
  1  1  1  4  1
         44.14730300          0.01650900
          9.99342600          0.10348100
          2.95324600          0.31548100
          0.91859700          0.48935300
  1  1  1  1  1
          0.26682400          1.00000000
  1  1  1  1  1
          0.07750000          1.00000000
  1  2  2  2  1
          2.95320000          0.18354000
          0.91860000          0.51058000
  1  2  2  2  1
          0.26680000          0.69925000
          0.07750000          0.42926000
# SODIUM      (14S,10P,4D) -> [7S,5P,2D]
NA Sadlej-pVTZ
 13
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212800          0.00000000
        339.62000000          0.16978600          0.00000000
        109.55000000          0.51460900          0.00000000
         38.77700000          0.37983400          0.37476300
         14.57600000          0.00000000          0.57577100
          5.26990000          0.00000000          0.11392800
  1  0  0  1  1
          1.82780000          1.00000000
  1  0  0  1  1
          0.61990000          1.00000000
  1  0  0  1  1
          0.05720000          1.00000000
  1  0  0  1  1
          0.02400000          1.00000000
  1  0  0  1  1
          0.01010000          1.00000000
  1  1  1  6  1
        144.64500000          0.00545700
         33.90700000          0.03913800
         10.62900000          0.15192400
          3.82390000          0.33309800
          1.44430000          0.42228400
          0.55260000          0.28119700
  1  1  1  1  1
          0.18870000          1.00000000
  1  1  1  1  1
          0.04650000          1.00000000
  1  1  1  1  1
          0.01630000          1.00000000
  1  1  1  1  1
          0.00570000          1.00000000
  1  2  2  2  1
          1.44430000          0.35137900
          0.55260000          0.37827300
  1  2  2  2  1
          0.18870000          0.01118000
          0.04650000          0.27875100
# MAGNESIUM   (14S,10P,4D) -> [7S,5P,2D]
MG Sadlej-pVTZ
 13
  1  0  0  8  2
      43886.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676300          0.00000000
         51.39800000          0.49797600          0.25135500
         19.92000000          0.00000000          0.61867100
          8.02470000          0.00000000          0.18841600
  1  0  0  1  1
          2.50820000          1.00000000
  1  0  0  1  1
          0.87150000          1.00000000
  1  0  0  1  1
          0.10820000          1.00000000
  1  0  0  1  1
          0.04010000          1.00000000
  1  0  0  1  1
          0.01490000          1.00000000
  1  1  1  6  1
        193.85400000          0.00480200
         45.44200000          0.03551600
         14.18600000          0.14489300
          5.05750000          0.33817900
          1.88860000          0.44110400
          0.72270000          0.26084900
  1  1  1  1  1
          0.23640000          1.00000000
  1  1  1  1  1
          0.09340000          1.00000000
  1  1  1  1  1
          0.03480000          1.00000000
  1  1  1  1  1
          0.01300000          1.00000000
  1  2  2  2  1
          1.88860000          0.32097500
          0.72270000          0.30683900
  1  2  2  2  1
          0.23640000          0.02804400
          0.09340000          0.17855400
# SILICON     (14S,10P,4D) -> [7S,5P,2D]
SI Sadlej-pVTZ
 13
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.88000000          0.03108800          0.00000000
        657.14000000          0.12496600          0.00000000
        214.30000000          0.38689600          0.00000000
         77.62900000          0.55489000          0.17788200
         30.63100000          0.00000000          0.62775600
         12.80100000          0.00000000          0.24763100
  1  0  0  1  1
          3.92690000          1.00000000
  1  0  0  1  1
          1.45230000          1.00000000
  1  0  0  1  1
          0.25620000          1.00000000
  1  0  0  1  1
          0.09430000          1.00000000
  1  0  0  1  1
          0.03470000          1.00000000
  1  1  1  6  1
        335.48000000          0.00361600
         78.90000000          0.02786600
         24.98800000          0.11867800
          9.21970000          0.29875000
          3.62110000          0.44119200
          1.45130000          0.31270100
  1  1  1  1  1
          0.50500000          1.00000000
  1  1  1  1  1
          0.18630000          1.00000000
  1  1  1  1  1
          0.06540000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  2  1
          0.50500000          0.22610000
          0.18630000          1.07590000
  1  2  2  2  1
          0.06540000          0.16360000
          0.02300000          0.10770000
# PHOSPHORUS  (14S,10P,4D) -> [7S,5P,2D]
P  Sadlej-pVTZ
 13
  1  0  0  8  2
      77492.43000000          0.00078700          0.00000000
      11605.79000000          0.00610900          0.00000000
       2645.96000000          0.03136800          0.00000000
        754.98000000          0.12429100          0.00000000
        248.75000000          0.38068200          0.00000000
         91.15700000          0.55998900          0.16399700
         36.22600000          0.00000000          0.62592700
         15.21100000          0.00000000          0.26221100
  1  0  0  1  1
          4.71380000          1.00000000
  1  0  0  1  1
          1.78270000          1.00000000
  1  0  0  1  1
          0.34250000          1.00000000
  1  0  0  1  1
          0.12460000          1.00000000
  1  0  0  1  1
          0.04530000          1.00000000
  1  1  1  6  1
        384.84000000          0.00037650
         90.55200000          0.02901000
         28.80600000          0.12295300
         10.68800000          0.30647000
          4.25210000          0.44134900
          1.74050000          0.29581700
  1  1  1  1  1
          0.59790000          1.00000000
  1  1  1  1  1
          0.22920000          1.00000000
  1  1  1  1  1
          0.08380000          1.00000000
  1  1  1  1  1
          0.03060000          1.00000000
  1  2  2  2  1
          0.59790000          0.30930000
          0.22920000          0.97150000
  1  2  2  2  1
          0.08380000          0.12780000
          0.03060000          0.07740000
# SULFUR      (14S,10P,4D) -> [7S,5P,2D]
S  Sadlej-pVTZ
 13
  1  0  0  8  2
      99413.40000000          0.00074200          0.00000000
      13961.70000000          0.00579000          0.00000000
       3169.90000000          0.02994100          0.00000000
        902.46000000          0.11897500          0.00000000
        297.16000000          0.36829000          0.00000000
        108.70200000          0.57748900          0.14293200
         43.15500000          0.00000000          0.62464900
         18.10800000          0.00000000          0.28340000
  1  0  0  1  1
          5.57050000          1.00000000
  1  0  0  1  1
          2.14270000          1.00000000
  1  0  0  1  1
          0.43400000          1.00000000
  1  0  0  1  1
          0.15700000          1.00000000
  1  0  0  1  1
          0.05680000          1.00000000
  1  1  1  6  1
        495.04000000          0.00317100
        117.22000000          0.02464300
         37.50700000          0.10784500
         13.91000000          0.28848900
          5.50450000          0.44810800
          2.24330000          0.32051700
  1  1  1  1  1
          0.77620000          1.00000000
  1  1  1  1  1
          0.29190000          1.00000000
  1  1  1  1  1
          0.10290000          1.00000000
  1  1  1  1  1
          0.03630000          1.00000000
  1  2  2  2  1
          0.77620000          0.29150000
          0.29190000          0.89660000
  1  2  2  2  1
          0.10290000          0.11380000
          0.03630000          0.05680000
# CHLORINE    (14S,10P,4D) -> [7S,5P,2D]
CL Sadlej-pVTZ
 13
  1  0  0  8  2
     105818.80000000          0.00074300          0.00000000
      15872.00000000          0.00575400          0.00000000
       3619.70000000          0.02967400          0.00000000
       1030.80000000          0.11799100          0.00000000
        339.91000000          0.36531900          0.00000000
        124.53800000          0.58114600          0.13754300
         49.51400000          0.00000000          0.62292000
         20.80600000          0.00000000          0.29010600
  1  0  0  1  1
          6.46480000          1.00000000
  1  0  0  1  1
          2.52540000          1.00000000
  1  0  0  1  1
          0.53780000          1.00000000
  1  0  0  1  1
          0.19350000          1.00000000
  1  0  0  1  1
          0.06960000          1.00000000
  1  1  1  6  1
        589.78000000          0.00298200
        139.85000000          0.02337500
         44.79500000          0.10399800
         16.61200000          0.28443000
          6.59950000          0.45068600
          2.71410000          0.32306400
  1  1  1  1  1
          0.95280000          1.00000000
  1  1  1  1  1
          0.35800000          1.00000000
  1  1  1  1  1
          0.12500000          1.00000000
  1  1  1  1  1
          0.04360000          1.00000000
  1  2  2  2  1
          0.95280000          0.28530000
          0.35800000          0.81690000
  1  2  2  2  1
          0.12500000          0.10130000
          0.04360000          0.04300000
# POTASSIUM   (15S,13P,4D) -> [9S,7P,2D]
K  Sadlej-pVTZ
 15
  1  0  0  9  3
     151351.90000000          0.00025850          0.00007450         -0.00002450
      22745.91000000          0.00199200          0.00056980         -0.00018820
       5227.16600000          0.01014690          0.00295990         -0.00097180
       1500.18800000          0.04036660          0.01176040         -0.00390390
        495.47030000          0.12730020          0.04002060         -0.01318970
        180.90080000          0.29858250          0.10237690         -0.03477070
         71.21769000          0.41850020          0.20508810         -0.07005520
         29.38428000          0.23708130          0.13515080         -0.05254560
          8.69924300          0.02020670         -0.50257140          0.24206320
  1  0  0  1  1
          3.47330400          1.00000000
  1  0  0  1  1
          0.81456200          1.00000000
  1  0  0  1  1
          0.31891500          1.00000000
  1  0  0  1  1
          0.03548400          1.00000000
  1  0  0  1  1
          0.01639000          1.00000000
  1  0  0  1  1
          0.00757000          1.00000000
  1  1  1  8  2
        868.39030000          0.00233510          0.00017880
        205.57650000          0.01875440          0.00576410
         65.91230000          0.08655860          0.02746990
         24.59863000          0.25027990          0.08139200
          9.88228100          0.43003970          0.15135980
          4.11675100          0.35114370          0.10827110
          1.55600400          0.06641970         -0.26193700
          0.61218800         -0.05125300         -0.58403100
  1  1  1  1  1
          0.22305300          1.00000000
  1  1  1  1  1
          0.08126000          1.00000000
  1  1  1  1  1
          0.02961000          1.00000000
  1  1  1  1  1
          0.01079000          1.00000000
  1  1  1  1  1
          0.00393000          1.00000000
  1  2  2  2  1
          0.61219000          0.57237000
          0.22305000          0.66528000
  1  2  2  2  1
          0.02961000          0.37658000
          0.01079000          0.37295000
# CALCIUM     (15S,13P,4D) -> [9S,7P,2D]
CA Sadlej-pVTZ
 15
  1  0  0  9  3
     171297.15000000          0.00025100         -0.00007310          0.00002510
      25997.43000000          0.00190900         -0.00055180          0.00019060
       5996.48000000          0.00973920         -0.00286960          0.00098530
       1714.73000000          0.03910600         -0.01151110          0.00399620
        563.65320000          0.12449940         -0.03947410          0.01360870
        204.94600000          0.29520870         -0.10212320          0.03628250
         80.45147000          0.41956110         -0.20617240          0.07376420
         33.14092000          0.24275360         -0.14147230          0.05758500
          9.87914600          0.02151540          0.49590070         -0.25268930
  1  0  0  1  1
          3.99467000          1.00000000
  1  0  0  1  1
          0.98534300          1.00000000
  1  0  0  1  1
          0.41161600          1.00000000
  1  0  0  1  1
          0.06560500          1.00000000
  1  0  0  1  1
          0.02674000          1.00000000
  1  0  0  1  1
          0.01062000          1.00000000
  1  1  1  8  2
       1003.02700000          0.00222070         -0.00072750
        237.82390000          0.01786480         -0.00585370
         76.56948000          0.08273140         -0.02794790
         28.73768000          0.24195210         -0.08405700
         11.63688000          0.42420780         -0.15902850
          4.90320800          0.35857820         -0.12159820
          1.92337000          0.07503820          0.24858350
          0.78005800          0.00451020          0.59543360
  1  1  1  1  1
          0.29376400          1.00000000
  1  1  1  1  1
          0.11063000          1.00000000
  1  1  1  1  1
          0.04166000          1.00000000
  1  1  1  1  1
          0.01569000          1.00000000
  1  1  1  1  1
          0.00591000          1.00000000
  1  2  2  2  1
          0.78006000          0.51870000
          0.29376000          0.56587000
  1  2  2  2  1
          0.04166000          0.33335000
          0.01569000          0.14089000
# BROMINE     (15S,12P,9D,4F) -> [9S,7P,4D,2F]
BR Sadlej-pVTZ
 17
  1  0  0 10  4
     379677.70000000          0.00038420         -0.00012080          0.00004800         -0.00001470
      56125.18000000          0.00300030         -0.00094110          0.00037490         -0.00011470
      12967.35000000          0.01489070         -0.00474420          0.00188270         -0.00057660
       3836.08200000          0.05477460         -0.01770260          0.00709770         -0.00217350
       1331.99600000          0.15677150         -0.05499180          0.02201390         -0.00675470
        508.04210000          0.33280990         -0.13338940          0.05533690         -0.01701640
        207.78120000          0.39856780         -0.23451110          0.09950580         -0.03086650
         90.42185000          0.17653680         -0.09721030          0.04981420         -0.01561800
         33.00437000          0.01249060          0.54259170         -0.35744090          0.11757500
         14.35639000         -0.00172190          0.57185840         -0.51718760          0.18286250
  1  0  0  1  1
          4.72852500          1.00000000
  1  0  0  1  1
          2.03296700          1.00000000
  1  0  0  1  1
          0.41270600          1.00000000
  1  0  0  1  1
          0.15614200          1.00000000
  1  0  0  1  1
          0.05907400          1.00000000
  1  1  1  8  3
       3167.91000000          0.00246430         -0.00099400          0.00025880
        762.50440000          0.01959070         -0.00795010          0.00204380
        249.39630000          0.09116940         -0.03828910          0.01003860
         95.23177000          0.26560200         -0.11691170          0.03024520
         39.92301000          0.43554300         -0.20901610          0.05658970
         17.78166000          0.31177610         -0.09683760          0.01958550
          7.67726400          0.06020910          0.35122830         -0.10565350
          3.34206400         -0.00199290          0.56985370         -0.22549650
  1  1  1  1  1
          1.44242200          1.00000000
  1  1  1  1  1
          0.44232000          1.00000000
  1  1  1  1  1
          0.13777200          1.00000000
  1  1  1  1  1
          0.04291300          1.00000000
  1  2  2  3  1
         96.15001000          0.02651280
         27.83908000          0.15006420
          9.85106700          0.38048960
  1  2  2  2  1
          3.61018700          0.48027720
          1.25154400          0.24788540
  1  2  2  2  1
          1.44240000          0.00395000
          0.44230000          0.80388000
  1  2  2  2  1
          0.13780000          0.13480000
          0.04290000          0.06231000
  1  3  3  2  1
         27.83910000          0.02844100
          9.85107000          0.12122800
  1  3  3  2  1
          3.61019000          0.25277100
          1.25154000          0.22157900
# RUBIDIUM    (18S,15P,10D) -> [11S,9P,4D]
RB Sadlej-pVTZ
 19
  1  0  0 11  4
     432918.40000000          0.00037020         -0.00011700          0.00004740          0.00001600
      65814.05000000          0.00279580         -0.00088250          0.00035770          0.00012080
      15362.04000000          0.01385200         -0.00442590          0.00179340          0.00060530
       4506.95000000          0.05253920         -0.01709230          0.00695990          0.00235420
       1533.26200000          0.15484700         -0.05424870          0.02222370          0.00750950
        581.09600000          0.32664490         -0.13182170          0.05535600          0.01883560
        240.21680000          0.39424630         -0.22703110          0.09919630          0.03379590
        106.11120000          0.18840790         -0.12106900          0.05908320          0.02088110
         40.82235000          0.01691090          0.45008930         -0.28498790         -0.10455660
         18.69521000         -0.00277380          0.60674180         -0.56166080         -0.21509890
          7.85089400          0.00154220          0.13097090          0.06893800          0.02617940
  1  0  0  1  1
          3.94615000          1.00000000
  1  0  0  1  1
          1.84403900          1.00000000
  1  0  0  1  1
          0.06921720          1.00000000
  1  0  0  1  1
          0.27676700          1.00000000
  1  0  0  1  1
          0.03889000          1.00000000
  1  0  0  1  1
          0.01963200          1.00000000
  1  0  0  1  1
          0.00991000          1.00000000
  1  1  1  9  3
       3772.36000000          0.00224900         -0.00093260         -0.00027990
        896.84980000          0.01841780         -0.00764860         -0.00228370
        291.17740000          0.08705500         -0.03758360         -0.01135210
        111.16650000          0.25735740         -0.11573930         -0.03489420
         46.59779000          0.43451480         -0.21569860         -0.06690170
         20.61947000          0.32479400         -0.10128430         -0.02586680
          8.54580300          0.06296000          0.38339830          0.14412410
          3.72780700         -0.00301060          0.57238880          0.25911670
          1.62608800          0.00227040          0.18499650         -0.02242420
  1  1  1  1  1
          0.60815400          1.00000000
  1  1  1  1  1
          0.21125700          1.00000000
  1  1  1  1  1
          0.07338500          1.00000000
  1  1  1  1  1
          0.02549200          1.00000000
  1  1  1  1  1
          0.00885500          1.00000000
  1  1  1  1  1
          0.00308000          1.00000000
  1  2  2  4  1
        132.33260000          0.01956850
         38.80142000          0.11893780
         14.10538000          0.32958700
          5.53661600          0.45462320
  1  2  2  2  1
          2.23966800          0.29737770
          0.85943200          0.05918200
  1  2  2  2  1
          0.60815000          0.08031000
          0.21126000          0.10313000
  1  2  2  2  1
          0.02549000          0.44488000
          0.00886000          0.37698000
# STRONTIUM   (18S,15P,10D) -> [11S,9P,4D]
SR Sadlej-pVTZ
 19
  1  0  0 11  4
     447503.80000000          0.00037980         -0.00012030         -0.00004910          0.00001740
      68033.85000000          0.00286610         -0.00090690         -0.00037080          0.00013180
      15907.65000000          0.01414740         -0.00453340         -0.00185360          0.00065780
       4680.18100000          0.05338980         -0.01741690         -0.00715570          0.00254670
       1596.10800000          0.15677030         -0.05516680         -0.02281190          0.00810370
        605.02680000          0.33004550         -0.13393850         -0.05678060          0.02034300
        249.66550000          0.39426210         -0.22989190         -0.10157800          0.03636980
        110.23710000          0.18288270         -0.11405300         -0.05636820          0.02115380
         42.34581000          0.01568870          0.46964200          0.30364050         -0.11807470
         19.32749000         -0.00261670          0.59824300          0.56731990          0.22897930
          7.94375200          0.00148320          0.12031880         -0.13577640          0.05482200
  1  0  0  1  1
          3.99792700          1.00000000
  1  0  0  1  1
          1.93331400          1.00000000
  1  0  0  1  1
          0.71633500          1.00000000
  1  0  0  1  1
          0.30581700          1.00000000
  1  0  0  1  1
          0.05487500          1.00000000
  1  0  0  1  1
          0.02294400          1.00000000
  1  0  0  1  1
          0.00959300          1.00000000
  1  1  1  9  3
       3942.23500000          0.00230060          0.00096470         -0.00031110
        935.36130000          0.01887990          0.00793810         -0.00254770
        303.60260000          0.08905800          0.03891590         -0.01263310
        115.89080000          0.26221620          0.11963390         -0.03880580
         48.56029000          0.43752720          0.22008900         -0.07343700
         21.49991000          0.31769830          0.09481260         -0.02521190
          8.94698400          0.05894890         -0.40425900          0.16581460
          3.86965000         -0.00251450         -0.58060630          0.28752600
          1.61773200          0.00198100         -0.15882060         -0.08079170
  1  1  1  1  1
          0.64198300          1.00000000
  1  1  1  1  1
          0.23849500          1.00000000
  1  1  1  1  1
          0.08876700          1.00000000
  1  1  1  1  1
          0.03303900          1.00000000
  1  1  1  1  1
          0.01229700          1.00000000
  1  1  1  1  1
          0.00457700          1.00000000
  1  2  2  4  1
        137.77420000          0.02082950
         40.44428000          0.12589180
         14.68809000          0.34435740
          5.75212900          0.46147100
  1  2  2  2  1
          2.32495500          0.27626760
          0.88911100          0.04438420
  1  2  2  2  1
          0.64198000          0.83492000
          0.23850000          0.80831000
  1  2  2  2  1
          0.03304000          0.39400000
          0.01230000          0.11109000
# IODINE      (19S,15P,12D,4F) -> [11S,9P,6D,2F]
I  Sadlej-pVTZ
 19
  1  0  0 13  5
    1024924.80000000         -0.00031120          0.00010120         -0.00004510         -0.00002030          0.00000690
     154843.13000000         -0.00238220          0.00077360         -0.00034510         -0.00015560          0.00005290
      35646.33600000         -0.01210280          0.00397840         -0.00177150         -0.00079920          0.00027190
      10272.63000000         -0.04739060          0.01582010         -0.00709610         -0.00320170          0.00108830
       3434.47690000         -0.14435740          0.05179790         -0.02330840         -0.01054490          0.00359000
       1284.43130000         -0.31644810          0.12988120         -0.06026250         -0.02735820          0.00930650
        525.64189000         -0.40189880          0.23403130         -0.11246510         -0.05169880          0.01767380
        230.74127000         -0.20585810          0.13785890         -0.07617240         -0.03557510          0.01210960
         87.25521700         -0.01951780         -0.47045900          0.35156800          0.17534850         -0.06059020
         39.49446400          0.00351050         -0.62441440          0.64497580          0.35783470         -0.12752780
         14.25452000         -0.00215030         -0.11868340         -0.41409940         -0.32857720          0.12801440
          7.64660890          0.00190770          0.03771190         -0.80842900         -0.92020060          0.37253770
          3.05005980         -0.00171740         -0.02476350         -0.15597730          0.24782610         -0.13940910
  1  0  0  1  1
          1.73261810          1.00000000
  1  0  0  1  1
          0.87682360          1.00000000
  1  0  0  1  1
          0.63499300          1.00000000
  1  0  0  1  1
          0.25649760          1.00000000
  1  0  0  1  1
          0.10611690          1.00000000
  1  0  0  1  1
          0.04390220          1.00000000
  1  1  1 10  4
       7299.04100000          0.00263160          0.00122930          0.00053660          0.00015990
       1767.86710000          0.02049250          0.00967380          0.00422850          0.00126120
        590.09433000          0.09320570          0.04558810          0.02008670          0.00599460
        231.49387000          0.26163390          0.13561190          0.06039740          0.01807690
        101.73176000          0.41588470          0.23456620          0.10674460          0.03200640
         47.56911900          0.31281820          0.12012920          0.04674670          0.01372830
         22.27540400          0.07148570         -0.34953750         -0.22011500         -0.07006300
         10.84089700          0.00109600         -0.58376400         -0.42079030         -0.13605430
          5.23794980          0.00063450         -0.20620120          0.06285800          0.03812520
          2.54663340         -0.00038110         -0.85723060          0.64345010          0.27009600
  1  1  1  1  1
          1.21068480          1.00000000
  1  1  1  1  1
          0.57440920          1.00000000
  1  1  1  1  1
          0.24653310          1.00000000
  1  1  1  1  1
          0.09135320          1.00000000
  1  1  1  1  1
          0.03385110          1.00000000
  1  2  2  4  2
        370.37639000          0.01607890          0.00666480
        109.71047000          0.10913290          0.04617800
         41.19921600          0.32774670          0.14050370
         17.28460700          0.46584060          0.18651160
  1  2  2  4  2
          7.81544150          0.26401570          0.01089200
          3.74281530          0.04389700          0.38274730
          1.65958780          0.00308300          0.52593280
          0.65265910         -0.00042300          0.22223190
  1  2  2  2  1
          0.57440900          0.24806500
          0.24653300          1.07295300
  1  2  2  2  1
          0.09135300          0.13663400
          0.03385100          0.05436000
  1  3  3  2  1
          7.81544150          0.00389600
          3.74281530          0.19783900
  1  3  3  2  1
          1.65958780          0.40825400
          0.65265910          0.27508300
# BASIS="Roos Augmented Double Zeta ANO"
#Elements                             References
#--------                             ----------
#H - Ne:  P.O. Widmark, P.A. Malmqvist, B. Roos, Theor. Chim. Acta, 77,
#         291 (1990).
#Na - Ar: P.O. Widmark, B. J. Persson and B. Roos Theor. Chim. Acta, 79,
#         419 (1991).
#Sc - Zn: R. Pou-Amerigo, M. Merchan, I. Nebot-Gil, P.O. Widmark and B. Roos,
#         Theor. Chim. Acta, 92, 149 (1995).
#
# HYDROGEN    (8s,4p) -> [3s,2p]
H  Roos-ADZ-ANO
  2
  1  0  0  8  3
        188.61445000          0.00096390         -0.00131190          0.00242240
         28.27659600          0.00749200         -0.01034510          0.02033820
          6.42483000          0.03759540         -0.05049530          0.08963940
          1.81504100          0.14339500         -0.20738550          0.44229070
          0.59106300          0.34863630         -0.43508850          0.57571440
          0.21214900          0.43829740         -0.02472970         -0.98028900
          0.07989100          0.16510660          0.32252600         -0.67215380
          0.02796200          0.02102290          0.70727540          1.14176850
  1  1  1  4  2
          2.30500000          0.11279020         -0.21086880
          0.80675000          0.41850750         -0.59437960
          0.28236200          0.47000770          0.08968890
          0.09882700          0.18262600          0.86116340
# HELIUM      (9s,4p) -> [3s,2p]
HE Roos-ADZ-ANO
  2
  1  0  0  9  3
       1149.27050000          0.00035774         -0.00053060          0.00070544
        172.04457000          0.00277289         -0.00403300          0.00705199
         39.08046500          0.01429838         -0.02258040          0.03126037
         11.03617300          0.05586749         -0.10262550          0.32197965
          3.56415200          0.16336284         -0.45771141          1.00474880
          1.24044300          0.33133146         -0.60596530         -1.29080400
          0.44731600          0.41429728          0.57131336         -0.47258960
          0.16420600          0.18903228          0.54758341          0.95308829
          0.05747200          0.00515606          0.01165900          0.05061692
  1  1  1  4  2
          4.55000000          0.08926060         -0.18673500
          1.59250000          0.38050238         -0.51173450
          0.55737500          0.44912372         -0.19815060
          0.19508100          0.27765440          0.99587976
# LITHIUM     (14s,9p,4d) -> [4s,3p,2d]
LI Roos-ADZ-ANO
  3
  1  0  0 14  4
       9497.93440000          0.00007470         -0.00001100          0.00000640         -0.00004010
       1416.81120000          0.00058360         -0.00008570          0.00004890         -0.00031020
        321.45994000          0.00306100         -0.00045070          0.00026580         -0.00164650
         91.12416300          0.01260110         -0.00186300          0.00106850         -0.00663950
         29.99989100          0.04234720         -0.00635750          0.00397710         -0.02266020
         11.01763100          0.11475800         -0.01776730          0.01120300         -0.05824470
          4.37280100          0.23936590         -0.03979680          0.03121890         -0.12226070
          1.83125600          0.35759180         -0.07012820          0.06165080         -0.13524710
          0.80226100          0.30337580         -0.10294690          0.15065020         -0.05426510
          0.36264800          0.08637930         -0.09370780          0.18747830          0.08320130
          0.11399500          0.00264390          0.22012880         -1.09410700          1.74793500
          0.05123700          0.00121700          0.59337740         -0.29242230         -1.64630700
          0.02246800          0.00056200          0.29452750          0.84809440         -0.74085420
          0.00786000          0.00001970          0.02495030          0.44800090          1.30386500
  1  1  1  9  3
         13.11950400          0.00144900         -0.00232680          0.00948250
          3.07742420          0.00799580         -0.01122420          0.06320780
          1.09880050          0.02134850         -0.03446260          0.17514660
          0.43577840          0.05011950         -0.03387750          0.57689390
          0.18024320          0.19547390         -0.45445200          0.55635160
          0.07613330          0.41911190         -0.49630840         -1.29108200
          0.03254650          0.34816470          0.48858790          0.20705210
          0.01401820          0.15059750          0.56023390          0.42867280
          0.00490640          0.01570330          0.07028070          0.00433120
  1  2  2  4  2
          0.45000000          0.02237290         -0.03046180
          0.15750000          0.37508790         -0.57345880
          0.05512500          0.46891730         -0.27418710
          0.01929380          0.36536290          0.95628830
# BERYLLIUM   (14s,9p,4d) -> [4s,3p,2d]
BE Roos-ADZ-ANO
  3
  1  0  0 14  4
      22628.59900000          0.00005330         -0.00001020          0.00001240         -0.00001630
       3372.31810000          0.00041810         -0.00008040          0.00009760         -0.00010870
        760.35040000          0.00222600         -0.00042810          0.00051670         -0.00072720
        211.74048000          0.00956280         -0.00184870          0.00225260         -0.00232140
         67.22346800          0.03481790         -0.00680080          0.00822820         -0.01240240
         23.37217700          0.10594610         -0.02137190          0.02644130         -0.02509110
          8.72137300          0.24566320         -0.05303520          0.06578970         -0.11646220
          3.46809100          0.38607360         -0.10045770          0.13010640         -0.06311670
          1.45214400          0.31037320         -0.13751390          0.19754920         -0.67003370
          0.60861500          0.06389400         -0.06507040          0.07492650          1.22635800
          0.25768600         -0.00153140          0.32457320         -1.38872200          1.07468780
          0.10417600          0.00118250          0.61816430          0.15458290         -2.96245500
          0.04242700         -0.00025210          0.20476750          1.02601810          1.56000350
          0.01484900          0.00007380          0.00430350          0.02577770          0.28184410
  1  1  1  9  3
         33.71018400          0.00103780         -0.00121420          0.00258730
          8.05764950          0.00660870         -0.00561260          0.02089540
          2.83647140          0.02155900         -0.02547970          0.05737160
          1.09996570          0.06087780         -0.01144150          0.26426850
          0.44339640          0.20355730         -0.51385070          1.06476000
          0.18222640          0.45796690         -0.49080920         -1.43630700
          0.07572410          0.36859060          0.72214520         -0.05473260
          0.03168540          0.06306410          0.43076220          0.77703460
          0.01108990          0.00210970          0.00225560         -0.03205040
  1  2  2  4  2
          1.40000000          0.00667730         -0.01038680
          0.49000000          0.24681340          0.89258070
          0.17150000          0.65744630         -0.15070990
          0.06002500          0.25351910         -0.68121650
# BORON       (14s,9p,4d) -> [4s,3p,2d]
B  Roos-ADZ-ANO
  3
  1  0  0 14  4
      33360.21700000          0.00005830         -0.00001210          0.00001210         -0.00001800
       4972.09520000          0.00045650         -0.00009500          0.00009450         -0.00012920
       1125.64170000          0.00240890         -0.00050280          0.00049970         -0.00077710
        316.49136000          0.01016310         -0.00212640          0.00211920         -0.00278200
        102.00726000          0.03609550         -0.00767440          0.00765190         -0.01256000
         36.29587300          0.10598100         -0.02321790          0.02340450         -0.03012700
         13.97141000          0.23956540         -0.05694680          0.05811560         -0.11132910
          5.74115600          0.37377260         -0.10625770          0.11167390         -0.10474970
          2.49426800          0.30814650         -0.14576940          0.17056230         -0.45988410
          1.11420200          0.07769280         -0.04302850          0.01726760          0.67401790
          0.42154900          0.00147970          0.37194410         -0.99890440          1.50425190
          0.16963300          0.00049910          0.56520900         -0.22657220         -2.47604300
          0.06853500         -0.00002620          0.19212690          1.02945500          0.57766700
          0.02398700          0.00002360          0.02191280          0.22137860          0.74299930
  1  1  1  9  3
         55.00000000          0.00101860         -0.00077760          0.00075900
         13.36610100          0.00739580         -0.00577680          0.00591510
          4.13539400          0.03225140         -0.02261340          0.01360090
          1.48125600          0.09834640         -0.06968340          0.03206280
          0.60213600          0.23180240         -0.25511460          0.62952610
          0.25563600          0.34124360         -0.36077860          0.17326490
          0.11115100          0.29329830          0.06123950         -0.89178530
          0.04764800          0.16959510          0.29599380         -0.35355500
          0.01667700          0.15075690          0.66292780          0.84690410
  1  2  2  4  2
          1.20000000          0.08034580         -0.12246280
          0.42000000          0.42193580         -0.56047330
          0.14700000          0.46391670         -0.08942600
          0.05145000          0.28557340          0.90159380
# CARBON      (14s,9p,4d) -> [4s,3p,2d]
C  Roos-ADZ-ANO
  3
  1  0  0 14  4
      50557.50100000          0.00005530         -0.00001200          0.00001190         -0.00001560
       7524.78560000          0.00043430         -0.00009400          0.00009270         -0.00011400
       1694.32760000          0.00231590         -0.00050280          0.00049890         -0.00067310
        472.82279000          0.00987290         -0.00214760          0.00211800         -0.00253230
        151.71075000          0.03521950         -0.00779420          0.00777840         -0.01090030
         53.91874600          0.10419380         -0.02376340          0.02363280         -0.02778070
         20.65931100          0.24127410         -0.06002350          0.06163060         -0.09587130
          8.38397600          0.38401740         -0.11539850          0.11896800         -0.12478060
          3.57701500          0.30823710         -0.15390090          0.18806210         -0.39324600
          1.54711800          0.06830550         -0.01459460         -0.05403040          0.67960040
          0.61301300          0.00077820          0.38958490         -0.98141370          1.19786900
          0.24606800          0.00099050          0.53972910         -0.10967580         -1.89795200
          0.09908700         -0.00008930          0.18840600          0.88473560         -0.00446140
          0.03468000          0.00004710          0.02585750          0.29649830          1.01421480
  1  1  1  9  3
         83.33315500          0.00122410         -0.00114440          0.00146690
         19.55761100          0.00943890         -0.00897960          0.01445530
          6.08036500          0.04177440         -0.03784560          0.04663730
          2.17931700          0.13183300         -0.12927080          0.23665370
          0.86515000          0.27891190         -0.37840220          0.60887340
          0.36194400          0.36686630         -0.26921370         -0.39177930
          0.15474000          0.27905910          0.29175420         -0.87002290
          0.06542900          0.13804810          0.54366980          0.42005050
          0.02290000          0.03419500          0.26283080          0.57994970
  1  2  2  4  2
          1.90000000          0.09873120         -0.14550130
          0.66500000          0.45296610         -0.50768090
          0.23275000          0.43624570         -0.10156300
          0.08146300          0.27192500          0.92519220
# NITROGEN    (14s,9p,4d) -> [4s,3p,2d]
N  Roos-ADZ-ANO
  3
  1  0  0 14  4
      74761.71500000          0.00005020         -0.00001120          0.00000970         -0.00001210
      11123.65400000          0.00039460         -0.00008780          0.00007650         -0.00009030
       2512.68570000          0.00208850         -0.00046670          0.00040480         -0.00051790
        703.77729000          0.00890790         -0.00199310          0.00173980         -0.00200460
        225.47879000          0.03208840         -0.00730330          0.00634560         -0.00836000
         79.61581000          0.09744740         -0.02282590          0.02014050         -0.02274400
         30.23728300          0.23178950         -0.05922070          0.05240310         -0.07448660
         12.26362200          0.37769110         -0.11561210          0.10665170         -0.11086000
          5.26508600          0.31879170         -0.15650830          0.15833880         -0.29833890
          2.33347100          0.08237820         -0.02310580         -0.00500510          0.32128220
          0.90185600          0.00279050          0.37564760         -0.84187200          1.17102980
          0.35833600          0.00024650          0.54576530         -0.15905630         -0.86495620
          0.14109300         -0.00002890          0.21035430          0.59120260         -1.22379300
          0.04938300          0.00000970          0.01278950          0.57660530          1.44458050
  1  1  1  9  3
        126.66657000          0.00114230         -0.00095650          0.00142010
         29.83738900          0.00895910         -0.00757630          0.01254390
          9.39403800          0.04053750         -0.03369470          0.05099130
          3.40510400          0.12949010         -0.11334370          0.20571180
          1.35000000          0.27678080         -0.30554980          0.54520410
          0.55769600          0.36888890         -0.27339530         -0.15225420
          0.23244900          0.29346190          0.20192520         -0.83771660
          0.09426400          0.12846830          0.49253440          0.04965950
          0.03299200          0.03905860          0.40980120          0.74594410
  1  2  2  4  2
          2.75000000          0.12053068         -0.17333210
          0.96250000          0.50760685         -0.47399030
          0.33687500          0.44539556          0.03678810
          0.11790600          0.15876917          0.89316126
# OXYGEN      (14s,9p,4d) -> [4s,3p,2d]
O  Roos-ADZ-ANO
  3
  1  0  0 14  4
     105374.95000000          0.00004590         -0.00001050          0.00000900         -0.00001090
      15679.24000000          0.00036070         -0.00008250          0.00007050         -0.00008220
       3534.54470000          0.00191980         -0.00044120          0.00037570         -0.00046750
        987.36516000          0.00820670         -0.00188640          0.00161460         -0.00184650
        315.97875000          0.02972570         -0.00695400          0.00593400         -0.00755850
        111.65428000          0.09045580         -0.02172080          0.01878660         -0.02108680
         42.69945100          0.21740540         -0.05685130          0.04946830         -0.06675110
         17.39559600          0.36876570         -0.11396350          0.10303990         -0.10936730
          7.43830900          0.33727980         -0.16202010          0.16205860         -0.27314310
          3.22286200          0.09675050         -0.03338000          0.00093670          0.20971370
          1.25387700          0.00256740          0.36550680         -0.82242510          1.20348070
          0.49515500          0.00137460          0.55200310         -0.10179020         -0.67746940
          0.19166500         -0.00014100          0.22363930          0.42539390         -1.42988400
          0.06708300          0.00006830          0.00657450          0.68770280          1.48910680
  1  1  1  9  3
        200.00000000          0.00089330         -0.00083840          0.00126180
         46.53336700          0.00736900         -0.00684910          0.01116280
         14.62180900          0.03493920         -0.03285050          0.05183160
          5.31306400          0.11529850         -0.11000600          0.19788450
          2.10252500          0.25832310         -0.31352630          0.57076520
          0.85022300          0.36962310         -0.31960110         -0.17892910
          0.33759700          0.32387890          0.22172430         -0.89820770
          0.12889200          0.14679890          0.56226160          0.26666430
          0.04511200          0.03361270          0.30132510          0.62589940
  1  2  2  4  2
          3.75000000          0.12849340         -0.21820550
          1.31250000          0.52118840         -0.48176950
          0.45937500          0.43457840          0.13575950
          0.16078100          0.14574090          0.82977340
# FLUORINE    (14s,9p,4d) -> [4s,3p,2d]
F  Roos-ADZ-ANO
  3
  1  0  0 14  4
     103109.46000000          0.00006370         -0.00001480          0.00001510         -0.00001540
      15281.00700000          0.00050280         -0.00011720          0.00011870         -0.00011600
       3441.53920000          0.00266770         -0.00062390          0.00063630         -0.00065960
        967.09483000          0.01120030         -0.00262800          0.00265990         -0.00255000
        314.03534000          0.03909800         -0.00935030          0.00960680         -0.01023610
        113.44230000          0.11226570         -0.02784900          0.02843360         -0.02676290
         44.64472700          0.24720420         -0.06768800          0.07198310         -0.08293450
         18.94287400          0.36803450         -0.12305420          0.13103930         -0.11416490
          8.53274300          0.29086170         -0.15221800          0.20316170         -0.31608660
          3.91940100          0.07810240         -0.00757940         -0.09159900          0.44872390
          1.56815700          0.00354030          0.37593130         -1.00702500          1.16053510
          0.62329000          0.00091570          0.54384820          0.01746270         -1.36957000
          0.24086100          0.00007650          0.21277460          0.74900270         -0.60414010
          0.08430100          0.00002050          0.00664220          0.34476920          1.29671020
  1  1  1  9  3
        245.33029000          0.00098800         -0.00097930          0.00140030
         56.91900500          0.00829110         -0.00834100          0.01356230
         17.60456800          0.04073900         -0.04074570          0.06060520
          6.27499500          0.13533040         -0.14552660          0.26782200
          2.44703000          0.28096370         -0.35562750          0.58183690
          0.99506000          0.35883510         -0.25371630         -0.42803960
          0.40397300          0.30381120          0.28087000         -0.79915710
          0.15481000          0.13893790          0.56520350          0.46852140
          0.05418400          0.02581860          0.23237080          0.48624410
  1  2  2  4  2
          5.00000000          0.13035590         -0.28336550
          1.75000000          0.52550550         -0.53295890
          0.61250000          0.44216400          0.33934740
          0.21437500          0.12327470          0.67721890
# NEON        (14s,9p,4d) -> [4s,3p,2d]
NE Roos-ADZ-ANO
  3
  1  0  0 14  4
     166165.08000000          0.00004720         -0.00001110          0.00001380         -0.00001340
      23107.52400000          0.00040070         -0.00009420          0.00011550         -0.00010150
       5060.15390000          0.00219320         -0.00051800          0.00064920         -0.00065470
       1384.61230000          0.00958760         -0.00226650          0.00276320         -0.00232050
        436.51258000          0.03507340         -0.00845930          0.01073360         -0.01138250
        153.47148000          0.10465170         -0.02604860          0.03183250         -0.02534250
         59.38908700          0.23771230         -0.06535970          0.08719600         -0.10583830
         24.86196700          0.36960610         -0.12226570          0.15298110         -0.09837220
         11.01570400          0.30616090         -0.15857100          0.28479790         -0.52302700
          4.96517500          0.08419850         -0.00602870         -0.19295490          1.12262340
          1.93650300          0.00370350          0.38289570         -1.32258800          0.49014010
          0.76572800          0.00096540          0.53886490          0.49012790         -1.73790500
          0.29553800          0.00005400          0.21144870          0.75461750          0.39778720
          0.10343800          0.00002680          0.00280490          0.06136710          0.89004130
  1  1  1  9  3
        234.94500000          0.00158260         -0.00221020          0.00339890
         55.07738500          0.01257670         -0.01851140          0.03630470
         17.38954900          0.05698650         -0.08152120          0.14392890
          6.38953700          0.16812300         -0.29235700          0.73364640
          2.54208200          0.30738600         -0.54030600         -0.10766930
          1.03376400          0.35831120          0.09151550         -1.21431500
          0.41878800          0.27869380          0.60908800          0.64108330
          0.16462700          0.09521110          0.24352740          0.35686170
          0.05761900          0.00210200          0.00713030          0.01895010
  1  2  2  4  2
          6.42000000          0.13708560         -0.42047260
          2.24700000          0.54471000         -0.55929570
          0.78645000          0.44972740          0.70000990
          0.27525750          0.06537090          0.33900230
# SODIUM      (17s,12p,5d) -> [5s,4p,2d]
NA Roos-ADZ-ANO
  3
  1  0  0 17  5
     138773.72000000          0.00007636         -0.00001870          0.00000255         -0.00000230          0.00000364
      20325.89900000          0.00052939         -0.00012910          0.00001760         -0.00001600          0.00002582
       5878.60490000          0.00183722         -0.00045110          0.00006160         -0.00005530          0.00008615
       2015.43730000          0.00653431         -0.00159820          0.00021769         -0.00019860          0.00032753
        739.62658000          0.02092231         -0.00521350          0.00071184         -0.00063400          0.00100249
        280.82116000          0.06426610         -0.01627270          0.00221369         -0.00199710          0.00347727
        108.71501000          0.17089923         -0.04645830          0.00632867         -0.00546590          0.00977528
         42.60157200          0.35610342         -0.11144450          0.01509121         -0.01276240          0.02880208
         16.82981700          0.40213461         -0.18537340          0.02530901         -0.01876960          0.05266945
          6.68644860          0.12746393         -0.06005440          0.00808949         -0.00747550          0.02852077
          2.66748770          0.00061064          0.35924086         -0.05305070          0.03897469         -0.18124290
          1.06746210          0.00338457          0.57207971         -0.11164110          0.08327536         -0.14683560
          0.42818910         -0.00132870          0.22321420         -0.13831340          0.20560497         -0.33984270
          0.17208010          0.00085748         -0.00502860         -0.02990100         -0.04683150          0.65955083
          0.06925880         -0.00047610          0.00595957          0.44900485         -0.79823140          1.85913770
          0.02790920          0.00022186         -0.00253770          0.47484493         -0.57595290         -3.55761200
          0.01116330         -0.00006380          0.00078635          0.22905052          1.44086540          1.88655310
  1  1  1 12  4
        383.79172000          0.00102867         -0.00011860          0.00015162         -0.00018580
         94.39807200          0.00743093         -0.00086340          0.00110681         -0.00115460
         32.36150700          0.03273646         -0.00379970          0.00487773         -0.00606080
         12.05435200          0.11687036         -0.01384260          0.01792042         -0.01828510
          4.64171860          0.27753763         -0.03315040          0.04350073         -0.05598100
          1.81728760          0.39800015         -0.04899740          0.06554272         -0.05672000
          0.71827120          0.32331086         -0.04658270          0.07245938         -0.15067210
          0.28558030          0.09433492         -0.03024570          0.09073829         -0.00335500
          0.11399470          0.00109373          0.22294313         -0.76763740          1.54882680
          0.04562920          0.00178158          0.50923252         -0.39771490         -1.89946400
          0.01830100         -0.00069800          0.37196823          0.92303779          0.39892154
          0.00732040          0.00022539          0.04475107          0.17065606          0.64929030
  1  2  2  5  2
          0.86260360          0.02177426         -0.01348600
          0.34514180         -0.00721860         -0.00299870
          0.13809690          0.33517471         -0.46667530
          0.05525480          0.36379749         -0.62374900
          0.02210190          0.49254995          1.10909490
# MAGNESIUM   (17s,12p,5d) -> [5s,4p,2d]
MG Roos-ADZ-ANO
  3
  1  0  0 17  5
     169973.87000000          0.00007417         -0.00001880          0.00000379         -0.00000440          0.00000684
      24699.06600000          0.00051736         -0.00013060          0.00002638         -0.00003080          0.00004631
       7175.48510000          0.00177276         -0.00045010          0.00009109         -0.00010460          0.00016849
       2478.79200000          0.00623864         -0.00157940          0.00031906         -0.00037490          0.00054725
        917.73259000          0.01976587         -0.00509070          0.00103163         -0.00118030          0.00193137
        351.75140000          0.06017463         -0.01575210          0.00318903         -0.00375480          0.00545737
        137.51557000          0.16016295         -0.04484030          0.00913931         -0.01046200          0.01729461
         54.43028600          0.33917581         -0.10853870          0.02227591         -0.02638960          0.03812473
         21.72256900          0.40883352         -0.18759800          0.03965557         -0.04506790          0.07914147
          8.71944840          0.15183413         -0.08683860          0.01868253         -0.02557030          0.01594961
          3.51471660          0.00195927          0.33464216         -0.08001640          0.10765675         -0.13968240
          1.42121320          0.00418518          0.59813818         -0.18827570          0.21164824         -0.53435960
          0.57607650         -0.00187660          0.23180428         -0.21162620          0.43129749         -0.28133200
          0.23395250          0.00120338         -0.00693860          0.14066560         -0.96823710          3.08684680
          0.09515600         -0.00067450          0.00680179          0.68477064         -0.97343960         -3.53760100
          0.03875100          0.00031460         -0.00280300          0.34545022          1.46805860          1.02585020
          0.01550040         -0.00008880          0.00083003          0.00874972          0.09800990          0.56587909
  1  1  1 12  4
        557.13078000          0.00079833         -0.00016120          0.00013230         -0.00021600
        135.48388000          0.00589231         -0.00119310          0.00094881         -0.00048420
         47.21295800          0.02583591         -0.00524640          0.00431193         -0.00750940
         18.00095500          0.09406296         -0.01931180          0.01513244         -0.00373040
          7.11466070          0.24134480         -0.05049450          0.04187188         -0.07988840
          2.86302400          0.38746464         -0.08296280          0.06595574          0.01126479
          1.16401850          0.35595067         -0.08827490          0.09294055         -0.56057880
          0.47630470          0.12288168         -0.03970790          0.05017503          0.66659154
          0.19573560          0.00380787          0.42165449         -0.75622220          1.23752910
          0.08067830          0.00230283          0.58978450         -0.18127870         -2.36745000
          0.03332660         -0.00085890          0.10380275          1.03897020          1.29736030
          0.01333060          0.00027579          0.00502440          0.09524704          0.07151495
  1  2  2  5  2
          1.04456440          0.01605667         -0.04289690
          0.48574730          0.02264646          0.18907793
          0.22588410          0.46449386          0.77129122
          0.10504150          0.47219231         -0.32119970
          0.04201660          0.16336646         -0.76069020
# ALUMINUM    (17s,12p,5d) -> [5s,4p,2d]
AL Roos-ADZ-ANO
  3
  1  0  0 17  5
     208459.49000000          0.00007078         -0.00001840          0.00000432         -0.00000430          0.00000648
      29971.59800000          0.00049759         -0.00012920          0.00003029         -0.00003050          0.00004502
       8764.45650000          0.00167444         -0.00043710          0.00010265         -0.00010220          0.00015532
       3060.70730000          0.00580246         -0.00151200          0.00035421         -0.00035890          0.00052217
       1147.49630000          0.01811648         -0.00479430          0.00112743         -0.00111920          0.00171468
        445.75595000          0.05440537         -0.01462910          0.00343446         -0.00348670          0.00506469
        176.70642000          0.14492054         -0.04143990          0.00980341         -0.00974050          0.01501684
         70.94362000          0.31321200         -0.10118870          0.02408671         -0.02459030          0.03577722
         28.72400000          0.41334250         -0.18447700          0.04527494         -0.04498180          0.07132737
         11.69892300          0.19059653         -0.12273700          0.03095121         -0.03404100          0.04282415
          4.78536970          0.00707487          0.27348316         -0.07575180          0.08910950         -0.13355890
          1.96375180          0.00484032          0.61530733         -0.22480450          0.22809994         -0.44484980
          0.80785940         -0.00233010          0.28146024         -0.25485420          0.38525013         -0.52149340
          0.33299060          0.00153518         -0.00503600          0.20149503         -0.80088860          2.94805910
          0.13746930         -0.00086880          0.00796206          0.68310534         -0.99962600         -2.57699600
          0.05682380          0.00040223         -0.00353640          0.30782923          1.19801100         -0.19367300
          0.02272950         -0.00011120          0.00100247          0.02408008          0.36451428          1.10610360
  1  1  1 12  4
        677.76458000          0.00079717         -0.00013730          0.00015515         -0.00016860
        164.83442000          0.00589941         -0.00101230          0.00113147         -0.00108570
         57.68342400          0.02586307         -0.00449520          0.00508163         -0.00558830
         22.10867400          0.09471373         -0.01657140          0.01841598         -0.01713210
          8.78775140          0.24484796         -0.04414490          0.05014804         -0.05622460
          3.55708740          0.39837993         -0.07248030          0.08138367         -0.07224890
          1.45487800          0.35294610         -0.07465500          0.09799899         -0.16960580
          0.59893630          0.10280005          0.01880214         -0.01844020          0.10547020
          0.24763730          0.00234580          0.27739515         -0.62774810          1.09587210
          0.10269950          0.00175805          0.44207475         -0.24598520         -0.80230420
          0.04268530         -0.00053410          0.29055057          0.35129892         -0.92384590
          0.01707410          0.00019528          0.16625332          0.65543563          1.16081480
  1  2  2  5  2
          1.26731440          0.01856849         -0.00676530
          0.50951300          0.11745821          0.20578256
          0.20484530          0.50149748          0.54053298
          0.08235630          0.37968233         -0.08920980
          0.03294250          0.20021391         -0.87110670
# SILICON     (17s,12p,5d) -> [5s,4p,2d]
SI Roos-ADZ-ANO
  3
  1  0  0 17  5
     250095.97000000          0.00006815         -0.00001820          0.00000470         -0.00000490          0.00000688
      35803.20000000          0.00048017         -0.00012780          0.00003305         -0.00003480          0.00004735
      10522.48300000          0.00159626         -0.00042650          0.00011064         -0.00011490          0.00016522
       3701.77450000          0.00547507         -0.00146180          0.00037778         -0.00040070          0.00053088
       1399.39330000          0.01693706         -0.00458450          0.00119120         -0.00123290          0.00179852
        548.38895000          0.05041784         -0.01387010          0.00359228         -0.00382010          0.00503523
        219.36269000          0.13450267         -0.03917820          0.01024273         -0.01061380          0.01559960
         88.88225900          0.29476401         -0.09635060          0.02530364         -0.02708780          0.03568620
         36.32337700          0.41279726         -0.18176200          0.04932521         -0.05122020          0.07863781
         14.93346300          0.21885760         -0.14523390          0.04049616         -0.04663010          0.04948931
          6.16634850          0.01352631          0.22989807         -0.06985640          0.09190140         -0.11137450
          2.55455650          0.00478761          0.62379847         -0.25411200          0.26901327         -0.55229290
          1.06095070         -0.00235090          0.31543582         -0.28611330          0.46077703         -0.38840900
          0.44150240          0.00157700         -0.00276260          0.24639415         -1.05620100          2.95347820
          0.18401680         -0.00091180          0.00903722          0.68019181         -0.78471120         -2.85560200
          0.07679620          0.00041644         -0.00390620          0.28966706          1.20426300          0.09215286
          0.03071850         -0.00011400          0.00111144          0.02414823          0.29679859          1.03482600
  1  1  1 12  4
        843.53382000          0.00074369         -0.00015740          0.00016602         -0.00019250
        204.90726000          0.00552015         -0.00116560          0.00119789         -0.00115190
         72.24878700          0.02411287         -0.00515290          0.00545750         -0.00647660
         27.96136500          0.08883573         -0.01917230          0.01962832         -0.01827540
         11.23228200          0.23494251         -0.05231320          0.05586579         -0.06800600
          4.59693730          0.39732250         -0.09000870          0.09197956         -0.07758320
          1.90148330          0.36181185         -0.09250120          0.11503921         -0.21432990
          0.79178280          0.10524773          0.03870909         -0.06483660          0.25572048
          0.33116620          0.00256555          0.34152769         -0.68318220          1.07773340
          0.13894230          0.00177329          0.46110561         -0.16360950         -1.24468400
          0.05842570         -0.00045410          0.25855921          0.61750164         -0.38355030
          0.02337030          0.00017881          0.07566560          0.44097775          1.02251980
  1  2  2  5  2
          2.01053330          0.02221051         -0.00195270
          0.79109810          0.10356980          0.15356092
          0.31127870          0.50813164          0.48959332
          0.12248090          0.35117535          0.11387560
          0.04899240          0.25071127         -0.98489900
# PHOSPHORUS  (17s,12p,5d) -> [5s,4p,2d]
P  Roos-ADZ-ANO
  3
  1  0  0 17  5
     296647.55000000          0.00006562         -0.00001780          0.00000495         -0.00000380          0.00000594
      42380.03000000          0.00046254         -0.00012560          0.00003483         -0.00002680          0.00004144
      12503.85600000          0.00152412         -0.00041530          0.00011560         -0.00008660          0.00013959
       4422.49370000          0.00518926         -0.00141400          0.00039175         -0.00030500          0.00046280
       1681.84780000          0.01595159         -0.00440030          0.00122727         -0.00091310          0.00148861
        663.21490000          0.04720087         -0.01323730          0.00367506         -0.00287280          0.00434089
        267.00585000          0.12619981         -0.03733840          0.01047976         -0.00779880          0.01277688
        108.89592000          0.27982529         -0.09244400          0.02602575         -0.02049300          0.03096216
         44.79731400          0.41030382         -0.17908160          0.05218594         -0.03865600          0.06543104
         18.54031200          0.24188220         -0.16174870          0.04842224         -0.04197400          0.05707014
          7.70709950          0.02071709          0.19399810         -0.06270700          0.06559604         -0.09386140
          3.21437500          0.00443622          0.62785121         -0.27648210          0.19549449         -0.41005510
          1.34401270         -0.00216870          0.34320722         -0.31132840          0.38636227         -0.48607910
          0.56308700          0.00148760         -0.00010200          0.27584791         -0.75348860          1.95041420
          0.23628700         -0.00087720          0.00993085          0.67745539         -0.54814350         -0.29309150
          0.09928110          0.00039698         -0.00418080          0.28560830          0.26985002         -2.30754900
          0.03971240         -0.00010790          0.00119275          0.01675006          0.97010724          1.77847660
  1  1  1 12  4
       1018.41220000          0.00071159         -0.00016880          0.00015264         -0.00022110
        247.39820000          0.00528387         -0.00125010          0.00110387         -0.00137890
         87.79048200          0.02297828         -0.00550960          0.00500340         -0.00741670
         34.24860000          0.08494327         -0.02057220          0.01814153         -0.02236340
         13.87701400          0.22803285         -0.05717830          0.05241729         -0.07944690
          5.73030980          0.39658377         -0.10153640          0.08911554         -0.10183150
          2.39200680          0.36766734         -0.10487000          0.10677427         -0.22045860
          1.00527670          0.10640781          0.05753445         -0.07211440          0.35066535
          0.42439290          0.00281028          0.37524649         -0.60909640          0.97783112
          0.17973060          0.00165268          0.45668244         -0.16157330         -1.12189900
          0.07629100         -0.00040110          0.22572156          0.54191860         -0.50591410
          0.03051640          0.00016315          0.06188888          0.53980064          1.02634120
  1  2  2  5  2
          2.72018530          0.02567866         -0.01281640
          1.07222220          0.12037513          0.17873934
          0.42264050          0.55955359          0.50423470
          0.16659330          0.37100935         -0.11770020
          0.06663730          0.12126366         -0.88859820
# SULFUR      (17s,12p,5d) -> [5s,4p,2d]
S  Roos-ADZ-ANO
  3
  1  0  0 17  5
     346348.23000000          0.00006370         -0.00001760          0.00000516         -0.00000380          0.00000585
      49391.14600000          0.00044935         -0.00012410          0.00003629         -0.00002730          0.00004096
      14610.99000000          0.00147142         -0.00040760          0.00011970         -0.00008760          0.00013668
       5187.20950000          0.00498429         -0.00138200          0.00040336         -0.00030730          0.00045296
       1980.96760000          0.01525241         -0.00427630          0.00125841         -0.00091510          0.00144216
        784.63139000          0.04494424         -0.01281620          0.00374805         -0.00286710          0.00420970
        317.32779000          0.12035338         -0.03610970          0.01069509         -0.00777990          0.01231522
        130.01976000          0.26908335         -0.08987260          0.02665475         -0.02053900          0.03016574
         53.73820800          0.40722490         -0.17728880          0.05454724         -0.03956760          0.06449660
         22.34589600          0.25831856         -0.17312010          0.05462756         -0.04600480          0.06268013
          9.33325120          0.02714669          0.16887115         -0.05692420          0.06098330         -0.08761680
          3.91118680          0.00400872          0.63115534         -0.29658550          0.20575809         -0.39434690
          1.64320660         -0.00192710          0.36103178         -0.32932730          0.40570893         -0.55180690
          0.69174560          0.00134644          0.00184135          0.30470795         -0.81899290          1.99993610
          0.29167360         -0.00081150          0.01069710          0.67383630         -0.44471340         -0.27829840
          0.12314410          0.00036382         -0.00432300          0.27748421          0.18735812         -2.35282500
          0.04925760         -0.00009870          0.00124248          0.01304772          1.00722580          1.79232710
  1  1  1 12  4
       1129.12690000          0.00077145         -0.00019700          0.00018333         -0.00028000
        274.03515000          0.00572945         -0.00146240          0.00130515         -0.00172590
         97.40258400          0.02477182         -0.00640040          0.00600239         -0.00940080
         38.08551800          0.09109122         -0.02387630          0.02129088         -0.02797840
         15.47103300          0.24064577         -0.06532010          0.06221627         -0.10067960
          6.40565900          0.40976882         -0.11476930          0.09978781         -0.11767160
          2.68128280          0.35226804         -0.10657020          0.11944864         -0.25665430
          1.13000500          0.08382797          0.11048130         -0.15959890          0.68243796
          0.47839950          0.00271787          0.41795827         -0.67011450          0.66515564
          0.20318050          0.00078655          0.42517813          0.01331064         -1.44513800
          0.08649230          0.00011535          0.19228231          0.64871747          0.12745221
          0.03459690          0.00003404          0.04207771          0.37095119          0.77294449
  1  2  2  5  2
          3.00536790          0.03293922         -0.03191870
          1.21729760          0.16386221          0.29392107
          0.49305560          0.58677406          0.46210890
          0.19970780          0.31916052         -0.32360540
          0.07988310          0.08508563         -0.75561170
# CHLORINE    (17s,12p,5d) -> [5s,4p,2d]
CL Roos-ADZ-ANO
  3
  1  0  0 17  5
     399432.47000000          0.00006215         -0.00001740          0.00000531         -0.00000470          0.00000595
      56908.83300000          0.00043838         -0.00012290          0.00003739         -0.00003370          0.00004122
      16874.76900000          0.00142781         -0.00040130          0.00012271         -0.00010830          0.00013955
       6010.02780000          0.00481620         -0.00135560          0.00041159         -0.00037410          0.00044686
       2303.28300000          0.01468157         -0.00417440          0.00127960         -0.00112330          0.00146844
        915.65994000          0.04311398         -0.01247260          0.00379416         -0.00346090          0.00411004
        371.72009000          0.11558388         -0.03510470          0.01083171         -0.00951860          0.01251189
        152.89109000          0.26016348         -0.08775020          0.02707379         -0.02486630          0.02954625
         63.43630300          0.40382380         -0.17564250          0.05631797         -0.04964540          0.06763368
         26.48172300          0.27179877         -0.18206990          0.05980454         -0.05901320          0.06396442
         11.10411200          0.03338125          0.14753370         -0.05113350          0.06729192         -0.07622940
          4.67162890          0.00356211          0.63295111         -0.31267210          0.26850578         -0.44555880
          1.97045200         -0.00165600          0.37614178         -0.34374380          0.51536265         -0.53191500
          0.83279460          0.00117962          0.00380802          0.32577967         -1.11610500          2.38922930
          0.35254090         -0.00073110          0.01133746          0.66892575         -0.52914520         -1.29926400
          0.14943410          0.00032425         -0.00444450          0.27170146          0.76655700         -1.50478700
          0.05977360         -0.00008790          0.00129047          0.01386816          0.59696595          1.65737770
  1  1  1 12  4
       1288.97160000          0.00078181         -0.00021070          0.00020575         -0.00031720
        312.24430000          0.00581729         -0.00157040          0.00146090         -0.00194620
        111.34634000          0.02503057         -0.00683040          0.00673436         -0.01067180
         43.73608700          0.09188004         -0.02552010          0.02376316         -0.03157490
         17.85652400          0.24258072         -0.06974890          0.07010553         -0.11574860
          7.43276590          0.41394424         -0.12387560          0.11161894         -0.12908650
          3.12825380          0.34789086         -0.10851620          0.12978530         -0.27649330
          1.32572140          0.07717314          0.13894281         -0.23354130          0.89183689
          0.56441910          0.00312835          0.42954359         -0.67189630          0.41342424
          0.24107410          0.00050049          0.40829131          0.10952051         -1.53837700
          0.10320890          0.00034786          0.18156256          0.66424757          0.46781029
          0.04128360         -0.00002380          0.03396053          0.30179468          0.59904463
  1  2  2  5  2
          3.62045610          0.03682298         -0.04843800
          1.47757170          0.17638808          0.39297464
          0.60302300          0.59139283          0.47951806
          0.24610430          0.30996037         -0.56212450
          0.09844170          0.06672018         -0.56257760
# ARGON       (17s,12p,5d) -> [5s,4p,2d]
AR Roos-ADZ-ANO
  3
  1  0  0 17  5
     455476.77000000          0.00006096         -0.00001730          0.00000544         -0.00000530          0.00000579
      64817.74300000          0.00043020         -0.00012220          0.00003829         -0.00003750          0.00003978
      19256.98700000          0.00139466         -0.00039690          0.00012513         -0.00012020          0.00013641
       6877.00730000          0.00468779         -0.00133670          0.00041795         -0.00041340          0.00042380
       2643.48770000          0.01424066         -0.00409860          0.00129572         -0.00123820          0.00143205
       1054.23750000          0.04169365         -0.01221340          0.00382578         -0.00379760          0.00386068
        429.37122000          0.11183053         -0.03433220          0.01092652         -0.01045540          0.01216691
        177.18859000          0.25298878         -0.08610070          0.02735689         -0.02735260          0.02778303
         73.76394500          0.40044790         -0.17427680          0.05765806         -0.05546770          0.06724781
         30.89700700          0.28245090         -0.18902660          0.06394978         -0.06865230          0.06200867
         12.99948200          0.03906305          0.13009718         -0.04572820          0.07055596         -0.06041520
          5.48767930          0.00314565          0.63399171         -0.32577250          0.30115546         -0.46387010
          2.32257160         -0.00139160          0.38815020         -0.35331040          0.61789886         -0.49311320
          0.98498070          0.00101034          0.00573222          0.33817566         -1.43377400          2.41394970
          0.41839730         -0.00064850          0.01193554          0.66223091         -0.27094710         -1.53597500
          0.17795940          0.00028402         -0.00449410          0.27636906          0.77596409         -1.27729400
          0.07118380         -0.00007710          0.00131952          0.00949692          0.50334371          1.63788950
  1  1  1 12  4
       1462.49620000          0.00078756         -0.00022120          0.00029752         -0.00045430
        354.06731000          0.00586048         -0.00165140          0.00201545         -0.00318150
        126.69779000          0.02510137         -0.00713990          0.00979652         -0.01511580
         49.98909500          0.09200774         -0.02671710          0.03265686         -0.05279920
         20.50929500          0.24317197         -0.07307220          0.10366041         -0.17027200
          8.58046410          0.41674542         -0.13132950          0.14799999         -0.23127500
          3.63010490          0.34542045         -0.10964210          0.20744830         -0.20352810
          1.54652800          0.07305360          0.16048636         -0.50796850          1.74529250
          0.66193690          0.00294397          0.43595556         -0.80424020         -1.39630300
          0.28424280         -0.00023940          0.40458441          0.69669502         -0.47271850
          0.12234630          0.00028995          0.17125106          0.46331690          0.89125570
          0.04893850         -0.00009340          0.01351308          0.04908714          0.06889766
  1  2  2  5  2
          4.32884170          0.04003444         -0.05753400
          1.77423020          0.18334334          0.42320227
          0.72719060          0.59072873          0.45075094
          0.29804820          0.30437283         -0.56963190
          0.11921930          0.06258812         -0.55102580
# POTASSIUM   (17s,12p,4d) -> [6s,5p,3d]
K  Roos-ADZ-ANO
  3
  1  0  0 17  6
     491258.49000000          0.00005842         -0.00002070          0.00000435         -0.00000100          0.00000164         -0.00000890
      73596.26000000          0.00045381         -0.00016070          0.00003401         -0.00000770          0.00001315         -0.00006650
      16749.08500000          0.00237837         -0.00084290          0.00017722         -0.00003950          0.00006615         -0.00036960
       4743.06460000          0.00992078         -0.00353600          0.00075221         -0.00017110          0.00029351         -0.00141650
       1546.57230000          0.03480238         -0.01257040          0.00265519         -0.00058790          0.00097189         -0.00546100
        557.61034000          0.10256352         -0.03848430          0.00837390         -0.00191410          0.00326796         -0.01358480
        216.63552000          0.23961148         -0.09801500          0.02156418         -0.00470680          0.00742939         -0.03639130
         88.97660300          0.38126993         -0.19258520          0.04665380         -0.01073760          0.01770685         -0.03011530
         37.70667000          0.29621852         -0.21748580          0.05565267         -0.01128390          0.01480930         -0.05474160
         14.62274900          0.06375196          0.09256514         -0.02479790          0.00231784          0.00460019          0.06700469
          6.74696650          0.02601417          0.58909472         -0.27722080          0.06582098         -0.11983180         -0.03527940
          3.03462520          0.02795313          0.47571709         -0.33246770          0.05481428         -0.07493820          1.20112230
          0.90298592          0.00130668          0.00807837          0.50767943         -0.07425960          0.09938682         -3.35082100
          0.37318822         -0.00014920         -0.05118210          0.70161851         -0.32299760          0.64446308          2.79270070
          0.06155351          0.00000326         -0.00174370          0.07043030          0.09186196         -1.96324000         -0.43064540
          0.02553669         -0.00000220          0.00060097         -0.05969240          0.93438734          0.95293980         -0.64231060
          0.01021330          0.00000000         -0.00015040          0.00948955          0.06211051          0.61563072          0.70496631
  1  1  1 12  5
       1189.74050000          0.00141380         -0.00033300          0.00006492         -0.00010300          0.00026569
        287.10831000          0.01038087         -0.00249260          0.00048585         -0.00074110          0.00250941
        100.91081000          0.04474237         -0.01076840          0.00209050         -0.00332710          0.00833263
         38.96316500          0.15406934         -0.03906560          0.00755029         -0.01139040          0.04065920
         15.62070400          0.35465661         -0.09285550          0.01777551         -0.02828850          0.06909479
          6.38134000          0.45431722         -0.13401620          0.02546473         -0.03628700          0.17159295
          2.63505000          0.19116706          0.03118623         -0.00496590         -0.00208330         -0.19831070
          1.09542300         -0.01862470          0.40666025         -0.06854900          0.12037081         -0.03116310
          0.45742400         -0.02790530          0.49596210         -0.09481970          0.10952669         -1.38969700
          0.19160900         -0.01460530          0.20243950         -0.07258240          0.41463187          2.67276250
          0.06706320          0.00018929          0.00793367          0.20338465         -1.81305400         -1.75862800
          0.02347210         -0.00028140          0.00119087          0.87327808          1.27013160          0.61694169
  1  2  2  4  3
          0.09333000          0.50545552         -1.13396900          0.97707492
          0.03733200          0.57601816          0.89460794         -1.96236900
          0.01493280          0.02038626          0.42432475          1.88487010
          0.00597300         -0.04888480         -0.14892240         -0.35784830
# CALCIUM     (17s,12p,4d) -> [6s,5p,3d]
CA Roos-ADZ-ANO
  3
  1  0  0 17  6
     542844.56000000          0.00005841         -0.00002110          0.00000685         -0.00000150          0.00000168         -0.00000400
      81324.55700000          0.00045377         -0.00016370          0.00005340         -0.00001170          0.00001293         -0.00002760
      18507.90600000          0.00237823         -0.00085890          0.00027903         -0.00006070          0.00006896         -0.00017260
       5241.13940000          0.00991905         -0.00360190          0.00117888         -0.00025900          0.00028359         -0.00057020
       1708.98930000          0.03479574         -0.01279950          0.00417698         -0.00090720          0.00104107         -0.00274630
        616.18926000          0.10249859         -0.03912940          0.01303884         -0.00288050          0.00311564         -0.00573740
        239.42854000          0.23924588         -0.09936550          0.03357530         -0.00729850          0.00852796         -0.02446030
         98.37458100          0.37922037         -0.19366870          0.07046608         -0.01588600          0.01668291         -0.02371310
         41.71418300          0.29253681         -0.21515880          0.08285525         -0.01799130          0.02303530         -0.09147860
         16.09407900          0.06468846          0.09713469         -0.04133500          0.00742164         -0.01742770          0.16250618
          7.46704860          0.03281779          0.56572226         -0.36805990          0.09616220         -0.08758100         -0.07273020
          3.37858760          0.03199147          0.41996510         -0.38857710          0.09549962         -0.14611870          0.81888116
          1.02991330          0.00254060          0.06391161          0.59698724         -0.18281930          0.32722133         -2.33849000
          0.42260000          0.00098313          0.02369149          0.64234271         -0.41255990          0.36853705          1.93435540
          0.06783130          0.00005600          0.00332540          0.03054920          0.70539294         -2.34379300          0.21528538
          0.02752130         -0.00003000         -0.00222660         -0.01615820          0.47715882          2.24315820         -1.86334000
          0.01100704          0.00000915          0.00073373          0.00502950         -0.01706170         -0.13030730          1.66682650
  1  1  1 12  5
       1402.42710000          0.00127432         -0.00042400          0.00010198         -0.00010830          0.00018813
        338.55939000          0.00936449         -0.00316090          0.00076323         -0.00088700          0.00197915
        119.98925000          0.04001879         -0.01354030          0.00326097         -0.00340270          0.00557656
         46.80993600          0.13890894         -0.04894240          0.01187257         -0.01389780          0.03155397
         18.97619100          0.32858814         -0.11907730          0.02887702         -0.02952650          0.04521323
          7.84183500          0.44618186         -0.17759170          0.04384101         -0.05603990          0.15212192
          3.27635300          0.21822676         -0.00699460         -0.00200520          0.02197499         -0.16059250
          1.37829300          0.01508472          0.41010521         -0.11533190          0.07370106          0.11878904
          0.58247500          0.00741586          0.51830550         -0.17248950          0.35745642         -1.61591100
          0.24694600         -0.00045020          0.18538460         -0.08907560         -0.13208330          2.90021550
          0.08643110          0.00070335          0.00656569          0.69200083         -1.30992600         -2.12745700
          0.03025090         -0.00020640          0.00061610          0.45318416          1.35118460          0.86987929
  1  2  2  4  3
          0.39250000          0.09888404         -0.06448030          1.02905310
          0.15700000          0.35400289         -1.15845300         -0.56109360
          0.06280000          0.60583332          0.93993886         -0.65246380
          0.02512000          0.09979140          0.24451693          0.91827402
# SCANDIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
SC Roos-ADZ-ANO
  4
  1  0  0 21  6
    2715278.00000000          0.00000900         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     406598.40000000          0.00007030         -0.00002060          0.00000730         -0.00000180          0.00000260         -0.00000380
      92530.04000000          0.00036940         -0.00010830          0.00003810         -0.00000940          0.00001340         -0.00001890
      26207.92000000          0.00155730         -0.00045720          0.00016110         -0.00003970          0.00005780         -0.00008580
       8549.42900000          0.00563820         -0.00166130          0.00058530         -0.00014420          0.00020370         -0.00028470
       3085.97500000          0.01806450         -0.00537480          0.00189710         -0.00046690          0.00068540         -0.00103110
       1203.17200000          0.05144550         -0.01567320          0.00554030         -0.00136660          0.00191410         -0.00262930
        498.48690000          0.12707080         -0.04083870          0.01453930         -0.00358060          0.00531270         -0.00814650
        216.73600000          0.25490550         -0.09186680          0.03306540         -0.00818040          0.01128470         -0.01500180
         97.87476000          0.36017450         -0.16483380          0.06115120         -0.01512000          0.02309850         -0.03719520
         45.20433000          0.26994140         -0.18091270          0.07020760         -0.01759940          0.02223440         -0.02357950
         20.21187000          0.06163750          0.05165400         -0.02111350          0.00550800          0.00012430         -0.02279820
          9.57475100         -0.00137010          0.50475000         -0.27065280          0.07005320         -0.12218900          0.23648630
          4.54034600          0.00205340          0.50458120         -0.44054920          0.12312720         -0.14779690          0.13085050
          1.99568700         -0.00095410          0.09393700          0.06285390         -0.02804590         -0.03470180          0.23841110
          0.94221500          0.00043550         -0.00297080          0.71691260         -0.24417280          0.64622190         -1.77116600
          0.41784500         -0.00018700          0.00248250          0.44287950         -0.32519970          0.15556920          1.29776820
          0.09576100          0.00009670         -0.00080170          0.02330730          0.35832950         -2.27616700          3.27082980
          0.05135100         -0.00009370          0.00076540         -0.01372210          0.60752200          1.15412310         -6.65044700
          0.02387800          0.00004130         -0.00033710          0.00463010          0.20971750          0.73089930          4.26392470
          0.00955100         -0.00000960          0.00007800         -0.00096690          0.00735930          0.10275990         -0.71246510
  1  1  1 15  5
       4609.88500000          0.00019180         -0.00006450          0.00001890         -0.00002410          0.00003140
       1092.15600000          0.00168010         -0.00056470          0.00016800         -0.00021600          0.00028190
        354.33680000          0.00927530         -0.00314160          0.00092260         -0.00117490          0.00153070
        134.80760000          0.03752900         -0.01284830          0.00383000         -0.00492860          0.00643370
         56.60258000          0.11490240         -0.04053780          0.01193470         -0.01520350          0.01981900
         25.33410000          0.25439250         -0.09287680          0.02796510         -0.03616710          0.04726480
         11.74033000          0.37991660         -0.14765040          0.04354370         -0.05550180          0.07284370
          5.56925900          0.30955560         -0.11280680          0.03528510         -0.04666140          0.06440110
          2.59495800          0.08713980          0.15761620         -0.06168620          0.08722140         -0.11917420
          1.19635100          0.00256100          0.47136960         -0.15801900          0.22269450         -0.38254400
          0.53505900          0.00122680          0.43009950         -0.22299720          0.36197370         -0.39389800
          0.22077600         -0.00047590          0.10180830          0.15843480         -0.88835790          2.19800400
          0.08831000          0.00022640         -0.00184220          0.70244750         -0.40959980         -2.39692000
          0.03532400         -0.00011100          0.00290250          0.28120420          0.91905930          0.89636100
          0.01413000          0.00003470         -0.00078270          0.01348200          0.21314870          0.35148690
  1  2  2 10  4
        110.21970000          0.00082590         -0.00072360          0.00088820         -0.00079750
         32.80041000          0.00668110         -0.00582090          0.00727290         -0.00574830
         12.31300000          0.02815940         -0.02479120          0.03053470         -0.02734940
          5.06381900          0.08372590         -0.07372960          0.09263050         -0.07108940
          2.22554700          0.17840110         -0.15786200          0.19890520         -0.19284550
          0.99234300          0.26729480         -0.22085100          0.26567710         -0.17873910
          0.43636100          0.30373220         -0.20962350          0.09014130         -0.03909720
          0.18570500          0.29501850          0.05386540         -0.65848460          1.37404170
          0.07344100          0.19903620          0.43826460         -0.39701430         -1.98588300
          0.02937600          0.09880500          0.51004480          0.89538510          1.16147000
  1  3  3  6  2
          2.84150000          0.03457760         -0.09573200
          1.12630000          0.09785270         -0.21698380
          0.44640000          0.34953560         -0.57644500
          0.17690000          0.54494830          0.14682810
          0.07010000          0.23054040          0.57506500
          0.02780000          0.03096220          0.20992140
# TITANIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
TI Roos-ADZ-ANO
  4
  1  0  0 21  6
    3014643.00000000          0.00000890         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     451432.90000000          0.00006930         -0.00002050          0.00000730         -0.00000180          0.00000260         -0.00000530
     102733.80000000          0.00036440         -0.00010770          0.00003850         -0.00000950          0.00001350         -0.00002630
      29098.17000000          0.00153640         -0.00045480          0.00016260         -0.00004010          0.00005870         -0.00012000
       9492.33000000          0.00556280         -0.00165290          0.00059090         -0.00014580          0.00020570         -0.00039620
       3426.34600000          0.01782860         -0.00534850          0.00191600         -0.00047270          0.00069770         -0.00144350
       1335.89600000          0.05081180         -0.01560890          0.00559920         -0.00138220          0.00193150         -0.00365790
        553.50260000          0.12571800         -0.04072220          0.01471710         -0.00363470          0.00543140         -0.01144970
        240.69250000          0.25299350         -0.09187640          0.03356770         -0.00830710          0.01140250         -0.02093470
        108.72930000          0.35959430         -0.16550280          0.06237530         -0.01548490          0.02391930         -0.05291360
         50.26457000          0.27246950         -0.18360090          0.07240540         -0.01810670          0.02240970         -0.03314180
         22.58004000          0.06359560          0.04772320         -0.01969540          0.00495790          0.00244170         -0.03572990
         10.71432000         -0.00122450          0.50578510         -0.27814850          0.07274550         -0.12994700          0.34737590
          5.09354600          0.00201170          0.50661980         -0.44779230          0.12462260         -0.14412390          0.19621750
          2.24418300         -0.00093570          0.09464750          0.07571830         -0.03012510         -0.04266210          0.21600550
          1.05957000          0.00042050         -0.00280280          0.72182450         -0.25472070          0.68771070         -2.54289500
          0.46884900         -0.00017760          0.00244130          0.43305370         -0.31128130          0.08970370          2.53447060
          0.10614300          0.00008640         -0.00072980          0.02190390          0.39641780         -2.20071600          0.65481180
          0.05526200         -0.00008290          0.00069790         -0.01256510          0.58239440          1.16817660         -3.07838800
          0.02546500          0.00003760         -0.00031470          0.00450140          0.19898060          0.68247570          2.18525880
          0.01018600         -0.00000900          0.00007490         -0.00096630          0.00465100          0.09670200         -0.12137220
  1  1  1 15  5
       5181.15700000          0.00018720         -0.00006430          0.00001780         -0.00002460          0.00003720
       1227.46100000          0.00164140         -0.00056350          0.00015780         -0.00021600          0.00030350
        398.27120000          0.00908300         -0.00314250          0.00086990         -0.00120360          0.00181820
        151.58670000          0.03689510         -0.01290430          0.00362100         -0.00495220          0.00694320
         63.69633000          0.11355990         -0.04095070          0.01136290         -0.01573360          0.02391530
         28.54733000          0.25317900         -0.09460300          0.02679910         -0.03658610          0.05029720
         13.26129000          0.38016760         -0.15139560          0.04214160         -0.05944900          0.09593970
          6.31035200          0.31020000         -0.11414090          0.03368180         -0.04678460          0.05786020
          2.95187500          0.08777410          0.16320570         -0.05898500          0.07944800         -0.08846610
          1.36537000          0.00294910          0.47321730         -0.15122720          0.27628380         -0.65664460
          0.61141500          0.00131940          0.42451320         -0.20347950          0.27142190          0.11031280
          0.25254800         -0.00042150          0.10183770          0.11806170         -0.79246970          1.61485710
          0.10101900          0.00021980         -0.00167870          0.69383950         -0.46317480         -1.74849600
          0.04040800         -0.00010630          0.00283920          0.31458520          0.84321160          0.31630340
          0.01616300          0.00003320         -0.00076640          0.01638690          0.29045090          0.63388040
  1  2  2 10  4
        134.35650000          0.00082950         -0.00066820          0.00107010         -0.00145030
         40.04189000          0.00686720         -0.00549600          0.00903560         -0.01239650
         15.12976000          0.02978290         -0.02413250          0.03925760         -0.05422370
          6.27699000          0.08973600         -0.07293950          0.12440160         -0.17800620
          2.78141000          0.19339830         -0.15795350          0.25010250         -0.33545420
          1.25360200          0.28934680         -0.21643350          0.28000330         -0.18766830
          0.55740500          0.31794410         -0.18224060         -0.08899850          0.78380040
          0.23975900          0.27588610          0.12624550         -0.62602520          0.22363430
          0.09528700          0.15938330          0.44805130         -0.24875410         -1.28760100
          0.03811500          0.07054350          0.48413330          0.81573960          0.96413090
  1  3  3  6  2
          4.24640000          0.03908400         -0.12201770
          1.68310000          0.13383140         -0.36711890
          0.66710000          0.36510790         -0.49912310
          0.26440000          0.49496780          0.25518400
          0.10480000          0.25144470          0.52213820
          0.04150000          0.03832940          0.11207230
# VANADIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
V  Roos-ADZ-ANO
  4
  1  0  0 21  6
    3321857.00000000          0.00000880         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     497435.60000000          0.00006870         -0.00002040          0.00000740         -0.00000170          0.00000330         -0.00000540
     113202.70000000          0.00036100         -0.00010750          0.00003890         -0.00000920          0.00001660         -0.00002720
      32063.33000000          0.00152210         -0.00045390          0.00016420         -0.00003870          0.00007310         -0.00012220
      10459.62000000          0.00551160         -0.00165010          0.00059670         -0.00014080          0.00025210         -0.00041000
       3775.50600000          0.01766850         -0.00534000          0.00193530         -0.00045670          0.00087230         -0.00146550
       1472.04000000          0.05038290         -0.01559340          0.00565820         -0.00133560          0.00235840         -0.00380660
        609.93310000          0.12480880         -0.04072340          0.01489220         -0.00351830          0.00683810         -0.01159340
        265.26340000          0.25172610         -0.09208410          0.03404070         -0.00805470          0.01385690         -0.02209190
        119.86070000          0.35922650         -0.16636470          0.06349340         -0.01508270          0.03069540         -0.05334350
         55.44891000          0.27416450         -0.18580410          0.07421810         -0.01773950          0.02615090         -0.03823630
         24.98372000          0.06486330          0.04585460         -0.01908000          0.00455360          0.00874490         -0.02907220
         11.88056000         -0.00116620          0.50807060         -0.28571740          0.07165820         -0.17680100          0.34559820
          5.66031100          0.00198280          0.50692040         -0.45245900          0.12029780         -0.15916140          0.25792820
          2.49570300         -0.00092240          0.09430990          0.09007790         -0.03297310         -0.08362760          0.02175320
          1.17786600          0.00040990         -0.00270220          0.72508740         -0.24733060          1.01147820         -2.40280600
          0.52004400         -0.00017020          0.00240070          0.42300420         -0.28548310         -0.22802420          2.70767500
          0.11596500          0.00007890         -0.00067900          0.02042980          0.35331150         -2.26950100         -0.25108400
          0.05893800         -0.00007520          0.00064630         -0.01164770          0.59079650          1.60659870         -2.02543500
          0.02694600          0.00003490         -0.00029880          0.00432260          0.22227520          0.30163730          1.79308710
          0.01077800         -0.00000850          0.00007270         -0.00095410          0.00404190          0.13033430         -0.03372380
  1  1  1 15  5
       5777.37700000          0.00018360         -0.00006410          0.00001790         -0.00002930          0.00003760
       1368.67400000          0.00161110         -0.00056260          0.00015830         -0.00025550          0.00031060
        444.12330000          0.00893310         -0.00314410          0.00087600         -0.00143690          0.00184300
        169.09910000          0.03640770         -0.01295560          0.00365290         -0.00589370          0.00715630
         71.10191000          0.11255930         -0.04131800          0.01154370         -0.01897940          0.02447010
         31.90311000          0.25238890         -0.09610600          0.02735360         -0.04405560          0.05280940
         14.85109000          0.38048750         -0.15458390          0.04343200         -0.07318490          0.09891910
          7.08522700          0.31047820         -0.11487580          0.03382940         -0.05429490          0.06201690
          3.32442200          0.08808030          0.16825760         -0.06114900          0.10392680         -0.12794370
          1.54116400          0.00320000          0.47522200         -0.15596350          0.35080200         -0.64800290
          0.69052000          0.00136800          0.41995650         -0.19423340          0.21455920          0.26641430
          0.28542400         -0.00038780          0.10071520          0.12128510         -0.91179100          1.37800780
          0.11417000          0.00021440         -0.00165100          0.68002870         -0.29944180         -1.66822500
          0.04566800         -0.00010280          0.00277480          0.32526770          0.79383860          0.32032510
          0.01826700          0.00003210         -0.00074620          0.01640420          0.24053480          0.68719140
  1  2  2 10  4
        155.85270000          0.00082400         -0.00073700          0.00111480         -0.00160610
         46.49771000          0.00690790         -0.00615680          0.00949820         -0.01385620
         17.62999000          0.03046120         -0.02746690          0.04217370         -0.06229780
          7.35467200          0.09234490         -0.08414480          0.13485540         -0.20931580
          3.27405100          0.19856960         -0.18070830          0.27482530         -0.38597190
          1.48248200          0.29427800         -0.23594040          0.27099700         -0.04116230
          0.66135100          0.31782360         -0.15454830         -0.17801220          0.90020360
          0.28482600          0.27361460          0.19348160         -0.65249560         -0.17294460
          0.11289900          0.15457840          0.46099510         -0.03686490         -1.00120500
          0.04516000          0.05137880          0.41547910          0.73380860          0.90394100
  1  3  3  6  2
          5.90660000          0.04103170         -0.11078580
          2.34120000          0.16050070         -0.38304920
          0.92790000          0.39186680         -0.46986320
          0.36780000          0.46817410          0.29209870
          0.14580000          0.23292270          0.51792180
          0.05780000          0.03878760          0.11509430
# CHROMIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CR Roos-ADZ-ANO
  4
  1  0  0 21  6
    6177194.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000
     924929.50000000          0.00003520         -0.00001060          0.00000380          0.00000000          0.00000160         -0.00000270
     210486.50000000          0.00018520         -0.00005550          0.00002010         -0.00000480          0.00000920         -0.00001470
      59620.05000000          0.00078170         -0.00023440          0.00008480         -0.00002000          0.00003570         -0.00005850
      19450.76000000          0.00284000         -0.00085460          0.00030980         -0.00007390          0.00014470         -0.00022940
       7022.05600000          0.00919120         -0.00277760          0.00100500         -0.00023660          0.00041230         -0.00068230
       2738.76300000          0.02681960         -0.00823310          0.00299260         -0.00071610          0.00143310         -0.00225550
       1135.81400000          0.07006660         -0.02215430          0.00805280         -0.00189060          0.00319370         -0.00535390
        495.09230000          0.15802290         -0.05364420          0.01974040         -0.00475090          0.00983570         -0.01532300
        224.74870000          0.28468010         -0.11084460          0.04123840         -0.00964650          0.01526100         -0.02636230
        105.38360000          0.34784190         -0.17981180          0.06982360         -0.01712800          0.03887360         -0.05910420
         50.19359000          0.21469600         -0.15326130          0.06194170         -0.01396960          0.01102890         -0.02750750
         22.24957000          0.03639130          0.15704610         -0.07028210          0.01468510          0.01119260          0.00607140
         10.98265000         -0.00233900          0.55798350         -0.35206530          0.09575890         -0.27550750          0.41885790
          5.38366500          0.00157580          0.40642730         -0.38303600          0.09291530         -0.02447570          0.18358050
          2.34368500         -0.00070320          0.05485290          0.26660970         -0.06694350         -0.14028950         -0.34679470
          1.10520200          0.00028400         -0.00183770          0.70724400         -0.30576810          1.39136390         -1.98221100
          0.48784800         -0.00010280          0.00145360          0.31331990         -0.17006770         -0.97588370          2.83069160
          0.08959900          0.00002440         -0.00007650          0.00785530          0.74527870         -1.41883500         -1.93940600
          0.03342300         -0.00001690          0.00023540         -0.00362720          0.39684270          1.71845830          0.89050600
          0.01336900          0.00000600         -0.00004620          0.00107930          0.00528540         -0.15218120          0.33550720
  1  1  1 15  5
       6268.92100000          0.00018740         -0.00006560          0.00002110         -0.00004280          0.00004900
       1485.11800000          0.00164430         -0.00057560          0.00018610         -0.00036790          0.00041520
        481.91460000          0.00912080         -0.00322040          0.00103810         -0.00210200          0.00240430
        183.51420000          0.03719650         -0.01327760          0.00430200         -0.00850300          0.00960040
         77.19005000          0.11492610         -0.04237710          0.01371150         -0.02787310          0.03196840
         34.65178000          0.25692940         -0.09833830          0.03212880         -0.06332420          0.07142640
         16.14846000          0.38335940         -0.15697670          0.05144400         -0.10828590          0.12916330
          7.71093900          0.30473540         -0.10861110          0.03596730         -0.07062480          0.10060060
          3.60715400          0.08243440          0.18485070         -0.07642230          0.17670900         -0.34212040
          1.66736200          0.00273620          0.47596480         -0.19422200          0.57084960         -0.83549890
          0.73908800          0.00145720          0.40672300         -0.18560820         -0.03570800          1.41643780
          0.30132600         -0.00032910          0.10212740          0.20105820         -1.25601300         -0.04974320
          0.12053000          0.00022830         -0.00155650          0.68652460          0.40458460         -1.33599800
          0.04821200         -0.00010210          0.00275350          0.26067750          0.58709910          0.97815560
          0.01928500          0.00003220         -0.00077330          0.00171750          0.00688970          0.25778320
  1  2  2 10  4
        150.83410000          0.00118076         -0.00073170          0.00147090         -0.00198190
         44.99723000          0.00966118         -0.00593860          0.01221630         -0.01633860
         16.96088000          0.04140729         -0.02588100          0.05281196         -0.07298360
          7.04015400          0.12131664         -0.07615180          0.16199100         -0.23037030
          3.10387800          0.24095388         -0.15059490          0.29357778         -0.36806240
          1.37589600          0.32484954         -0.16871590          0.23847460          0.09367552
          0.59228200          0.32060330         -0.07194640         -0.23308910          0.77748431
          0.24213800          0.23605297          0.19912700         -0.56415040         -0.16503670
          0.09128400          0.09618844          0.30980514         -0.18723120         -0.99837170
          0.03651400          0.02433110          0.61183718          0.71568988          0.83634879
  1  3  3  6  2
          7.71390000          0.03904982         -0.09216890
          3.05750000          0.16805148         -0.36090680
          1.21190000          0.40501469         -0.45590560
          0.48030000          0.45078646          0.24749491
          0.19040000          0.22761472          0.51827288
          0.07550000          0.05358525          0.19289890
# MANGANESE   (21s,15p,10d,6f) -> [6s,5p,4d,2f]
MN Roos-ADZ-ANO
  4
  1  0  0 21  6
    3960805.00000000          0.00000870         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     593115.50000000          0.00006800         -0.00002050          0.00000750         -0.00000180          0.00000280         -0.00000580
     134976.80000000          0.00035740         -0.00010780          0.00003960         -0.00000940          0.00001420         -0.00002880
      38230.67000000          0.00150710         -0.00045530          0.00016750         -0.00003980          0.00006220         -0.00012990
      12471.54000000          0.00545760         -0.00165520          0.00060840         -0.00014450          0.00021660         -0.00043510
       4501.74300000          0.01749970         -0.00535760          0.00197440         -0.00046990          0.00074070         -0.00155900
       1755.21200000          0.04993510         -0.01565660          0.00577530         -0.00137120          0.00203370         -0.00404210
        727.30390000          0.12388070         -0.04095100          0.01523350         -0.00363220          0.00580330         -0.01236980
        316.36780000          0.25049690         -0.09287230          0.03492020         -0.00830490          0.01207350         -0.02356150
        143.00980000          0.35895920         -0.16842450          0.06548770         -0.01572940          0.02604550         -0.05741360
         66.21805000          0.27590170         -0.18918780          0.07702400         -0.01842520          0.02385160         -0.04110840
         29.91896000          0.06596040          0.04616510         -0.01954550          0.00436730          0.00485290         -0.03230330
         14.30318000         -0.00123720          0.51471840         -0.30058260          0.07696050         -0.14730130          0.37768110
          6.83945100          0.00195630          0.50418490         -0.45625350          0.12103880         -0.14594950          0.26094310
          3.01237400         -0.00090710          0.09186060          0.12027270         -0.03966160         -0.03547160         -0.00501200
          1.41880800          0.00039750         -0.00258700          0.72812930         -0.26313840          0.77851700         -2.43265200
          0.62362400         -0.00015930          0.00230800          0.40324530         -0.26294560         -0.08070840          2.70448470
          0.13409800          0.00006830         -0.00059920          0.01779610          0.43299070         -2.04653000         -0.18863590
          0.06554800         -0.00006470          0.00056840         -0.01018190          0.54643390          1.23053960         -1.98447500
          0.02958400          0.00003130         -0.00027370          0.00400370          0.19067480          0.54467080          1.81069230
          0.01183400         -0.00000790          0.00006890         -0.00092400         -0.00022150          0.08868420         -0.15215100
  1  1  1 15  5
       7048.27100000          0.00017840         -0.00006390          0.00001760         -0.00003520          0.00003830
       1669.67800000          0.00156680         -0.00056100          0.00015600         -0.00030590          0.00032350
        541.85710000          0.00871540         -0.00314650          0.00086970         -0.00173610          0.00188620
        206.42950000          0.03571610         -0.01303980          0.00363280         -0.00712210          0.00752970
         86.89334000          0.11121530         -0.04192160          0.01162420         -0.02325950          0.02535640
         39.06309000          0.25160510         -0.09857340          0.02770210         -0.05418060          0.05694880
         18.24725000          0.38123080         -0.15962520          0.04470710         -0.09199500          0.10353020
          8.74128900          0.31029020         -0.11507290          0.03304800         -0.06717710          0.07872650
          4.11933200          0.08812070          0.17705150         -0.06260660          0.13777230         -0.19226940
          1.91480400          0.00359900          0.47737790         -0.16108730          0.46888220         -0.69137230
          0.85789300          0.00145210          0.41264500         -0.17690520          0.10208170          0.61487770
          0.35495000         -0.00033420          0.09948660          0.12091270         -1.04596100          0.92077360
          0.14198000          0.00020600         -0.00159780          0.64429190         -0.06945110         -1.51537700
          0.05679200         -0.00009730          0.00267830          0.35827300          0.68819970          0.36824920
          0.02271700          0.00003030         -0.00071550          0.01972490          0.18214330          0.70160790
  1  2  2 10  4
        199.83570000          0.00086890         -0.00061410          0.00124530         -0.00144350
         59.72176000          0.00740550         -0.00517230          0.01084020         -0.01243060
         22.74772000          0.03343540         -0.02375470          0.04918380         -0.05807330
          9.56500300          0.10222310         -0.07263280          0.16008170         -0.19535270
          4.28549900          0.21763820         -0.15840410          0.32014190         -0.37455660
          1.95097500          0.31388650         -0.20224890          0.26650740          0.04875240
          0.87279600          0.32265140         -0.12237590         -0.28152510          0.78022240
          0.37562100          0.24897740          0.19545300         -0.57570980         -0.11241070
          0.14800900          0.11555480          0.39788320         -0.07034260         -1.10424800
          0.05920400          0.03978050          0.51436970          0.67373320          0.97098940
  1  3  3  6  2
          9.54130000          0.03498520         -0.08024420
          3.78180000          0.15976610         -0.34830930
          1.49900000          0.39648690         -0.47839020
          0.59410000          0.45515610          0.22560180
          0.23550000          0.23977600          0.52997080
          0.09330000          0.05663870          0.19214410
# IRON        (21s,15p,10d,6f) -> [6s,5p,4d,2f]
FE Roos-ADZ-ANO
  4
  1  0  0 21  6
    4316265.00000000          0.00000870         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     646342.40000000          0.00006760         -0.00002020          0.00000660         -0.00000180          0.00000270         -0.00000570
     147089.70000000          0.00035510         -0.00010650          0.00003470         -0.00000940          0.00001400         -0.00002870
      41661.52000000          0.00149760         -0.00044950          0.00014670         -0.00003970          0.00006110         -0.00012810
      13590.77000000          0.00542370         -0.00163470          0.00053290         -0.00014380          0.00021330         -0.00043330
       4905.75000000          0.01739500         -0.00529340          0.00173040         -0.00046800          0.00072770         -0.00153520
       1912.74600000          0.04966290         -0.01548620          0.00506480         -0.00136580          0.00200470         -0.00403960
        792.60430000          0.12335570         -0.04059850          0.01338920         -0.00362260          0.00570610         -0.01216330
        344.80650000          0.25002290         -0.09250400          0.03080250         -0.00829640          0.01195170         -0.02374360
        155.89990000          0.35990370         -0.16905000          0.05821830         -0.01577060          0.02569760         -0.05631410
         72.23091000          0.27899280         -0.19228400          0.06938660         -0.01858720          0.02403850         -0.04348580
         32.72506000          0.06684860          0.04532080         -0.01668270          0.00410360          0.00461020         -0.02746690
         15.66762000         -0.00530450          0.52919120         -0.28071900          0.07759400         -0.14507200          0.35854230
          7.50348300         -0.00219420          0.52613700         -0.43502950          0.12054490         -0.14701850          0.29723730
          3.31222300         -0.00156720          0.08634040          0.13102650         -0.04091310         -0.02284040         -0.05560670
          1.55847100          0.00070060         -0.03666660          0.72871520         -0.26246710          0.74958120         -2.35786300
          0.68391400         -0.00001330         -0.01644200          0.39852760         -0.25768170         -0.07729630          2.62219710
          0.14675700          0.00007580         -0.00138020          0.01733970          0.43339760         -1.92800900         -0.09696180
          0.07058300         -0.00006820          0.00098670         -0.00966160          0.54662560          1.06569450         -1.99104900
          0.03144900          0.00003290         -0.00043850          0.00385200          0.18747110          0.60856320          1.72090500
          0.01258000         -0.00000840          0.00010900         -0.00090970          0.00270480          0.09196060         -0.10051950
  1  1  1 15  5
       7721.48900000          0.00017940         -0.00005530          0.00001830         -0.00003460          0.00003990
       1829.12600000          0.00157650         -0.00048580          0.00016140         -0.00030210          0.00034850
        593.62800000          0.00878210         -0.00273220          0.00090230         -0.00170710          0.00197160
        226.20540000          0.03607770         -0.01136920          0.00377270         -0.00706390          0.00815410
         95.26145000          0.11272930         -0.03684800          0.01213510         -0.02300820          0.02661730
         42.85920000          0.25609280         -0.08750780          0.02898860         -0.05424340          0.06262640
         20.04971000          0.38909430         -0.14330720          0.04708140         -0.09111680          0.10665340
          9.62088500          0.31513030         -0.09976090          0.03395630         -0.06773050          0.09339330
          4.54137100          0.07892750          0.18578570         -0.06721070          0.14812740         -0.23558910
          2.11350000         -0.01959520          0.47909010         -0.17287650          0.46037010         -0.68343630
          0.94720100         -0.01837930          0.40815100         -0.16620750          0.03915710          0.63114560
          0.39124300         -0.00505370          0.09750330          0.14589740         -0.91332880          0.89696110
          0.15649700          0.00027940         -0.00155180          0.61178550         -0.15696580         -1.38206000
          0.06259900         -0.00022310          0.00263140          0.35925890          0.64005450          0.16944950
          0.02504000          0.00006380         -0.00070260          0.04073560          0.28359880          0.76562060
  1  2  2 10  4
        217.36880000          0.00090860         -0.00072370          0.00125890         -0.00161930
         64.99976000          0.00775700         -0.00612900          0.01092110         -0.01394030
         24.77314000          0.03509610         -0.02813160          0.04980140         -0.06542380
         10.43614000          0.10690640         -0.08623050          0.16077490         -0.22105340
          4.67965300          0.22354780         -0.18379140          0.32346140         -0.41836770
          2.12562200          0.31482280         -0.22300410          0.24231990          0.18487330
          0.94524200          0.31706310         -0.09948400         -0.34487070          0.78688110
          0.40268500          0.24533970          0.24250460         -0.54964040         -0.34311580
          0.15665100          0.11980180          0.42175960          0.03680090         -0.87041820
          0.06266000          0.04248370          0.43580570          0.65109530          0.90154760
  1  3  3  6  2
         11.27490000          0.03258760         -0.07378730
          4.46900000          0.15612850         -0.35717230
          1.77130000          0.40094740         -0.48333090
          0.70210000          0.45321070          0.23975430
          0.27830000          0.23899830          0.52100980
          0.11030000          0.05966160          0.18732480
# COBALT      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CO Roos-ADZ-ANO
  4
  1  0  0 21  6
    4676708.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     700317.20000000          0.00006700         -0.00002040          0.00000760         -0.00000170          0.00000350         -0.00000550
     159373.00000000          0.00035240         -0.00010750          0.00004000         -0.00000890          0.00001770         -0.00002790
      45140.67000000          0.00148620         -0.00045380          0.00016920         -0.00003790          0.00007790         -0.00012220
      14725.75000000          0.00538250         -0.00165000          0.00061480         -0.00013730          0.00026890         -0.00042470
       5315.44800000          0.01726470         -0.00534190          0.00199590         -0.00044680          0.00093000         -0.00145680
       2072.49800000          0.04930400         -0.01562390          0.00584290         -0.00130530          0.00252090         -0.00399180
        858.82310000          0.12253550         -0.04092880          0.01543990         -0.00346240          0.00732690         -0.01146260
        373.64370000          0.24860380         -0.09312740          0.03551540         -0.00794870          0.01498120         -0.02386790
        168.96820000          0.35837910         -0.16965500          0.06696130         -0.01512480          0.03342110         -0.05222480
         78.31971000          0.27841060         -0.19245090          0.07961680         -0.01794030          0.02931210         -0.04836930
         35.53724000          0.06785880          0.04347140         -0.01872100          0.00395780          0.00996530         -0.01193170
         17.04735000         -0.00115750          0.51737040         -0.31042280          0.07479190         -0.19610040          0.30946350
          8.17553400          0.00192300          0.50464650         -0.46054150          0.11490080         -0.17626490          0.39054300
          3.61157800         -0.00088960          0.09201290          0.13587240         -0.04223380         -0.03861910         -0.28532140
          1.69746800          0.00038520         -0.00234550          0.73020260         -0.24686420          1.08415130         -2.05903400
          0.74363600         -0.00015140          0.00224230          0.39330010         -0.24198820         -0.42626710          2.57812780
          0.15832500          0.00006130         -0.00053850          0.01679520          0.37226090         -1.91956200         -0.61815020
          0.07500900         -0.00005670          0.00050120         -0.00930160          0.56759560          1.37322520         -1.30766700
          0.03309300          0.00002780         -0.00024560          0.00375190          0.21737940          0.27764580          1.32262520
          0.01323700         -0.00000730          0.00006420         -0.00090600          0.00352470          0.13569010          0.10033550
  1  1  1 15  5
       8421.84200000          0.00017490         -0.00006400          0.00001880         -0.00003830          0.00003990
       1995.00000000          0.00153770         -0.00056240          0.00016620         -0.00033620          0.00035810
        647.48550000          0.00857460         -0.00316260          0.00093160         -0.00189450          0.00197280
        246.77950000          0.03528970         -0.01316530          0.00389910         -0.00789320          0.00841770
        103.96890000          0.11048560         -0.04258770          0.01259830         -0.02567960          0.02674400
         46.81052000          0.25156270         -0.10095360          0.03016540         -0.06112280          0.06551270
         21.92703000          0.38208840         -0.16409550          0.04922890         -0.10201960          0.10577100
         10.53715000          0.30945670         -0.11461140          0.03475150         -0.07728850          0.10794080
          4.98067800          0.08757280          0.18585070         -0.07188090          0.18257780         -0.29257760
          2.31982400          0.00382660          0.48071240         -0.18284560          0.51785750         -0.65412750
          1.03960900          0.00151230          0.40513110         -0.15347360         -0.05554230          0.76754230
          0.42892100         -0.00028530          0.09651020          0.15599370         -0.93997170          0.67550470
          0.17156800          0.00020140         -0.00155780          0.59752060         -0.05577780         -1.32197400
          0.06862700         -0.00009280          0.00261270          0.36419420          0.61553970          0.22022440
          0.02745100          0.00002890         -0.00069720          0.04018450          0.23599690          0.76020010
  1  2  2 10  4
        237.59280000          0.00092700         -0.00084720          0.00120630         -0.00171410
         71.08881000          0.00793870         -0.00721600          0.01046470         -0.01490830
         27.11903000          0.03606410         -0.03323240          0.04802990         -0.06950530
         11.44826000          0.10968160         -0.10231590          0.15456280         -0.23750360
          5.13954200          0.22645780         -0.21395030          0.31068290         -0.45108020
          2.33269400          0.31367760         -0.24295660          0.20905210          0.26005330
          1.03403000          0.31243550         -0.06620310         -0.35934790          0.80108240
          0.43789900          0.24628330          0.29378190         -0.51288440         -0.47137080
          0.16896300          0.12633170          0.41673020          0.07429740         -0.71721040
          0.06758500          0.03900340          0.37130920          0.68550190          0.82498910
  1  3  3  6  2
         12.84030000          0.03236910         -0.07453890
          5.08940000          0.15788750         -0.37667740
          2.01720000          0.41073330         -0.47481310
          0.79960000          0.45170690          0.27648130
          0.31690000          0.22855470          0.50315310
          0.12560000          0.05597530          0.17676000
# NICKEL      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
NI Roos-ADZ-ANO
  4
  1  0  0 21  6
    5048010.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     755918.10000000          0.00006680         -0.00002040          0.00000770         -0.00000170          0.00000360         -0.00000560
     172026.20000000          0.00035100         -0.00010760          0.00004030         -0.00000890          0.00001810         -0.00002900
      48724.57000000          0.00148020         -0.00045410          0.00017020         -0.00003750          0.00007960         -0.00012620
      15894.89000000          0.00536130         -0.00165120          0.00061850         -0.00013620          0.00027480         -0.00044210
       5737.46800000          0.01719850         -0.00534630          0.00200800         -0.00044320          0.00094960         -0.00150170
       2237.05100000          0.04912750         -0.01564110          0.00587970         -0.00129480          0.00257820         -0.00416600
        927.03020000          0.12216700         -0.04099880          0.01554880         -0.00343810          0.00748690         -0.01179840
        403.34610000          0.24810880         -0.09339290          0.03580900         -0.00790000          0.01536150         -0.02506610
        182.42820000          0.35826230         -0.17040030          0.06764850         -0.01506930          0.03423590         -0.05358670
         84.58917000          0.27910230         -0.19374000          0.08065480         -0.01791070          0.03032360         -0.05236170
         38.42293000          0.06830140          0.04354050         -0.01892620          0.00392190          0.00992020         -0.00783680
         18.46879000         -0.00118350          0.51950270         -0.31545840          0.07504680         -0.20137340          0.31051000
          8.86819000          0.00191620          0.50372390         -0.46110780          0.11324250         -0.18303880          0.44043500
          3.91887000         -0.00088450          0.09139080          0.14489870         -0.04393570         -0.02175280         -0.39622500
          1.83985300          0.00038170         -0.00227360          0.73044870         -0.24438380          1.09749980         -2.00536500
          0.80466300         -0.00014830          0.00220820          0.38778550         -0.23485420         -0.46797710          2.63047080
          0.16984600          0.00005850         -0.00051330          0.01622800          0.36865540         -1.85498200         -0.80559900
          0.07937000         -0.00005370          0.00047480         -0.00891480          0.57243370          1.32221160         -1.12092700
          0.03470000          0.00002660         -0.00023480          0.00364400          0.21592430          0.29731170          1.36863090
          0.01388000         -0.00000710          0.00006240         -0.00089650          0.00028770          0.11571620         -0.01542830
  1  1  1 15  5
       9148.79600000          0.00017360         -0.00006400          0.00001960         -0.00004290          0.00004470
       2167.17100000          0.00152660         -0.00056290          0.00017310         -0.00037840          0.00042100
        703.38570000          0.00852130         -0.00316920          0.00097220         -0.00212800          0.00221460
        268.13420000          0.03513410         -0.01321830          0.00407440         -0.00891460          0.00994010
        113.00780000          0.11025030         -0.04287100          0.01321020         -0.02898040          0.03007480
         50.91339000          0.25168060         -0.10196740          0.03171290         -0.06949990          0.07851530
         23.87740000          0.38250460         -0.16592570          0.05192370         -0.11563460          0.11657620
         11.48924000          0.30893670         -0.11411670          0.03605130         -0.09018240          0.15823130
          5.43688400          0.08722900          0.18968800         -0.07725320          0.22442350         -0.46936450
          2.53383700          0.00392060          0.48171720         -0.19414970          0.59429600         -0.66531670
          1.13530900          0.00153920          0.40202030         -0.14772330         -0.16225690          1.24799050
          0.46789100         -0.00026550          0.09551930          0.17187530         -1.03404300          0.06088250
          0.18715600          0.00019940         -0.00154890          0.60426630          0.15003200         -1.22401600
          0.07486200         -0.00009090          0.00258830          0.35544100          0.61273400          0.59511470
          0.02994500          0.00002840         -0.00069060          0.02125060          0.09486060          0.50804730
  1  2  2 10  4
        258.86670000          0.00095250         -0.00092610          0.00123660         -0.00177870
         77.49604000          0.00817990         -0.00792440          0.01074820         -0.01571750
         29.58972000          0.03730820         -0.03662670          0.04958940         -0.07273200
         12.51527000          0.11328720         -0.11305370          0.15987740         -0.25411760
          5.62446800          0.23147570         -0.23263250          0.31923220         -0.46309120
          2.55130300          0.31613600         -0.24935030          0.17919010          0.36602760
          1.12806000          0.31084320         -0.03532690         -0.41307200          0.75610370
          0.47537300          0.24210240          0.32694740         -0.47494000         -0.60471820
          0.18212800          0.12298390          0.41969840          0.17118430         -0.55810490
          0.07285100          0.03516760          0.31817540          0.63979400          0.78181900
  1  3  3  6  2
         14.21560000          0.03449540         -0.07796490
          5.63450000          0.16793190         -0.39359110
          2.23330000          0.42354040         -0.45649420
          0.88520000          0.44325990          0.31147600
          0.35090000          0.21579090          0.49201070
          0.13910000          0.05136220          0.16482550
# COPPER      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CU Roos-ADZ-ANO
  4
  1  0  0 21  6
    9148883.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000
    1369956.00000000          0.00003470         -0.00001070          0.00000400          0.00000000          0.00000170         -0.00000290
     311782.60000000          0.00018240         -0.00005610          0.00002100         -0.00000450          0.00000940         -0.00001540
      88318.80000000          0.00077000         -0.00023700          0.00008860         -0.00001870          0.00003650         -0.00006340
      28815.53000000          0.00279760         -0.00086380          0.00032360         -0.00006950          0.00014820         -0.00023880
      10403.46000000          0.00905600         -0.00280830          0.00105020         -0.00022030          0.00042260         -0.00074630
       4057.79100000          0.02644080         -0.00832980          0.00312940         -0.00067530          0.00147000         -0.00232870
       1682.97400000          0.06918040         -0.02245400          0.00843860         -0.00176120          0.00328320         -0.00594890
        733.75430000          0.15647990         -0.05456570          0.02077020         -0.00452220          0.01014890         -0.01569050
        333.26770000          0.28318800         -0.11339210          0.04369710         -0.00904300          0.01588480         -0.03044290
        156.43380000          0.34834740         -0.18512600          0.07460190         -0.01670180          0.04068720         -0.05907700
         74.69721000          0.21729720         -0.15873810          0.06696040         -0.01288420          0.01192630         -0.04167230
         33.32262000          0.03723950          0.16600910         -0.07944260          0.01333560          0.01022030          0.03684610
         16.62237000         -0.00258070          0.56808840         -0.38487520          0.09790590         -0.29168770          0.38295340
          8.20826000          0.00156040          0.39505050         -0.37246620          0.07249740         -0.02332030          0.36386430
          3.60940000         -0.00067990          0.05193440          0.31938580         -0.06056550         -0.06553060         -0.83790950
          1.68344900          0.00026190         -0.00105780          0.70435860         -0.29718440          1.32294460         -1.33277500
          0.73375700         -0.00008680          0.00123940          0.27996240         -0.10637610         -1.05594100          2.35852380
          0.11020700          0.00001770         -0.00011970          0.00579100          0.79532710         -1.23087800         -1.82846500
          0.03878600         -0.00001290          0.00008860         -0.00266520          0.30758250          1.65313940          1.20324560
          0.01551400          0.00000490         -0.00003400          0.00095220          0.01483550         -0.20155160          0.04477910
  1  1  1 15  5
       9713.25300000          0.00017840         -0.00006580          0.00002260         -0.00004700          0.00004950
       2300.88900000          0.00156860         -0.00057820          0.00019820         -0.00041560          0.00048660
        746.77060000          0.00875430         -0.00325660          0.00112040         -0.00232770          0.00245540
        284.68060000          0.03608110         -0.01357800          0.00466570         -0.00979250          0.01150310
        119.99990000          0.11299150         -0.04399850          0.01521570         -0.03165890          0.03321540
         54.07386000          0.25664090         -0.10418090          0.03608110         -0.07599310          0.09109850
         25.37321000          0.38518750         -0.16768020          0.05925500         -0.12447490          0.12482900
         12.20962000          0.30288080         -0.10714430          0.03709930         -0.09551570          0.19632250
          5.75742100          0.08164480          0.20500460         -0.09339450          0.27896170         -0.67869170
          2.67340200          0.00338810          0.48293960         -0.22900240          0.62767590         -0.49863740
          1.18683500          0.00157700          0.39022330         -0.12323690         -0.32615190          1.47981130
          0.48159300         -0.00022080          0.09437740          0.23118240         -1.00099000         -0.46342030
          0.19263700          0.00021200         -0.00154480          0.60241090          0.33267140         -0.93055400
          0.07705500         -0.00008950          0.00264390          0.30652420          0.54404040          0.69217010
          0.03082200          0.00002840         -0.00072740          0.01307760          0.05542390          0.36845720
  1  2  2 10  4
        249.34970000          0.00126400         -0.00155310          0.00186920         -0.00233540
         74.63837000          0.01063890         -0.01311300          0.01612510         -0.02290710
         28.37641000          0.04720950         -0.05895500          0.07240920         -0.09394700
         11.94893000          0.13793660         -0.17782060          0.23628630         -0.37675940
          5.31764600          0.26266750         -0.32716810          0.38296120         -0.32713530
          2.36441700          0.33241630         -0.24099740         -0.16793750          0.95009690
          1.01238600          0.30779900          0.18960650         -0.68246030         -0.04648790
          0.40677300          0.21664100          0.50340450          0.08869930         -0.88560220
          0.14733100          0.08407720          0.30703590          0.60278640          0.54282850
          0.05893200          0.00504380          0.03253970          0.14438100          0.32722400
  1  3  3  6  2
         15.43330000          0.03901820         -0.08437670
          6.11720000          0.18754340         -0.41437330
          2.42460000          0.44621250         -0.41723570
          0.96100000          0.42647410          0.35876800
          0.38090000          0.19155910          0.47774570
          0.15100000          0.04165180          0.15423760
# ZINC        (21s,15p,10d,6f) -> [6s,5p,4d,2f]
ZN Roos-ADZ-ANO
  4
  1  0  0 21  6
    5820021.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     871523.40000000          0.00006650         -0.00002050          0.00000780         -0.00000170          0.00000270         -0.00000590
     198335.00000000          0.00034950         -0.00010800          0.00004080         -0.00000910          0.00001370         -0.00003010
      56176.31000000          0.00147380         -0.00045590          0.00017230         -0.00003860          0.00005980         -0.00013300
      18325.82000000          0.00533830         -0.00165780          0.00062590         -0.00013990          0.00020950         -0.00045660
       6614.95500000          0.01712710         -0.00536850          0.00203290         -0.00045590          0.00071120         -0.00158960
       2579.19900000          0.04894090         -0.01571240          0.00595460         -0.00133090          0.00197450         -0.00428140
       1068.84900000          0.12179340         -0.04122570          0.01576690         -0.00354270          0.00559090         -0.01258460
        465.10450000          0.24765890         -0.09406410          0.03637540         -0.00814300          0.01189240         -0.02556620
        210.41300000          0.35824320         -0.17199640          0.06892730         -0.01561320          0.02539150         -0.05827530
         97.61629000          0.27981700         -0.19585000          0.08237330         -0.01853580          0.02475170         -0.05034830
         44.38020000          0.06857580          0.04532440         -0.02009310          0.00413200          0.00312860         -0.02002860
         21.42308000         -0.00131270          0.52445220         -0.32530080          0.07898840         -0.14558310          0.36143710
         10.30891000          0.00191630          0.50060100         -0.46020860          0.11413160         -0.14872710          0.36964340
          4.55364500         -0.00087910          0.08947690          0.16339080         -0.04867670          0.03235680         -0.27535280
          2.13282100          0.00037780         -0.00217430          0.72999360         -0.25153870          0.66517080         -2.09870600
          0.92969700         -0.00014330          0.00213750          0.37667470         -0.23375600         -0.09666510          2.46453010
          0.19214700          0.00005410         -0.00046910          0.01508170          0.43801720         -1.65751300         -0.10951070
          0.08759500         -0.00004910          0.00043030         -0.00822400          0.55217390          0.75108880         -1.76128800
          0.03770200          0.00002470         -0.00021650          0.00344840          0.16985730          0.73491840          1.53073600
          0.01508100         -0.00000670          0.00005910         -0.00087620          0.00249730          0.07323190         -0.07747830
  1  1  1 15  5
      10684.58000000          0.00017140         -0.00006410          0.00001680         -0.00003600          0.00004200
       2530.90300000          0.00150870         -0.00056380          0.00014820         -0.00031830          0.00037880
        821.48200000          0.00843680         -0.00318040          0.00083380         -0.00178740          0.00208760
        313.25220000          0.03489610         -0.01331030          0.00350650         -0.00753410          0.00897610
        132.10940000          0.10993590         -0.04336340          0.01141350         -0.02449690          0.02862580
         59.58751000          0.25205640         -0.10373190          0.02756400         -0.05930450          0.07089200
         28.00399000          0.38327840         -0.16900020          0.04514620         -0.09830750          0.11494810
         13.50425000          0.30782600         -0.11286720          0.03039090         -0.07579650          0.11746310
          6.40188100          0.08651150          0.19638980         -0.06646510          0.18815810         -0.33659140
          2.98576900          0.00408220          0.48297950         -0.16153150          0.46903910         -0.64064250
          1.33690200          0.00158570          0.39676170         -0.13642790         -0.03999370          0.74529540
          0.54996100         -0.00023230          0.09411040          0.11657870         -0.81822090          0.70157210
          0.21998400          0.00019580         -0.00153060          0.54683600         -0.22067370         -1.15028400
          0.08799400         -0.00008780          0.00254790          0.41490790          0.53820720         -0.05687820
          0.03519800          0.00002740         -0.00067970          0.07954380          0.36284880          0.84283010
  1  2  2 10  4
        305.01150000          0.00102500         -0.00138600          0.00152390         -0.00179460
         91.40003000          0.00884670         -0.01201630          0.01363620         -0.01752960
         34.95829000          0.04068310         -0.05596400          0.06257500         -0.07605900
         14.83697000          0.12323990         -0.17605410          0.21698560         -0.30775460
          6.68074800          0.24793300         -0.34913890          0.40159130         -0.40478260
          3.02902600          0.33086680         -0.27309330         -0.16958970          0.86315710
          1.33483900          0.31736350          0.21104720         -0.70399180          0.12409940
          0.55860800          0.22301480          0.51804310          0.13084190         -0.93622630
          0.21174300          0.08092210          0.26108130          0.59401250          0.39627950
          0.08469700          0.00354320          0.02024490          0.18018630          0.51834500
  1  3  3  6  2
         16.57440000          0.04557150         -0.09412220
          6.56950000          0.21536030         -0.43664550
          2.60390000          0.46964770         -0.37405330
          1.03210000          0.40406900          0.42861550
          0.40910000          0.16303650          0.47241450
          0.16210000          0.02361610          0.09871230
# BASIS="Roos Augmented Triple Zeta ANO"
#Elements                             References
#--------                             ----------
#H - Ne:  P.O. Widmark, P.A. Malmqvist, B. Roos, Theor. Chim. Acta, 77,
#         291 (1990).
#Na - Ar: P.O. Widmark, B. J. Persson and B. Roos Theor. Chim. Acta, 79,
#         419 (1991).
#Sc - Zn: R. Pou-Amerigo, M. Merchan, I. Nebot-Gil, P.O. Widmark and B. Roos,
#         Theor. Chim. Acta, 92, 149 (1995).
#
# HYDROGEN    (8s,4p,3d) -> [4s,3p,2d]
H  Roos-ATZ-ANO
  3
  1  0  0  8  4
        188.61445000          0.00096390         -0.00131190          0.00242240         -0.01157010
         28.27659600          0.00749200         -0.01034510          0.02033820         -0.08371540
          6.42483000          0.03759540         -0.05049530          0.08963940         -0.44516630
          1.81504100          0.14339500         -0.20738550          0.44229070         -1.14627100
          0.59106300          0.34863630         -0.43508850          0.57571440          2.50318710
          0.21214900          0.43829740         -0.02472970         -0.98028900         -1.58284930
          0.07989100          0.16510660          0.32252600         -0.67215380          0.03096569
          0.02796200          0.02102290          0.70727540          1.14176850          0.30862864
  1  1  1  4  3
          2.30500000          0.11279020         -0.21086880          0.75995010
          0.80675000          0.41850750         -0.59437960          0.16461590
          0.28236200          0.47000770          0.08968890         -1.37101400
          0.09882700          0.18262600          0.86116340          1.05931550
  1  2  2  3  2
          1.81900000          0.27051340         -0.79380350
          0.72760000          0.55101250         -0.09142520
          0.29104000          0.33108660          0.86200330
# HELIUM      (9s,4p,3d) -> [4s,3p,2d]
HE Roos-ATZ-ANO
  3
  1  0  0  9  4
       1149.27050000          0.00035774         -0.00053060          0.00070544         -0.00047220
        172.04457000          0.00277289         -0.00403300          0.00705199         -0.01047220
         39.08046500          0.01429838         -0.02258040          0.03126037         -0.01940990
         11.03617300          0.05586749         -0.10262550          0.32197965         -0.71273560
          3.56415200          0.16336284         -0.45771141          1.00474880         -0.01013290
          1.24044300          0.33133146         -0.60596530         -1.29080400          1.93433390
          0.44731600          0.41429728          0.57131336         -0.47258960         -2.54165900
          0.16420600          0.18903228          0.54758341          0.95308829          0.89814050
          0.05747200          0.00515606          0.01165900          0.05061692          0.54395940
  1  1  1  4  3
          4.55000000          0.08926060         -0.18673500          0.85489228
          1.59250000          0.38050238         -0.51173450          0.10926707
          0.55737500          0.44912372         -0.19815060         -1.26381200
          0.19508100          0.27765440          0.99587976          0.90243325
  1  2  2  3  2
          3.40000000          0.28055213         -0.95147161
          1.36000000          0.56558317          0.18505878
          0.54400000          0.30332967          0.69874000
# LITHIUM     (14s,9p,4d,3f) -> [5s,4p,3d,2f]
LI Roos-ATZ-ANO
  4
  1  0  0 14  5
       9497.93440000          0.00007470         -0.00001100          0.00000640         -0.00004010          0.00015530
       1416.81120000          0.00058360         -0.00008570          0.00004890         -0.00031020          0.00121290
        321.45994000          0.00306100         -0.00045070          0.00026580         -0.00164650          0.00634650
         91.12416300          0.01260110         -0.00186300          0.00106850         -0.00663950          0.02593170
         29.99989100          0.04234720         -0.00635750          0.00397710         -0.02266020          0.08532950
         11.01763100          0.11475800         -0.01776730          0.01120300         -0.05824470          0.21962470
          4.37280100          0.23936590         -0.03979680          0.03121890         -0.12226070          0.40388970
          1.83125600          0.35759180         -0.07012820          0.06165080         -0.13524710          0.36488270
          0.80226100          0.30337580         -0.10294690          0.15065020         -0.05426510         -0.55096830
          0.36264800          0.08637930         -0.09370780          0.18747830          0.08320130         -1.38761000
          0.11399500          0.00264390          0.22012880         -1.09410700          1.74793500          1.98390880
          0.05123700          0.00121700          0.59337740         -0.29242230         -1.64630700         -0.75902980
          0.02246800          0.00056200          0.29452750          0.84809440         -0.74085420         -0.68444260
          0.00786000          0.00001970          0.02495030          0.44800090          1.30386500          0.64145200
  1  1  1  9  4
         13.11950400          0.00144900         -0.00232680          0.00948250         -0.01053320
          3.07742420          0.00799580         -0.01122420          0.06320780         -0.07342820
          1.09880050          0.02134850         -0.03446260          0.17514660         -0.24101740
          0.43577840          0.05011950         -0.03387750          0.57689390         -0.88596330
          0.18024320          0.19547390         -0.45445200          0.55635160          1.62517800
          0.07613330          0.41911190         -0.49630840         -1.29108200         -0.33356840
          0.03254650          0.34816470          0.48858790          0.20705210         -1.25048500
          0.01401820          0.15059750          0.56023390          0.42867280          0.94681210
          0.00490640          0.01570330          0.07028070          0.00433120          0.20398210
  1  2  2  4  3
          0.45000000          0.02237290         -0.03046180          0.17667930
          0.15750000          0.37508790         -0.57345880          0.99447180
          0.05512500          0.46891730         -0.27418710         -1.55262100
          0.01929380          0.36536290          0.95628830          0.87869010
  1  3  3  3  2
          0.24000000          0.38777830         -0.37956520
          0.09600000          0.40160980         -0.61030860
          0.03840000          0.44614990          1.09006880
# BERYLLIUM   (14s,9p,4d,3f) -> [5s,4p,3d,2f]
BE Roos-ATZ-ANO
  4
  1  0  0 14  5
      22628.59900000          0.00005330         -0.00001020          0.00001240         -0.00001630          0.00002030
       3372.31810000          0.00041810         -0.00008040          0.00009760         -0.00010870          0.00013930
        760.35040000          0.00222600         -0.00042810          0.00051670         -0.00072720          0.00089930
        211.74048000          0.00956280         -0.00184870          0.00225260         -0.00232140          0.00303920
         67.22346800          0.03481790         -0.00680080          0.00822820         -0.01240240          0.01555530
         23.37217700          0.10594610         -0.02137190          0.02644130         -0.02509110          0.03697740
          8.72137300          0.24566320         -0.05303520          0.06578970         -0.11646220          0.15845460
          3.46809100          0.38607360         -0.10045770          0.13010640         -0.06311670          0.08359830
          1.45214400          0.31037320         -0.13751390          0.19754920         -0.67003370          0.95775190
          0.60861500          0.06389400         -0.06507040          0.07492650          1.22635800         -3.52772300
          0.25768600         -0.00153140          0.32457320         -1.38872200          1.07468780          3.75338910
          0.10417600          0.00118250          0.61816430          0.15458290         -2.96245500         -1.19402400
          0.04242700         -0.00025210          0.20476750          1.02601810          1.56000350         -1.24778000
          0.01484900          0.00007380          0.00430350          0.02577770          0.28184410          1.35910940
  1  1  1  9  4
         33.71018400          0.00103780         -0.00121420          0.00258730         -0.00228730
          8.05764950          0.00660870         -0.00561260          0.02089540         -0.05162490
          2.83647140          0.02155900         -0.02547970          0.05737160         -0.02179070
          1.09996570          0.06087780         -0.01144150          0.26426850         -1.01121800
          0.44339640          0.20355730         -0.51385070          1.06476000          0.73527740
          0.18222640          0.45796690         -0.49080920         -1.43630700          0.91566940
          0.07572410          0.36859060          0.72214520         -0.05473260         -1.93169500
          0.03168540          0.06306410          0.43076220          0.77703460          1.16330190
          0.01108990          0.00210970          0.00225560         -0.03205040          0.20468350
  1  2  2  4  3
          1.40000000          0.00667730         -0.01038680          0.18372870
          0.49000000          0.24681340          0.89258070          0.84247000
          0.17150000          0.65744630         -0.15070990         -1.49449700
          0.06002500          0.25351910         -0.68121650          1.11748040
  1  3  3  3  2
          0.50000000          0.32812970         -1.10394400
          0.20000000          0.65980420          0.65022980
          0.08000000          0.16284720          0.35201450
# BORON       (14s,9p,4d,3f) -> [5s,4p,3d,2f]
B  Roos-ATZ-ANO
  4
  1  0  0 14  5
      33360.21700000          0.00005830         -0.00001210          0.00001210         -0.00001800          0.00002150
       4972.09520000          0.00045650         -0.00009500          0.00009450         -0.00012920          0.00013760
       1125.64170000          0.00240890         -0.00050280          0.00049970         -0.00077710          0.00096490
        316.49136000          0.01016310         -0.00212640          0.00211920         -0.00278200          0.00280310
        102.00726000          0.03609550         -0.00767440          0.00765190         -0.01256000          0.01654500
         36.29587300          0.10598100         -0.02321790          0.02340450         -0.03012700          0.03061560
         13.97141000          0.23956540         -0.05694680          0.05811560         -0.11132910          0.16803220
          5.74115600          0.37377260         -0.10625770          0.11167390         -0.10474970          0.02641520
          2.49426800          0.30814650         -0.14576940          0.17056230         -0.45988410          0.82053220
          1.11420200          0.07769280         -0.04302850          0.01726760          0.67401790         -2.15453300
          0.42154900          0.00147970          0.37194410         -0.99890440          1.50425190          1.02175820
          0.16963300          0.00049910          0.56520900         -0.22657220         -2.47604300          1.70610160
          0.06853500         -0.00002620          0.19212690          1.02945500          0.57766700         -3.08376400
          0.02398700          0.00002360          0.02191280          0.22137860          0.74299930          1.80833780
  1  1  1  9  4
         55.00000000          0.00101860         -0.00077760          0.00075900         -0.00322100
         13.36610100          0.00739580         -0.00577680          0.00591510         -0.03257940
          4.13539400          0.03225140         -0.02261340          0.01360090         -0.13130910
          1.48125600          0.09834640         -0.06968340          0.03206280         -0.68095730
          0.60213600          0.23180240         -0.25511460          0.62952610         -0.34919830
          0.25563600          0.34124360         -0.36077860          0.17326490          1.39374620
          0.11115100          0.29329830          0.06123950         -0.89178530         -0.35297960
          0.04764800          0.16959510          0.29599380         -0.35355500         -0.77473540
          0.01667700          0.15075690          0.66292780          0.84690410          0.57687380
  1  2  2  4  3
          1.20000000          0.08034580         -0.12246280          0.51304620
          0.42000000          0.42193580         -0.56047330          0.50979380
          0.14700000          0.46391670         -0.08942600         -1.31899900
          0.05145000          0.28557340          0.90159380          0.86638550
  1  3  3  3  2
          0.85000000          0.18252190         -0.47733130
          0.34000000          0.39464530         -0.65781140
          0.13600000          0.61043750          0.95136720
# CARBON      (14s,9p,4d,3f) -> [5s,4p,3d,2f]
C  Roos-ATZ-ANO
  4
  1  0  0 14  5
      50557.50100000          0.00005530         -0.00001200          0.00001190         -0.00001560          0.00001740
       7524.78560000          0.00043430         -0.00009400          0.00009270         -0.00011400          0.00012320
       1694.32760000          0.00231590         -0.00050280          0.00049890         -0.00067310          0.00076340
        472.82279000          0.00987290         -0.00214760          0.00211800         -0.00253230          0.00270030
        151.71075000          0.03521950         -0.00779420          0.00777840         -0.01090030          0.01267800
         53.91874600          0.10419380         -0.02376340          0.02363280         -0.02778070          0.03028660
         20.65931100          0.24127410         -0.06002350          0.06163060         -0.09587130          0.12014640
          8.38397600          0.38401740         -0.11539850          0.11896800         -0.12478060          0.12427730
          3.57701500          0.30823710         -0.15390090          0.18806210         -0.39324600          0.55304310
          1.54711800          0.06830550         -0.01459460         -0.05403040          0.67960040         -1.66049700
          0.61301300          0.00077820          0.38958490         -0.98141370          1.19786900          0.21977070
          0.24606800          0.00099050          0.53972910         -0.10967580         -1.89795200          2.65683290
          0.09908700         -0.00008930          0.18840600          0.88473560         -0.00446140         -3.59655600
          0.03468000          0.00004710          0.02585750          0.29649830          1.01421480          1.85211290
  1  1  1  9  4
         83.33315500          0.00122410         -0.00114440          0.00146690         -0.00372130
         19.55761100          0.00943890         -0.00897960          0.01445530         -0.03798440
          6.08036500          0.04177440         -0.03784560          0.04663730         -0.16980420
          2.17931700          0.13183300         -0.12927080          0.23665370         -0.81141520
          0.86515000          0.27891190         -0.37840220          0.60887340          0.24217300
          0.36194400          0.36686630         -0.26921370         -0.39177930          1.30306730
          0.15474000          0.27905910          0.29175420         -0.87002290         -1.20014200
          0.06542900          0.13804810          0.54366980          0.42005050         -0.09054520
          0.02290000          0.03419500          0.26283080          0.57994970          0.56980090
  1  2  2  4  3
          1.90000000          0.09873120         -0.14550130          0.56376830
          0.66500000          0.45296610         -0.50768090          0.43125920
          0.23275000          0.43624570         -0.10156300         -1.27799800
          0.08146300          0.27192500          0.92519220          0.83542050
  1  3  3  3  2
          1.25000000          0.31136500         -0.50413800
          0.50000000          0.51596730         -0.43737190
          0.20000000          0.37742310          1.01472460
# NITROGEN    (14s,9p,4d,3f) -> [5s,4p,3d,2f]
N  Roos-ATZ-ANO
  4
  1  0  0 14  5
      74761.71500000          0.00005020         -0.00001120          0.00000970         -0.00001210          0.00001870
      11123.65400000          0.00039460         -0.00008780          0.00007650         -0.00009030          0.00012930
       2512.68570000          0.00208850         -0.00046670          0.00040480         -0.00051790          0.00082180
        703.77729000          0.00890790         -0.00199310          0.00173980         -0.00200460          0.00277580
        225.47879000          0.03208840         -0.00730330          0.00634560         -0.00836000          0.01376940
         79.61581000          0.09744740         -0.02282590          0.02014050         -0.02274400          0.03116420
         30.23728300          0.23178950         -0.05922070          0.05240310         -0.07448660          0.13563680
         12.26362200          0.37769110         -0.11561210          0.10665170         -0.11086000          0.13557620
          5.26508600          0.31879170         -0.15650830          0.15833880         -0.29833890          0.66633410
          2.33347100          0.08237820         -0.02310580         -0.00500510          0.32128220         -1.62494200
          0.90185600          0.00279050          0.37564760         -0.84187200          1.17102980         -0.38598650
          0.35833600          0.00024650          0.54576530         -0.15905630         -0.86495620          3.23066540
          0.14109300         -0.00002890          0.21035430          0.59120260         -1.22379300         -3.51745000
          0.04938300          0.00000970          0.01278950          0.57660530          1.44458050          1.52006560
  1  1  1  9  4
        126.66657000          0.00114230         -0.00095650          0.00142010         -0.00270580
         29.83738900          0.00895910         -0.00757630          0.01254390         -0.03026210
          9.39403800          0.04053750         -0.03369470          0.05099130         -0.11909920
          3.40510400          0.12949010         -0.11334370          0.20571180         -0.62785490
          1.35000000          0.27678080         -0.30554980          0.54520410         -0.21161480
          0.55769600          0.36888890         -0.27339530         -0.15225420          1.40746300
          0.23244900          0.29346190          0.20192520         -0.83771660         -0.66666490
          0.09426400          0.12846830          0.49253440          0.04965950         -0.68070720
          0.03299200          0.03905860          0.40980120          0.74594410          0.74984860
  1  2  2  4  3
          2.75000000          0.12053068         -0.17333210          0.61298904
          0.96250000          0.50760685         -0.47399030          0.31696608
          0.33687500          0.44539556          0.03678810         -1.21666300
          0.11790600          0.15876917          0.89316126          0.87035573
  1  3  3  3  2
          1.80000000          0.33068755         -0.76707010
          0.72000000          0.55560706         -0.01115110
          0.28800000          0.30748869          0.80193318
# OXYGEN      (14s,9p,4d,3f) -> [5s,4p,3d,2f]
O  Roos-ATZ-ANO
  4
  1  0  0 14  5
     105374.95000000          0.00004590         -0.00001050          0.00000900         -0.00001090          0.00001810
      15679.24000000          0.00036070         -0.00008250          0.00007050         -0.00008220          0.00012130
       3534.54470000          0.00191980         -0.00044120          0.00037570         -0.00046750          0.00080930
        987.36516000          0.00820670         -0.00188640          0.00161460         -0.00184650          0.00257700
        315.97875000          0.02972570         -0.00695400          0.00593400         -0.00755850          0.01377940
        111.65428000          0.09045580         -0.02172080          0.01878660         -0.02108680          0.02811120
         42.69945100          0.21740540         -0.05685130          0.04946830         -0.06675110          0.13747540
         17.39559600          0.36876570         -0.11396350          0.10303990         -0.10936730          0.12206900
          7.43830900          0.33727980         -0.16202010          0.16205860         -0.27314310          0.73734930
          3.22286200          0.09675050         -0.03338000          0.00093670          0.20971370         -1.70575100
          1.25387700          0.00256740          0.36550680         -0.82242510          1.20348070         -0.35040600
          0.49515500          0.00137460          0.55200310         -0.10179020         -0.67746940          3.14299460
          0.19166500         -0.00014100          0.22363930          0.42539390         -1.42988400         -3.34748100
          0.06708300          0.00006830          0.00657450          0.68770280          1.48910680          1.40123750
  1  1  1  9  4
        200.00000000          0.00089330         -0.00083840          0.00126180         -0.00195280
         46.53336700          0.00736900         -0.00684910          0.01116280         -0.02434040
         14.62180900          0.03493920         -0.03285050          0.05183160         -0.09447540
          5.31306400          0.11529850         -0.11000600          0.19788450         -0.54898560
          2.10252500          0.25832310         -0.31352630          0.57076520         -0.34954760
          0.85022300          0.36962310         -0.31960110         -0.17892910          1.46590890
          0.33759700          0.32387890          0.22172430         -0.89820770         -0.75718940
          0.12889200          0.14679890          0.56226160          0.26666430         -0.59056730
          0.04511200          0.03361270          0.30132510          0.62589940          0.79593210
  1  2  2  4  3
          3.75000000          0.12849340         -0.21820550          0.62420930
          1.31250000          0.52118840         -0.48176950          0.24030630
          0.45937500          0.43457840          0.13575950         -1.18364200
          0.16078100          0.14574090          0.82977340          0.92087220
  1  3  3  3  2
          2.35000000          0.36341110         -0.88354060
          0.94000000          0.56215550          0.22624080
          0.37600000          0.26352790          0.67223250
# FLUORINE    (14s,9p,4d,3f) -> [5s,4p,3d,2f]
F  Roos-ATZ-ANO
  4
  1  0  0 14  5
     103109.46000000          0.00006370         -0.00001480          0.00001510         -0.00001540          0.00002450
      15281.00700000          0.00050280         -0.00011720          0.00011870         -0.00011600          0.00016930
       3441.53920000          0.00266770         -0.00062390          0.00063630         -0.00065960          0.00108910
        967.09483000          0.01120030         -0.00262800          0.00265990         -0.00255000          0.00356210
        314.03534000          0.03909800         -0.00935030          0.00960680         -0.01023610          0.01777030
        113.44230000          0.11226570         -0.02784900          0.02843360         -0.02676290          0.03582820
         44.64472700          0.24720420         -0.06768800          0.07198310         -0.08293450          0.16274940
         18.94287400          0.36803450         -0.12305420          0.13103930         -0.11416490          0.12263700
          8.53274300          0.29086170         -0.15221800          0.20316170         -0.31608660          0.80374170
          3.91940100          0.07810240         -0.00757940         -0.09159900          0.44872390         -2.23161400
          1.56815700          0.00354030          0.37593130         -1.00702500          1.16053510          0.63328330
          0.62329000          0.00091570          0.54384820          0.01746270         -1.36957000          2.29000020
          0.24086100          0.00007650          0.21277460          0.74900270         -0.60414010         -3.12315900
          0.08430100          0.00002050          0.00664220          0.34476920          1.29671020          1.53811960
  1  1  1  9  4
        245.33029000          0.00098800         -0.00097930          0.00140030         -0.00214470
         56.91900500          0.00829110         -0.00834100          0.01356230         -0.02797690
         17.60456800          0.04073900         -0.04074570          0.06060520         -0.11268560
          6.27499500          0.13533040         -0.14552660          0.26782200         -0.68476350
          2.44703000          0.28096370         -0.35562750          0.58183690          0.02453600
          0.99506000          0.35883510         -0.25371630         -0.42803960          1.38243700
          0.40397300          0.30381120          0.28087000         -0.79915710         -1.14451700
          0.15481000          0.13893790          0.56520350          0.46852140         -0.20204710
          0.05418400          0.02581860          0.23237080          0.48624410          0.68548720
  1  2  2  4  3
          5.00000000          0.13035590         -0.28336550          0.64835310
          1.75000000          0.52550550         -0.53295890          0.08528130
          0.61250000          0.44216400          0.33934740         -1.07624500
          0.21437500          0.12327470          0.67721890          1.00032870
  1  3  3  3  2
          3.20000000          0.35649820         -0.89941610
          1.28000000          0.58411540          0.26248020
          0.51200000          0.24042220          0.65173540
# NEON        (14s,9p,4d,3f) -> [5s,4p,3d,2f]
NE Roos-ATZ-ANO
  4
  1  0  0 14  5
     166165.08000000          0.00004720         -0.00001110          0.00001380         -0.00001340          0.00001870
      23107.52400000          0.00040070         -0.00009420          0.00011550         -0.00010150          0.00013780
       5060.15390000          0.00219320         -0.00051800          0.00064920         -0.00065470          0.00092610
       1384.61230000          0.00958760         -0.00226650          0.00276320         -0.00232050          0.00310600
        436.51258000          0.03507340         -0.00845930          0.01073360         -0.01138250          0.01639810
        153.47148000          0.10465170         -0.02604860          0.03183250         -0.02534250          0.03407520
         59.38908700          0.23771230         -0.06535970          0.08719600         -0.10583830          0.16092110
         24.86196700          0.36960610         -0.12226570          0.15298110         -0.09837220          0.13776010
         11.01570400          0.30616090         -0.15857100          0.28479790         -0.52302700          0.88474080
          4.96517500          0.08419850         -0.00602870         -0.19295490          1.12262340         -2.83224200
          1.93650300          0.00370350          0.38289570         -1.32258800          0.49014010          2.19101090
          0.76572800          0.00096540          0.53886490          0.49012790         -1.73790500          0.44521020
          0.29553800          0.00005400          0.21144870          0.75461750          0.39778720         -2.20758300
          0.10343800          0.00002680          0.00280490          0.06136710          0.89004130          1.52725550
  1  1  1  9  4
        234.94500000          0.00158260         -0.00221020          0.00339890         -0.00759070
         55.07738500          0.01257670         -0.01851140          0.03630470         -0.04185460
         17.38954900          0.05698650         -0.08152120          0.14392890         -0.43275860
          6.38953700          0.16812300         -0.29235700          0.73364640         -0.77251740
          2.54208200          0.30738600         -0.54030600         -0.10766930          2.10381540
          1.03376400          0.35831120          0.09151550         -1.21431500         -1.59728600
          0.41878800          0.27869380          0.60908800          0.64108330         -0.00261610
          0.16462700          0.09521110          0.24352740          0.35686170          0.63860640
          0.05761900          0.00210200          0.00713030          0.01895010         -0.00225460
  1  2  2  4  3
          6.42000000          0.13708560         -0.42047260          0.74155800
          2.24700000          0.54471000         -0.55929570         -0.34783030
          0.78645000          0.44972740          0.70000990         -0.65982570
          0.27525750          0.06537090          0.33900230          1.02106730
  1  3  3  3  2
          4.19000000          0.34597040         -0.93628700
          1.67600000          0.61486820          0.33666420
          0.67040000          0.20832290          0.60353970
# SODIUM      (17s,12p,5d,4f) -> [6s,5p,3d,2f]
NA Roos-ATZ-ANO
  4
  1  0  0 17  6
     138773.72000000          0.00007636         -0.00001870          0.00000255         -0.00000230          0.00000364         -0.00000170
      20325.89900000          0.00052939         -0.00012910          0.00001760         -0.00001600          0.00002582         -0.00001000
       5878.60490000          0.00183722         -0.00045110          0.00006160         -0.00005530          0.00008615         -0.00004890
       2015.43730000          0.00653431         -0.00159820          0.00021769         -0.00019860          0.00032753         -0.00012770
        739.62658000          0.02092231         -0.00521350          0.00071184         -0.00063400          0.00100249         -0.00077750
        280.82116000          0.06426610         -0.01627270          0.00221369         -0.00199710          0.00347727         -0.00272200
        108.71501000          0.17089923         -0.04645830          0.00632867         -0.00546590          0.00977528         -0.01681110
         42.60157200          0.35610342         -0.11144450          0.01509121         -0.01276240          0.02880208         -0.07091840
         16.82981700          0.40213461         -0.18537340          0.02530901         -0.01876960          0.05266945         -0.23941720
          6.68644860          0.12746393         -0.06005440          0.00808949         -0.00747550          0.02852077         -0.06083470
          2.66748770          0.00061064          0.35924086         -0.05305070          0.03897469         -0.18124290          0.78439608
          1.06746210          0.00338457          0.57207971         -0.11164110          0.08327536         -0.14683560          0.84719710
          0.42818910         -0.00132870          0.22321420         -0.13831340          0.20560497         -0.33984270         -2.03625300
          0.17208010          0.00085748         -0.00502860         -0.02990100         -0.04683150          0.65955083         -0.24226820
          0.06925880         -0.00047610          0.00595957          0.44900485         -0.79823140          1.85913770          2.35803770
          0.02790920          0.00022186         -0.00253770          0.47484493         -0.57595290         -3.55761200         -2.25578000
          0.01116330         -0.00006380          0.00078635          0.22905052          1.44086540          1.88655310          0.90445966
  1  1  1 12  5
        383.79172000          0.00102867         -0.00011860          0.00015162         -0.00018580          0.00002038
         94.39807200          0.00743093         -0.00086340          0.00110681         -0.00115460         -0.00049790
         32.36150700          0.03273646         -0.00379970          0.00487773         -0.00606080          0.00196514
         12.05435200          0.11687036         -0.01384260          0.01792042         -0.01828510         -0.00087320
          4.64171860          0.27753763         -0.03315040          0.04350073         -0.05598100          0.05166830
          1.81728760          0.39800015         -0.04899740          0.06554272         -0.05672000         -0.01024290
          0.71827120          0.32331086         -0.04658270          0.07245938         -0.15067210          0.47624183
          0.28558030          0.09433492         -0.03024570          0.09073829         -0.00335500         -0.88974630
          0.11399470          0.00109373          0.22294313         -0.76763740          1.54882680         -0.26055090
          0.04562920          0.00178158          0.50923252         -0.39771490         -1.89946400          1.90119440
          0.01830100         -0.00069800          0.37196823          0.92303779          0.39892154         -2.63448100
          0.00732040          0.00022539          0.04475107          0.17065606          0.64929030          1.68088220
  1  2  2  5  3
          0.86260360          0.02177426         -0.01348600          0.02840092
          0.34514180         -0.00721860         -0.00299870         -0.20618900
          0.13809690          0.33517471         -0.46667530         -1.21588300
          0.05525480          0.36379749         -0.62374900          1.83133530
          0.02210190          0.49254995          1.10909490         -0.92087030
  1  3  3  4  2
          0.32814490          0.01063271         -0.03833350
          0.15734730         -0.49599110         -0.30098330
          0.07544890         -0.26287320         -0.64602910
          0.03017960         -0.47485960          1.12421000
# MAGNESIUM   (17s,12p,5d,4f) -> [6s,5p,3d,2f]
MG Roos-ATZ-ANO
  4
  1  0  0 17  6
     169973.87000000          0.00007417         -0.00001880          0.00000379         -0.00000440          0.00000684         -0.00000710
      24699.06600000          0.00051736         -0.00013060          0.00002638         -0.00003080          0.00004631         -0.00004210
       7175.48510000          0.00177276         -0.00045010          0.00009109         -0.00010460          0.00016849         -0.00019220
       2478.79200000          0.00623864         -0.00157940          0.00031906         -0.00037490          0.00054725         -0.00044000
        917.73259000          0.01976587         -0.00509070          0.00103163         -0.00118030          0.00193137         -0.00229800
        351.75140000          0.06017463         -0.01575210          0.00318903         -0.00375480          0.00545737         -0.00428070
        137.51557000          0.16016295         -0.04484030          0.00913931         -0.01046200          0.01729461         -0.02100840
         54.43028600          0.33917581         -0.10853870          0.02227591         -0.02638960          0.03812473         -0.02842980
         21.72256900          0.40883352         -0.18759800          0.03965557         -0.04506790          0.07914147         -0.10871400
          8.71944840          0.15183413         -0.08683860          0.01868253         -0.02557030          0.01594961          0.06640619
          3.51471660          0.00195927          0.33464216         -0.08001640          0.10765675         -0.13968240         -0.01738970
          1.42121320          0.00418518          0.59813818         -0.18827570          0.21164824         -0.53435960          1.14513150
          0.57607650         -0.00187660          0.23180428         -0.21162620          0.43129749         -0.28133200         -1.77632600
          0.23395250          0.00120338         -0.00693860          0.14066560         -0.96823710          3.08684680         -0.12364070
          0.09515600         -0.00067450          0.00680179          0.68477064         -0.97343960         -3.53760100          3.00224390
          0.03875100          0.00031460         -0.00280300          0.34545022          1.46805860          1.02585020         -4.22933300
          0.01550040         -0.00008880          0.00083003          0.00874972          0.09800990          0.56587909          2.41537470
  1  1  1 12  5
        557.13078000          0.00079833         -0.00016120          0.00013230         -0.00021600          0.00031544
        135.48388000          0.00589231         -0.00119310          0.00094881         -0.00048420          0.00072367
         47.21295800          0.02583591         -0.00524640          0.00431193         -0.00750940          0.01089367
         18.00095500          0.09406296         -0.01931180          0.01513244         -0.00373040          0.00243732
          7.11466070          0.24134480         -0.05049450          0.04187188         -0.07988840          0.12540044
          2.86302400          0.38746464         -0.08296280          0.06595574          0.01126479          0.01067632
          1.16401850          0.35595067         -0.08827490          0.09294055         -0.56057880          1.09323020
          0.47630470          0.12288168         -0.03970790          0.05017503          0.66659154         -3.22292200
          0.19573560          0.00380787          0.42165449         -0.75622220          1.23752910          3.64862140
          0.08067830          0.00230283          0.58978450         -0.18127870         -2.36745000         -2.39119800
          0.03332660         -0.00085890          0.10380275          1.03897020          1.29736030          0.71760597
          0.01333060          0.00027579          0.00502440          0.09524704          0.07151495          0.17597721
  1  2  2  5  3
          1.04456440          0.01605667         -0.04289690          0.20912538
          0.48574730          0.02264646          0.18907793         -0.90436520
          0.22588410          0.46449386          0.77129122         -0.29454590
          0.10504150          0.47219231         -0.32119970          1.57346520
          0.04201660          0.16336646         -0.76069020         -1.16827500
  1  3  3  4  2
          0.49952380          0.00588707         -0.30407460
          0.28386680         -0.51196050         -1.11399300
          0.16131440         -0.46978720          1.10670980
          0.06452580         -0.11745110          0.30597008
# ALUMINUM    (17s,12p,5d,4f) -> [6s,5p,3d,2f]
AL Roos-ATZ-ANO
  4
  1  0  0 17  6
     208459.49000000          0.00007078         -0.00001840          0.00000432         -0.00000430          0.00000648         -0.00000780
      29971.59800000          0.00049759         -0.00012920          0.00003029         -0.00003050          0.00004502         -0.00004730
       8764.45650000          0.00167444         -0.00043710          0.00010265         -0.00010220          0.00015532         -0.00021000
       3060.70730000          0.00580246         -0.00151200          0.00035421         -0.00035890          0.00052217         -0.00047560
       1147.49630000          0.01811648         -0.00479430          0.00112743         -0.00111920          0.00171468         -0.00243970
        445.75595000          0.05440537         -0.01462910          0.00343446         -0.00348670          0.00506469         -0.00446160
        176.70642000          0.14492054         -0.04143990          0.00980341         -0.00974050          0.01501684         -0.02177380
         70.94362000          0.31321200         -0.10118870          0.02408671         -0.02459030          0.03577722         -0.03013250
         28.72400000          0.41334250         -0.18447700          0.04527494         -0.04498180          0.07132737         -0.11759120
         11.69892300          0.19059653         -0.12273700          0.03095121         -0.03404100          0.04282415          0.04163135
          4.78536970          0.00707487          0.27348316         -0.07575180          0.08910950         -0.13355890         -0.03258050
          1.96375180          0.00484032          0.61530733         -0.22480450          0.22809994         -0.44484980          1.22705040
          0.80785940         -0.00233010          0.28146024         -0.25485420          0.38525013         -0.52149340         -1.45069000
          0.33299060          0.00153518         -0.00503600          0.20149503         -0.80088860          2.94805910         -1.20188000
          0.13746930         -0.00086880          0.00796206          0.68310534         -0.99962600         -2.57699600          4.27550510
          0.05682380          0.00040223         -0.00353640          0.30782923          1.19801100         -0.19367300         -4.77835900
          0.02272950         -0.00011120          0.00100247          0.02408008          0.36451428          1.10610360          2.32923960
  1  1  1 12  5
        677.76458000          0.00079717         -0.00013730          0.00015515         -0.00016860          0.00036347
        164.83442000          0.00589941         -0.00101230          0.00113147         -0.00108570          0.00162437
         57.68342400          0.02586307         -0.00449520          0.00508163         -0.00558830          0.01256209
         22.10867400          0.09471373         -0.01657140          0.01841598         -0.01713210          0.02439129
          8.78775140          0.24484796         -0.04414490          0.05014804         -0.05622460          0.13515491
          3.55708740          0.39837993         -0.07248030          0.08138367         -0.07224890          0.06998835
          1.45487800          0.35294610         -0.07465500          0.09799899         -0.16960580          0.56219989
          0.59893630          0.10280005          0.01880214         -0.01844020          0.10547020         -1.54752200
          0.24763730          0.00234580          0.27739515         -0.62774810          1.09587210          0.33806270
          0.10269950          0.00175805          0.44207475         -0.24598520         -0.80230420          1.69032720
          0.04268530         -0.00053410          0.29055057          0.35129892         -0.92384590         -2.21506500
          0.01707410          0.00019528          0.16625332          0.65543563          1.16081480          1.10120160
  1  2  2  5  3
          1.26731440          0.01856849         -0.00676530          0.15132202
          0.50951300          0.11745821          0.20578256         -0.90596570
          0.20484530          0.50149748          0.54053298         -0.04591540
          0.08235630          0.37968233         -0.08920980          1.26723600
          0.03294250          0.20021391         -0.87110670         -0.98171750
  1  3  3  4  2
          0.56231110          0.08418120         -0.20789430
          0.27076610          0.45945383         -0.40496500
          0.13038030          0.38017523         -0.17522960
          0.05215210          0.29286740          0.97536728
# SILICON     (17s,12p,5d,4f) -> [6s,5p,3d,2f]
SI Roos-ATZ-ANO
  4
  1  0  0 17  6
     250095.97000000          0.00006815         -0.00001820          0.00000470         -0.00000490          0.00000688         -0.00000870
      35803.20000000          0.00048017         -0.00012780          0.00003305         -0.00003480          0.00004735         -0.00005180
      10522.48300000          0.00159626         -0.00042650          0.00011064         -0.00011490          0.00016522         -0.00023760
       3701.77450000          0.00547507         -0.00146180          0.00037778         -0.00040070          0.00053088         -0.00049020
       1399.39330000          0.01693706         -0.00458450          0.00119120         -0.00123290          0.00179852         -0.00273600
        548.38895000          0.05041784         -0.01387010          0.00359228         -0.00382010          0.00503523         -0.00444650
        219.36269000          0.13450267         -0.03917820          0.01024273         -0.01061380          0.01559960         -0.02415990
         88.88225900          0.29476401         -0.09635060          0.02530364         -0.02708780          0.03568620         -0.03015270
         36.32337700          0.41279726         -0.18176200          0.04932521         -0.05122020          0.07863781         -0.13753650
         14.93346300          0.21885760         -0.14523390          0.04049616         -0.04663010          0.04948931          0.04506541
          6.16634850          0.01352631          0.22989807         -0.06985640          0.09190140         -0.11137450         -0.07232060
          2.55455650          0.00478761          0.62379847         -0.25411200          0.26901327         -0.55229290          1.49441380
          1.06095070         -0.00235090          0.31543582         -0.28611330          0.46077703         -0.38840900         -2.00225000
          0.44150240          0.00157700         -0.00276260          0.24639415         -1.05620100          2.95347820         -0.52493620
          0.18401680         -0.00091180          0.00903722          0.68019181         -0.78471120         -2.85560200          3.77092740
          0.07679620          0.00041644         -0.00390620          0.28966706          1.20426300          0.09215286         -4.55747700
          0.03071850         -0.00011400          0.00111144          0.02414823          0.29679859          1.03482600          2.28671740
  1  1  1 12  5
        843.53382000          0.00074369         -0.00015740          0.00016602         -0.00019250          0.00040030
        204.90726000          0.00552015         -0.00116560          0.00119789         -0.00115190          0.00205111
         72.24878700          0.02411287         -0.00515290          0.00545750         -0.00647660          0.01387012
         27.96136500          0.08883573         -0.01917230          0.01962832         -0.01827540          0.03298719
         11.23228200          0.23494251         -0.05231320          0.05586579         -0.06800600          0.15230781
          4.59693730          0.39732250         -0.09000870          0.09197956         -0.07758320          0.11866287
          1.90148330          0.36181185         -0.09250120          0.11503921         -0.21432990          0.47363973
          0.79178280          0.10524773          0.03870909         -0.06483660          0.25572048         -1.68302500
          0.33116620          0.00256555          0.34152769         -0.68318220          1.07773340          0.83716261
          0.13894230          0.00177329          0.46110561         -0.16360950         -1.24468400          1.19892260
          0.05842570         -0.00045410          0.25855921          0.61750164         -0.38355030         -2.07338700
          0.02337030          0.00017881          0.07566560          0.44097775          1.02251980          1.18870140
  1  2  2  5  3
          2.01053330          0.02221051         -0.00195270          0.13166768
          0.79109810          0.10356980          0.15356092         -0.66150530
          0.31127870          0.50813164          0.48959332         -0.45910920
          0.12248090          0.35117535          0.11387560          1.54430360
          0.04899240          0.25071127         -0.98489900         -0.99944500
  1  3  3  4  2
          0.71849250          0.11009981         -0.17967440
          0.34744460          0.46295659         -0.23375030
          0.16801530          0.32345259         -0.47263890
          0.06720610          0.34355047          1.10869610
# PHOSPHORUS  (17s,12p,5d,4f) -> [6s,5p,3d,2f]
P  Roos-ATZ-ANO
  4
  1  0  0 17  6
     296647.55000000          0.00006562         -0.00001780          0.00000495         -0.00000380          0.00000594         -0.00000860
      42380.03000000          0.00046254         -0.00012560          0.00003483         -0.00002680          0.00004144         -0.00005490
      12503.85600000          0.00152412         -0.00041530          0.00011560         -0.00008660          0.00013959         -0.00021710
       4422.49370000          0.00518926         -0.00141400          0.00039175         -0.00030500          0.00046280         -0.00056060
       1681.84780000          0.01595159         -0.00440030          0.00122727         -0.00091310          0.00148861         -0.00240580
        663.21490000          0.04720087         -0.01323730          0.00367506         -0.00287280          0.00434089         -0.00514180
        267.00585000          0.12619981         -0.03733840          0.01047976         -0.00779880          0.01277688         -0.02090760
        108.89592000          0.27982529         -0.09244400          0.02602575         -0.02049300          0.03096216         -0.03617190
         44.79731400          0.41030382         -0.17908160          0.05218594         -0.03865600          0.06543104         -0.11613130
         18.54031200          0.24188220         -0.16174870          0.04842224         -0.04197400          0.05707014         -0.02312510
          7.70709950          0.02071709          0.19399810         -0.06270700          0.06559604         -0.09386140          0.01864200
          3.21437500          0.00443622          0.62785121         -0.27648210          0.19549449         -0.41005510          1.12156650
          1.34401270         -0.00216870          0.34320722         -0.31132840          0.38636227         -0.48607910         -0.63232570
          0.56308700          0.00148760         -0.00010200          0.27584791         -0.75348860          1.95041420         -2.92756700
          0.23628700         -0.00087720          0.00993085          0.67745539         -0.54814350         -0.29309150          5.81150950
          0.09928110          0.00039698         -0.00418080          0.28560830          0.26985002         -2.30754900         -5.02116300
          0.03971240         -0.00010790          0.00119275          0.01675006          0.97010724          1.77847660          1.92707230
  1  1  1 12  5
       1018.41220000          0.00071159         -0.00016880          0.00015264         -0.00022110          0.00040331
        247.39820000          0.00528387         -0.00125010          0.00110387         -0.00137890          0.00219003
         87.79048200          0.02297828         -0.00550960          0.00500340         -0.00741670          0.01392847
         34.24860000          0.08494327         -0.02057220          0.01814153         -0.02236340          0.03590870
         13.87701400          0.22803285         -0.05717830          0.05241729         -0.07944690          0.15612489
          5.73030980          0.39658377         -0.10153640          0.08911554         -0.10183150          0.14452546
          2.39200680          0.36766734         -0.10487000          0.10677427         -0.22045860          0.41344622
          1.00527670          0.10640781          0.05753445         -0.07211440          0.35066535         -1.65083300
          0.42439290          0.00281028          0.37524649         -0.60909640          0.97783112          0.86123612
          0.17973060          0.00165268          0.45668244         -0.16157330         -1.12189900          1.21750160
          0.07629100         -0.00040110          0.22572156          0.54191860         -0.50591410         -2.11577900
          0.03051640          0.00016315          0.06188888          0.53980064          1.02634120          1.19234360
  1  2  2  5  3
          2.72018530          0.02567866         -0.01281640          0.14954306
          1.07222220          0.12037513          0.17873934         -0.66586430
          0.42264050          0.55955359          0.50423470         -0.40061210
          0.16659330          0.37100935         -0.11770020          1.53419160
          0.06663730          0.12126366         -0.88859820         -1.09500900
  1  3  3  4  2
          0.89440190          0.17144038         -0.37580420
          0.44087230          0.50049572         -0.39497070
          0.21731660          0.37145759          0.26674267
          0.08692660          0.13902900          0.76247795
# SULFUR      (17s,12p,5d,4f) -> [6s,5p,3d,2f]
S  Roos-ATZ-ANO
  4
  1  0  0 17  6
     346348.23000000          0.00006370         -0.00001760          0.00000516         -0.00000380          0.00000585         -0.00000910
      49391.14600000          0.00044935         -0.00012410          0.00003629         -0.00002730          0.00004096         -0.00005710
      14610.99000000          0.00147142         -0.00040760          0.00011970         -0.00008760          0.00013668         -0.00023300
       5187.20950000          0.00498429         -0.00138200          0.00040336         -0.00030730          0.00045296         -0.00056250
       1980.96760000          0.01525241         -0.00427630          0.00125841         -0.00091510          0.00144216         -0.00257760
        784.63139000          0.04494424         -0.01281620          0.00374805         -0.00286710          0.00420970         -0.00506850
        317.32779000          0.12035338         -0.03610970          0.01069509         -0.00777990          0.01231522         -0.02231470
        130.01976000          0.26908335         -0.08987260          0.02665475         -0.02053900          0.03016574         -0.03570240
         53.73820800          0.40722490         -0.17728880          0.05454724         -0.03956760          0.06449660         -0.12800240
         22.34589600          0.25831856         -0.17312010          0.05462756         -0.04600480          0.06268013         -0.02145890
          9.33325120          0.02714669          0.16887115         -0.05692420          0.06098330         -0.08761680         -0.01890560
          3.91118680          0.00400872          0.63115534         -0.29658550          0.20575809         -0.39434690          1.29060600
          1.64320660         -0.00192710          0.36103178         -0.32932730          0.40570893         -0.55180690         -0.88556930
          0.69174560          0.00134644          0.00184135          0.30470795         -0.81899290          1.99993610         -2.71487600
          0.29167360         -0.00081150          0.01069710          0.67383630         -0.44471340         -0.27829840          5.68938710
          0.12314410          0.00036382         -0.00432300          0.27748421          0.18735812         -2.35282500         -4.92890200
          0.04925760         -0.00009870          0.00124248          0.01304772          1.00722580          1.79232710          1.86654110
  1  1  1 12  5
       1129.12690000          0.00077145         -0.00019700          0.00018333         -0.00028000          0.00043230
        274.03515000          0.00572945         -0.00146240          0.00130515         -0.00172590          0.00288638
         97.40258400          0.02477182         -0.00640040          0.00600239         -0.00940080          0.01459323
         38.08551800          0.09109122         -0.02387630          0.02129088         -0.02797840          0.04821802
         15.47103300          0.24064577         -0.06532010          0.06221627         -0.10067960          0.16282315
          6.40565900          0.40976882         -0.11476930          0.09978781         -0.11767160          0.20594756
          2.68128280          0.35226804         -0.10657020          0.11944864         -0.25665430          0.24014052
          1.13000500          0.08382797          0.11048130         -0.15959890          0.68243796         -1.82669700
          0.47839950          0.00271787          0.41795827         -0.67011450          0.66515564          1.80214550
          0.20318050          0.00078655          0.42517813          0.01331064         -1.44513800          0.02939534
          0.08649230          0.00011535          0.19228231          0.64871747          0.12745221         -1.46966500
          0.03459690          0.00003404          0.04207771          0.37095119          0.77294449          1.12615110
  1  2  2  5  3
          3.00536790          0.03293922         -0.03191870          0.15012046
          1.21729760          0.16386221          0.29392107         -0.82383320
          0.49305560          0.58677406          0.46210890         -0.04964110
          0.19970780          0.31916052         -0.32360540          1.32176930
          0.07988310          0.08508563         -0.75561170         -1.11803800
  1  3  3  4  2
          1.10009880          0.20845644         -0.59442000
          0.52721330          0.55071337         -0.33649890
          0.25266270          0.33354097          0.71034940
          0.10106510          0.06724721          0.35946202
# CHLORINE    (17s,12p,5d,4f) -> [6s,5p,3d,2f]
CL Roos-ATZ-ANO
  4
  1  0  0 17  6
     399432.47000000          0.00006215         -0.00001740          0.00000531         -0.00000470          0.00000595         -0.00000920
      56908.83300000          0.00043838         -0.00012290          0.00003739         -0.00003370          0.00004122         -0.00005590
      16874.76900000          0.00142781         -0.00040130          0.00012271         -0.00010830          0.00013955         -0.00024330
       6010.02780000          0.00481620         -0.00135560          0.00041159         -0.00037410          0.00044686         -0.00051850
       2303.28300000          0.01468157         -0.00417440          0.00127960         -0.00112330          0.00146844         -0.00270980
        915.65994000          0.04311398         -0.01247260          0.00379416         -0.00346090          0.00411004         -0.00455620
        371.72009000          0.11558388         -0.03510470          0.01083171         -0.00951860          0.01251189         -0.02342010
        152.89109000          0.26016348         -0.08775020          0.02707379         -0.02486630          0.02954625         -0.03194480
         63.43630300          0.40382380         -0.17564250          0.05631797         -0.04964540          0.06763368         -0.13915220
         26.48172300          0.27179877         -0.18206990          0.05980454         -0.05901320          0.06396442         -0.00532620
         11.10411200          0.03338125          0.14753370         -0.05113350          0.06729192         -0.07622940         -0.08114670
          4.67162890          0.00356211          0.63295111         -0.31267210          0.26850578         -0.44555880          1.49579950
          1.97045200         -0.00165600          0.37614178         -0.34374380          0.51536265         -0.53191500         -1.37186000
          0.83279460          0.00117962          0.00380802          0.32577967         -1.11610500          2.38922930         -2.02018700
          0.35254090         -0.00073110          0.01133746          0.66892575         -0.52914520         -1.29926400          5.24741420
          0.14943410          0.00032425         -0.00444450          0.27170146          0.76655700         -1.50478700         -4.98513400
          0.05977360         -0.00008790          0.00129047          0.01386816          0.59696595          1.65737770          2.06108180
  1  1  1 12  5
       1288.97160000          0.00078181         -0.00021070          0.00020575         -0.00031720          0.00045514
        312.24430000          0.00581729         -0.00157040          0.00146090         -0.00194620          0.00362539
        111.34634000          0.02503057         -0.00683040          0.00673436         -0.01067180          0.01501985
         43.73608700          0.09188004         -0.02552010          0.02376316         -0.03157490          0.06149816
         17.85652400          0.24258072         -0.06974890          0.07010553         -0.11574860          0.16963861
          7.43276590          0.41394424         -0.12387560          0.11161894         -0.12908650          0.28532032
          3.12825380          0.34789086         -0.10851620          0.12978530         -0.27649330          0.03758123
          1.32572140          0.07717314          0.13894281         -0.23354130          0.89183689         -1.85478400
          0.56441910          0.00312835          0.42954359         -0.67189630          0.41342424          2.43376840
          0.24107410          0.00050049          0.40829131          0.10952051         -1.53837700         -0.94026680
          0.10320890          0.00034786          0.18156256          0.66424757          0.46781029         -0.77329620
          0.04128360         -0.00002380          0.03396053          0.30179468          0.59904463          0.92109142
  1  2  2  5  3
          3.62045610          0.03682298         -0.04843800          0.16746529
          1.47757170          0.17638808          0.39297464         -0.94489600
          0.60302300          0.59139283          0.47951806          0.27892621
          0.24610430          0.30996037         -0.56212450          1.04819660
          0.09844170          0.06672018         -0.56257760         -1.12710900
  1  3  3  4  2
          1.35689640          0.22438063         -0.68736230
          0.66136460          0.56956395         -0.26104400
          0.32235560          0.30148671          0.82343588
          0.12894220          0.04940109          0.21671325
# ARGON       (17s,12p,5d,4f) -> [6s,5p,3d,2f]
AR Roos-ATZ-ANO
  4
  1  0  0 17  6
     455476.77000000          0.00006096         -0.00001730          0.00000544         -0.00000530          0.00000579         -0.00001010
      64817.74300000          0.00043020         -0.00012220          0.00003829         -0.00003750          0.00003978         -0.00005880
      19256.98700000          0.00139466         -0.00039690          0.00012513         -0.00012020          0.00013641         -0.00027260
       6877.00730000          0.00468779         -0.00133670          0.00041795         -0.00041340          0.00042380         -0.00051080
       2643.48770000          0.01424066         -0.00409860          0.00129572         -0.00123820          0.00143205         -0.00305700
       1054.23750000          0.04169365         -0.01221340          0.00382578         -0.00379760          0.00386068         -0.00436370
        429.37122000          0.11183053         -0.03433220          0.01092652         -0.01045540          0.01216691         -0.02637120
        177.18859000          0.25298878         -0.08610070          0.02735689         -0.02735260          0.02778303         -0.03036920
         73.76394500          0.40044790         -0.17427680          0.05765806         -0.05546770          0.06724781         -0.16095030
         30.89700700          0.28245090         -0.18902660          0.06394978         -0.06865230          0.06200867          0.01248080
         12.99948200          0.03906305          0.13009718         -0.04572820          0.07055596         -0.06041520         -0.15431860
          5.48767930          0.00314565          0.63399171         -0.32577250          0.30115546         -0.46387010          1.83591150
          2.32257160         -0.00139160          0.38815020         -0.35331040          0.61789886         -0.49311320         -2.05303400
          0.98498070          0.00101034          0.00573222          0.33817566         -1.43377400          2.41394970         -1.20832800
          0.41839730         -0.00064850          0.01193554          0.66223091         -0.27094710         -1.53597500          4.63521250
          0.17795940          0.00028402         -0.00449410          0.27636906          0.77596409         -1.27729400         -4.69611700
          0.07118380         -0.00007710          0.00131952          0.00949692          0.50334371          1.63788950          1.98829450
  1  1  1 12  5
       1462.49620000          0.00078756         -0.00022120          0.00029752         -0.00045430          0.00038932
        354.06731000          0.00586048         -0.00165140          0.00201545         -0.00318150          0.00580901
        126.69779000          0.02510137         -0.00713990          0.00979652         -0.01511580          0.01133247
         49.98909500          0.09200774         -0.02671710          0.03265686         -0.05279920          0.10360929
         20.50929500          0.24317197         -0.07307220          0.10366041         -0.17027200          0.13463887
          8.58046410          0.41674542         -0.13132950          0.14799999         -0.23127500          0.54075660
          3.63010490          0.34542045         -0.10964210          0.20744830         -0.20352810         -0.95625510
          1.54652800          0.07305360          0.16048636         -0.50796850          1.74529250         -0.50691800
          0.66193690          0.00294397          0.43595556         -0.80424020         -1.39630300          2.32780040
          0.28424280         -0.00023940          0.40458441          0.69669502         -0.47271850         -2.63217100
          0.12234630          0.00028995          0.17125106          0.46331690          0.89125570          1.09251950
          0.04893850         -0.00009340          0.01351308          0.04908714          0.06889766          0.35266723
  1  2  2  5  3
          4.32884170          0.04003444         -0.05753400          0.16735357
          1.77423020          0.18334334          0.42320227         -0.96674040
          0.72719060          0.59072873          0.45075094          0.33376377
          0.29804820          0.30437283         -0.56963190          1.00414720
          0.11921930          0.06258812         -0.55102580         -1.11944400
  1  3  3  4  2
          1.63117400          0.23597497         -0.76592680
          0.82032880          0.57618801         -0.17377420
          0.41254910          0.27800823          0.84810472
          0.16501960          0.04019225          0.16638315
# SCANDIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
SC Roos-ATZ-ANO
  5
  1  0  0 21  8
    2715278.00000000          0.00000900         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
     406598.40000000          0.00007030         -0.00002060          0.00000730         -0.00000180          0.00000260         -0.00000380          0.00000510          0.00000000
      92530.04000000          0.00036940         -0.00010830          0.00003810         -0.00000940          0.00001340         -0.00001890          0.00002330         -0.00000320
      26207.92000000          0.00155730         -0.00045720          0.00016110         -0.00003970          0.00005780         -0.00008580          0.00011740         -0.00001470
       8549.42900000          0.00563820         -0.00166130          0.00058530         -0.00014420          0.00020370         -0.00028470          0.00033930         -0.00004710
       3085.97500000          0.01806450         -0.00537480          0.00189710         -0.00046690          0.00068540         -0.00103110          0.00144770         -0.00017810
       1203.17200000          0.05144550         -0.01567320          0.00554030         -0.00136660          0.00191410         -0.00262930          0.00299550         -0.00042980
        498.48690000          0.12707080         -0.04083870          0.01453930         -0.00358060          0.00531270         -0.00814650          0.01185640         -0.00142260
        216.73600000          0.25490550         -0.09186680          0.03306540         -0.00818040          0.01128470         -0.01500180          0.01553210         -0.00240110
         97.87476000          0.36017450         -0.16483380          0.06115120         -0.01512000          0.02309850         -0.03719520          0.05878880         -0.00667270
         45.20433000          0.26994140         -0.18091270          0.07020760         -0.01759940          0.02223440         -0.02357950          0.00528310         -0.00314330
         20.21187000          0.06163750          0.05165400         -0.02111350          0.00550800          0.00012430         -0.02279820          0.09434560         -0.00609790
          9.57475100         -0.00137010          0.50475000         -0.27065280          0.07005320         -0.12218900          0.23648630         -0.46579960          0.04625290
          4.54034600          0.00205340          0.50458120         -0.44054920          0.12312720         -0.14779690          0.13085050          0.10415480          0.01739340
          1.99568700         -0.00095410          0.09393700          0.06285390         -0.02804590         -0.03470180          0.23841110         -0.88418510          0.04824640
          0.94221500          0.00043550         -0.00297080          0.71691260         -0.24417280          0.64622190         -1.77116600          4.00662690         -0.40686840
          0.41784500         -0.00018700          0.00248250          0.44287950         -0.32519970          0.15556920          1.29776820         -4.97894900          0.46797940
          0.09576100          0.00009670         -0.00080170          0.02330730          0.35832950         -2.27616700          3.27082980          7.87419890          0.69915480
          0.05135100         -0.00009370          0.00076540         -0.01372210          0.60752200          1.15412310         -6.65044700         -9.85628200         -3.30406900
          0.02387800          0.00004130         -0.00033710          0.00463010          0.20971750          0.73089930          4.26392470          5.32791980          4.81968330
          0.00955100         -0.00000960          0.00007800         -0.00096690          0.00735930          0.10275990         -0.71246510         -1.36913800         -2.85896200
  1  1  1 15  7
       4609.88500000          0.00019180         -0.00006450          0.00001890         -0.00002410          0.00003140         -0.00000370          0.00006720
       1092.15600000          0.00168010         -0.00056470          0.00016800         -0.00021600          0.00028190         -0.00009380          0.00033050
        354.33680000          0.00927530         -0.00314160          0.00092260         -0.00117490          0.00153070         -0.00018100          0.00327360
        134.80760000          0.03752900         -0.01284830          0.00383000         -0.00492860          0.00643370         -0.00216920          0.00731900
         56.60258000          0.11490240         -0.04053780          0.01193470         -0.01520350          0.01981900         -0.00187070          0.04399470
         25.33410000          0.25439250         -0.09287680          0.02796510         -0.03616710          0.04726480         -0.01843640          0.04132910
         11.74033000          0.37991660         -0.14765040          0.04354370         -0.05550180          0.07284370          0.00517070          0.21606010
          5.56925900          0.30955560         -0.11280680          0.03528510         -0.04666140          0.06440110         -0.07381960         -0.04754280
          2.59495800          0.08713980          0.15761620         -0.06168620          0.08722140         -0.11917420          0.14285680          0.23806450
          1.19635100          0.00256100          0.47136960         -0.15801900          0.22269450         -0.38254400         -0.09680990         -2.55856900
          0.53505900          0.00122680          0.43009950         -0.22299720          0.36197370         -0.39389800          0.45403420          4.31709930
          0.22077600         -0.00047590          0.10180830          0.15843480         -0.88835790          2.19800400         -1.45299000         -3.68183000
          0.08831000          0.00022640         -0.00184220          0.70244750         -0.40959980         -2.39692000          2.62863880          2.28377620
          0.03532400         -0.00011100          0.00290250          0.28120420          0.91905930          0.89636100         -3.13249300         -1.07370600
          0.01413000          0.00003470         -0.00078270          0.01348200          0.21314870          0.35148690          1.96084820          0.28495100
  1  2  2 10  5
        110.21970000          0.00082590         -0.00072360          0.00088820         -0.00079750          0.00131880
         32.80041000          0.00668110         -0.00582090          0.00727290         -0.00574830          0.01552580
         12.31300000          0.02815940         -0.02479120          0.03053470         -0.02734940          0.04659410
          5.06381900          0.08372590         -0.07372960          0.09263050         -0.07108940          0.20849080
          2.22554700          0.17840110         -0.15786200          0.19890520         -0.19284550          0.28675450
          0.99234300          0.26729480         -0.22085100          0.26567710         -0.17873910          0.58272510
          0.43636100          0.30373220         -0.20962350          0.09014130         -0.03909720         -2.16466900
          0.18570500          0.29501850          0.05386540         -0.65848460          1.37404170          2.18450990
          0.07344100          0.19903620          0.43826460         -0.39701430         -1.98588300         -1.25616900
          0.02937600          0.09880500          0.51004480          0.89538510          1.16147000          0.44271170
  1  3  3  6  3
          2.84150000          0.03457760         -0.09573200          0.13599950
          1.12630000          0.09785270         -0.21698380          0.33213270
          0.44640000          0.34953560         -0.57644500          0.49380450
          0.17690000          0.54494830          0.14682810         -1.24770000
          0.07010000          0.23054040          0.57506500          0.81525440
          0.02780000          0.03096220          0.20992140          0.20469110
  1  4  4  4  2
          1.60710000         -0.03124780         -0.17126050
          0.63170000         -0.19912470         -0.40228810
          0.24830000         -0.43510610          0.05517030
          0.09760000         -0.16454480          0.44274080
# TITANIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
TI Roos-ATZ-ANO
  5
  1  0  0 21  8
    3014643.00000000          0.00000890         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
     451432.90000000          0.00006930         -0.00002050          0.00000730         -0.00000180          0.00000260         -0.00000530          0.00000530         -0.00000530
     102733.80000000          0.00036440         -0.00010770          0.00003850         -0.00000950          0.00001350         -0.00002630          0.00002920         -0.00003280
      29098.17000000          0.00153640         -0.00045480          0.00016260         -0.00004010          0.00005870         -0.00012000          0.00011610         -0.00011140
       9492.33000000          0.00556280         -0.00165290          0.00059090         -0.00014580          0.00020570         -0.00039620          0.00045570         -0.00053040
       3426.34600000          0.01782860         -0.00534850          0.00191600         -0.00047270          0.00069770         -0.00144350          0.00134220         -0.00122050
       1335.89600000          0.05081180         -0.01560890          0.00559920         -0.00138220          0.00193150         -0.00365790          0.00441360         -0.00535560
        553.50260000          0.12571800         -0.04072220          0.01471710         -0.00363470          0.00543140         -0.01144970          0.01006050         -0.00838210
        240.69250000          0.25299350         -0.09187640          0.03356770         -0.00830710          0.01140250         -0.02093470          0.02766260         -0.03603000
        108.72930000          0.35959430         -0.16550280          0.06237530         -0.01548490          0.02391930         -0.05291360          0.04026960         -0.02489570
         50.26457000          0.27246950         -0.18360090          0.07240540         -0.01810670          0.02240970         -0.03314180          0.07324130         -0.12295430
         22.58004000          0.06359560          0.04772320         -0.01969540          0.00495790          0.00244170         -0.03572990         -0.05679990          0.17036170
         10.71432000         -0.00122450          0.50578510         -0.27814850          0.07274550         -0.12994700          0.34737590         -0.16965990         -0.02547000
          5.09354600          0.00201170          0.50661980         -0.44779230          0.12462260         -0.14412390          0.19621750         -0.76563180          1.42375220
          2.24418300         -0.00093570          0.09464750          0.07571830         -0.03012510         -0.04266210          0.21600550          1.37733270         -3.69996800
          1.05957000          0.00042050         -0.00280280          0.72182450         -0.25472070          0.68771070         -2.54289500          0.71862210          3.42508630
          0.46884900         -0.00017760          0.00244130          0.43305370         -0.31128130          0.08970370          2.53447060         -2.56707700         -1.00954000
          0.10614300          0.00008640         -0.00072980          0.02190390          0.39641780         -2.20071600          0.65481180          5.20872300         -2.39533300
          0.05526200         -0.00008290          0.00069790         -0.01256510          0.58239440          1.16817660         -3.07838800         -5.98295700          5.66622560
          0.02546500          0.00003760         -0.00031470          0.00450140          0.19898060          0.68247570          2.18525880          1.89911920         -5.71171100
          0.01018600         -0.00000900          0.00007490         -0.00096630          0.00465100          0.09670200         -0.12137220          0.47574670          2.69579320
  1  1  1 15  7
       5181.15700000          0.00018720         -0.00006430          0.00001780         -0.00002460          0.00003720         -0.00005500          0.00003440
       1227.46100000          0.00164140         -0.00056350          0.00015780         -0.00021600          0.00030350         -0.00044230          0.00074570
        398.27120000          0.00908300         -0.00314250          0.00086990         -0.00120360          0.00181820         -0.00268410          0.00167520
        151.58670000          0.03689510         -0.01290430          0.00362100         -0.00495220          0.00694320         -0.01009190          0.01739890
         63.69633000          0.11355990         -0.04095070          0.01136290         -0.01573360          0.02391530         -0.03527760          0.01936750
         28.54733000          0.25317900         -0.09460300          0.02679910         -0.03658610          0.05029720         -0.07263650          0.14811200
         13.26129000          0.38016760         -0.15139560          0.04214160         -0.05944900          0.09593970         -0.14494120         -0.00414360
          6.31035200          0.31020000         -0.11414090          0.03368180         -0.04678460          0.05786020         -0.14247940          0.63592460
          2.95187500          0.08777410          0.16320570         -0.05898500          0.07944800         -0.08846610          0.31125940         -1.91295700
          1.36537000          0.00294910          0.47321730         -0.15122720          0.27628380         -0.65664460          1.43894680          1.31107870
          0.61141500          0.00131940          0.42451320         -0.20347950          0.27142190          0.11031280         -2.78088700          0.71779750
          0.25254800         -0.00042150          0.10183770          0.11806170         -0.79246970          1.61485710          1.85240650         -2.24014800
          0.10101900          0.00021980         -0.00167870          0.69383950         -0.46317480         -1.74849600         -0.07210230          2.90907530
          0.04040800         -0.00010630          0.00283920          0.31458520          0.84321160          0.31630340         -1.14942500         -2.70645000
          0.01616300          0.00003320         -0.00076640          0.01638690          0.29045090          0.63388040          0.97774750          1.42394160
  1  2  2 10  5
        134.35650000          0.00082950         -0.00066820          0.00107010         -0.00145030          0.00228580
         40.04189000          0.00686720         -0.00549600          0.00903560         -0.01239650          0.01652190
         15.12976000          0.02978290         -0.02413250          0.03925760         -0.05422370          0.08713510
          6.27699000          0.08973600         -0.07293950          0.12440160         -0.17800620          0.25177540
          2.78141000          0.19339830         -0.15795350          0.25010250         -0.33545420          0.54087000
          1.25360200          0.28934680         -0.21643350          0.28000330         -0.18766830         -0.64286510
          0.55740500          0.31794410         -0.18224060         -0.08899850          0.78380040         -0.80912680
          0.23975900          0.27588610          0.12624550         -0.62602520          0.22363430          1.85337250
          0.09528700          0.15938330          0.44805130         -0.24875410         -1.28760100         -1.65105200
          0.03811500          0.07054350          0.48413330          0.81573960          0.96413090          0.76643890
  1  3  3  6  3
          4.24640000          0.03908400         -0.12201770          0.23859370
          1.68310000          0.13383140         -0.36711890          0.55423570
          0.66710000          0.36510790         -0.49912310         -0.19514490
          0.26440000          0.49496780          0.25518400         -0.73517000
          0.10480000          0.25144470          0.52213820          0.65679220
          0.04150000          0.03832940          0.11207230          0.26902180
  1  4  4  4  2
          2.40170000          0.10522000         -0.38795830
          0.94400000          0.33971690         -0.55192540
          0.37100000          0.56411760          0.18037360
          0.14580000          0.28531140          0.60415490
# VANADIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
V  Roos-ATZ-ANO
  5
  1  0  0 21  8
    3321857.00000000          0.00000880         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     497435.60000000          0.00006870         -0.00002040          0.00000740         -0.00000170          0.00000330         -0.00000540          0.00000520         -0.00000680
     113202.70000000          0.00036100         -0.00010750          0.00003890         -0.00000920          0.00001660         -0.00002720          0.00002910         -0.00004150
      32063.33000000          0.00152210         -0.00045390          0.00016420         -0.00003870          0.00007310         -0.00012220          0.00011320         -0.00014450
      10459.62000000          0.00551160         -0.00165010          0.00059670         -0.00014080          0.00025210         -0.00041000          0.00045530         -0.00066690
       3775.50600000          0.01766850         -0.00534000          0.00193530         -0.00045670          0.00087230         -0.00146550          0.00130150         -0.00160130
       1472.04000000          0.05038290         -0.01559340          0.00565820         -0.00133560          0.00235840         -0.00380660          0.00443920         -0.00669230
        609.93310000          0.12480880         -0.04072340          0.01489220         -0.00351830          0.00683810         -0.01159340          0.00968600         -0.01124660
        265.26340000          0.25172610         -0.09208410          0.03404070         -0.00805470          0.01385690         -0.02209190          0.02820130         -0.04474820
        119.86070000          0.35922650         -0.16636470          0.06349340         -0.01508270          0.03069540         -0.05334350          0.03801970         -0.03654160
         55.44891000          0.27416450         -0.18580410          0.07421810         -0.01773950          0.02615090         -0.03823630          0.07857070         -0.14943220
         24.98372000          0.06486330          0.04585460         -0.01908000          0.00455360          0.00874490         -0.02907220         -0.06832350          0.19110580
         11.88056000         -0.00116620          0.50807060         -0.28571740          0.07165820         -0.17680100          0.34559820         -0.14736410          0.06905680
          5.66031100          0.00198280          0.50692040         -0.45245900          0.12029780         -0.15916140          0.25792820         -0.82902110          1.69200910
          2.49570300         -0.00092240          0.09430990          0.09007790         -0.03297310         -0.08362760          0.02175320          1.63122450         -4.96967400
          1.17786600          0.00040990         -0.00270220          0.72508740         -0.24733060          1.01147820         -2.40280600          0.23192920          5.29396380
          0.52004400         -0.00017020          0.00240070          0.42300420         -0.28548310         -0.22802420          2.70767500         -2.15214700         -2.39720300
          0.11596500          0.00007890         -0.00067900          0.02042980          0.35331150         -2.26950100         -0.25108400          4.89520660         -0.66756870
          0.05893800         -0.00007520          0.00064630         -0.01164770          0.59079650          1.60659870         -2.02543500         -5.96357100          3.38722670
          0.02694600          0.00003490         -0.00029880          0.00432260          0.22227520          0.30163730          1.79308710          2.17030290         -4.30186600
          0.01077800         -0.00000850          0.00007270         -0.00095410          0.00404190          0.13033430         -0.03372380          0.37871370          2.24684740
  1  1  1 15  7
       5777.37700000          0.00018360         -0.00006410          0.00001790         -0.00002930          0.00003760         -0.00005740          0.00004720
       1368.67400000          0.00161110         -0.00056260          0.00015830         -0.00025550          0.00031060         -0.00047960          0.00079790
        444.12330000          0.00893310         -0.00314410          0.00087600         -0.00143690          0.00184300         -0.00281000          0.00232320
        169.09910000          0.03640770         -0.01295560          0.00365290         -0.00589370          0.00715630         -0.01104480          0.01874100
         71.10191000          0.11255930         -0.04131800          0.01154370         -0.01897940          0.02447010         -0.03724580          0.02910050
         31.90311000          0.25238890         -0.09610600          0.02735360         -0.04405560          0.05280940         -0.08169560          0.15830170
         14.85109000          0.38048750         -0.15458390          0.04343200         -0.07318490          0.09891910         -0.15309860          0.05462060
          7.08522700          0.31047820         -0.11487580          0.03382940         -0.05429490          0.06201690         -0.15863690          0.54869930
          3.32442200          0.08808030          0.16825760         -0.06114900          0.10392680         -0.12794370          0.44880840         -2.07482200
          1.54116400          0.00320000          0.47522200         -0.15596350          0.35080200         -0.64800290          1.23670600          1.80041500
          0.69052000          0.00136800          0.41995650         -0.19423340          0.21455920          0.26641430         -2.69004000          0.18305780
          0.28542400         -0.00038780          0.10071520          0.12128510         -0.91179100          1.37800780          1.90754510         -1.88871400
          0.11417000          0.00021440         -0.00165100          0.68002870         -0.29944180         -1.66822500         -0.15905240          2.71073900
          0.04566800         -0.00010280          0.00277480          0.32526770          0.79383860          0.32032510         -1.09269000         -2.58362000
          0.01826700          0.00003210         -0.00074620          0.01640420          0.24053480          0.68719140          0.95690940          1.36049790
  1  2  2 10  5
        155.85270000          0.00082400         -0.00073700          0.00111480         -0.00160610          0.00235870
         46.49771000          0.00690790         -0.00615680          0.00949820         -0.01385620          0.01838360
         17.62999000          0.03046120         -0.02746690          0.04217370         -0.06229780          0.09402230
          7.35467200          0.09234490         -0.08414480          0.13485540         -0.20931580          0.30787650
          3.27405100          0.19856960         -0.18070830          0.27482530         -0.38597190          0.49646650
          1.48248200          0.29427800         -0.23594040          0.27099700         -0.04116230         -0.93727640
          0.66135100          0.31782360         -0.15454830         -0.17801220          0.90020360         -0.26353080
          0.28482600          0.27361460          0.19348160         -0.65249560         -0.17294460          1.51137020
          0.11289900          0.15457840          0.46099510         -0.03686490         -1.00120500         -1.64835400
          0.04516000          0.05137880          0.41547910          0.73380860          0.90394100          0.86279220
  1  3  3  6  3
          5.90660000          0.04103170         -0.11078580          0.24098330
          2.34120000          0.16050070         -0.38304920          0.57916150
          0.92790000          0.39186680         -0.46986320         -0.26821710
          0.36780000          0.46817410          0.29209870         -0.68232650
          0.14580000          0.23292270          0.51792180          0.64138310
          0.05780000          0.03878760          0.11509430          0.26286930
  1  4  4  4  2
          3.34060000          0.09336340         -0.34102680
          1.31300000          0.31083780         -0.51794230
          0.51610000          0.47448500          0.19167130
          0.20280000          0.23905820          0.55279660
# CHROMIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CR Roos-ATZ-ANO
  5
  1  0  0 21  8
    6177194.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000120
     924929.50000000          0.00003520         -0.00001060          0.00000380          0.00000000          0.00000160         -0.00000270          0.00000500         -0.00000570
     210486.50000000          0.00018520         -0.00005550          0.00002010         -0.00000480          0.00000920         -0.00001470          0.00002200         -0.00005680
      59620.05000000          0.00078170         -0.00023440          0.00008480         -0.00002000          0.00003570         -0.00005850          0.00011540         -0.00009070
      19450.76000000          0.00284000         -0.00085460          0.00030980         -0.00007390          0.00014470         -0.00022940          0.00031760         -0.00101630
       7022.05600000          0.00919120         -0.00277760          0.00100500         -0.00023660          0.00041230         -0.00068230          0.00144520         -0.00057270
       2738.76300000          0.02681960         -0.00823310          0.00299260         -0.00071610          0.00143310         -0.00225550          0.00281960         -0.01153910
       1135.81400000          0.07006660         -0.02215430          0.00805280         -0.00189060          0.00319370         -0.00535390          0.01243190          0.00082350
        495.09230000          0.15802290         -0.05364420          0.01974040         -0.00475090          0.00983570         -0.01532300          0.01615040         -0.09448890
        224.74870000          0.28468010         -0.11084460          0.04123840         -0.00964650          0.01526100         -0.02636230          0.07299220          0.05848110
        105.38360000          0.34784190         -0.17981180          0.06982360         -0.01712800          0.03887360         -0.05910420          0.03281590         -0.52732410
         50.19359000          0.21469600         -0.15326130          0.06194170         -0.01396960          0.01102890         -0.02750750          0.20421420          0.66490440
         22.24957000          0.03639130          0.15704610         -0.07028210          0.01468510          0.01119260          0.00607140         -0.40665110         -1.95251100
         10.98265000         -0.00233900          0.55798350         -0.35206530          0.09575890         -0.27550750          0.41885790         -0.00596390          7.62914130
          5.38366500          0.00157580          0.40642730         -0.38303600          0.09291530         -0.02447570          0.18358050         -1.93485000        -11.90154000
          2.34368500         -0.00070320          0.05485290          0.26660970         -0.06694350         -0.14028950         -0.34679470          6.13937260         10.92015100
          1.10520200          0.00028400         -0.00183770          0.70724400         -0.30576810          1.39136390         -1.98221100         -6.58541100         -6.81439800
          0.48784800         -0.00010280          0.00145360          0.31331990         -0.17006770         -0.97588370          2.83069160          2.81404490          2.25475520
          0.08959900          0.00002440         -0.00007650          0.00785530          0.74527870         -1.41883500         -1.93940600         -0.03754380         -0.40553220
          0.03342300         -0.00001690          0.00023540         -0.00362720          0.39684270          1.71845830          0.89050600         -1.11094600          0.09131830
          0.01336900          0.00000600         -0.00004620          0.00107930          0.00528540         -0.15218120          0.33550720          1.05236790          0.07126280
  1  1  1 15  7
       6268.92100000          0.00018740         -0.00006560          0.00002110         -0.00004280          0.00004900         -0.00005110          0.00006530
       1485.11800000          0.00164430         -0.00057560          0.00018610         -0.00036790          0.00041520         -0.00051760          0.00088090
        481.91460000          0.00912080         -0.00322040          0.00103810         -0.00210200          0.00240430         -0.00250870          0.00325740
        183.51420000          0.03719650         -0.01327760          0.00430200         -0.00850300          0.00960040         -0.01202570          0.02074720
         77.19005000          0.11492610         -0.04237710          0.01371150         -0.02787310          0.03196840         -0.03290190          0.04256650
         34.65178000          0.25692940         -0.09833830          0.03212880         -0.06332420          0.07142640         -0.09340990          0.17152030
         16.14846000          0.38335940         -0.15697670          0.05144400         -0.10828590          0.12916330         -0.12414110          0.14457120
          7.71093900          0.30473540         -0.10861110          0.03596730         -0.07062480          0.10060060         -0.21379300          0.39092670
          3.60715400          0.08243440          0.18485070         -0.07642230          0.17670900         -0.34212040          0.83665230         -2.42036800
          1.66736200          0.00273620          0.47596480         -0.19422200          0.57084960         -0.83549890          0.34600580          3.06951180
          0.73908800          0.00145720          0.40672300         -0.18560820         -0.03570800          1.41643780         -2.12483100         -1.59571400
          0.30132600         -0.00032910          0.10212740          0.20105820         -1.25601300         -0.04974320          2.48116440         -0.26908320
          0.12053000          0.00022830         -0.00155650          0.68652460          0.40458460         -1.33599800         -1.48346900          1.58828110
          0.04821200         -0.00010210          0.00275350          0.26067750          0.58709910          0.97815560         -0.10461050         -2.07075200
          0.01928500          0.00003220         -0.00077330          0.00171750          0.00688970          0.25778320          0.82880560          1.29901160
  1  2  2 10  5
        150.83410000          0.00118080         -0.00073170          0.00147090         -0.00198190          0.00293040
         44.99723000         -0.03366540          0.00966120         -0.00593860          0.01221630         -0.01633860
         16.96088000          0.04556200          0.03219560          0.04140730         -0.02588100          0.05281200
          7.04015400         -0.15934630          0.37011740         -1.71626000          0.12131660         -0.07615180
          3.10387800          0.37251220         -0.67852770          0.85425730          2.85143560          0.24095390
          1.37589600         -0.36806240          0.35632890          0.49893130         -2.51585300         -2.69098600
          0.59228200          0.23847460          0.09367550         -0.97662770          1.00466890          2.96154990
          0.24213800         -0.07194640         -0.23308910          0.77748430          0.00841510         -2.05693700
          0.09128400          0.23605300          0.19912700         -0.56415040         -0.16503670          1.20105610
          0.03651400          0.54132100          0.09618840          0.30980510         -0.18723120         -0.99837170
  1  3  3  6  3
          7.71390000          0.03904980         -0.09216890          0.20473740
          3.05750000          0.16805150         -0.36090680          0.57457540
          1.21190000          0.40501470         -0.45590560         -0.17144470
          0.48030000          0.45078650          0.24749490         -0.69725310
          0.19040000          0.22761470          0.51827290          0.45746730
          0.07550000          0.05358530          0.19289890          0.41964850
  1  4  4  4  2
          4.36270000          0.09899290          0.25622850
          1.71480000          0.37757710          0.43342790
          0.67400000          0.52313250         -0.12143690
          0.26490000          0.29987330         -0.49414150
# MANGANESE   (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
MN Roos-ATZ-ANO
  5
  1  0  0 21  8
    3960805.00000000          0.00000870         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     593115.50000000          0.00006800         -0.00002050          0.00000750         -0.00000180          0.00000280         -0.00000580          0.00000630         -0.00000740
     134976.80000000          0.00035740         -0.00010780          0.00003960         -0.00000940          0.00001420         -0.00002880          0.00003620         -0.00004250
      38230.67000000          0.00150710         -0.00045530          0.00016750         -0.00003980          0.00006220         -0.00012990          0.00013440         -0.00015830
      12471.54000000          0.00545760         -0.00165520          0.00060840         -0.00014450          0.00021660         -0.00043510          0.00057350         -0.00067290
       4501.74300000          0.01749970         -0.00535760          0.00197440         -0.00046990          0.00074070         -0.00155900          0.00152210         -0.00179950
       1755.21200000          0.04993510         -0.01565660          0.00577530         -0.00137120          0.00203370         -0.00404210          0.00567100         -0.00664250
        727.30390000          0.12388070         -0.04095100          0.01523350         -0.00363220          0.00580330         -0.01236980          0.01108900         -0.01320330
        316.36780000          0.25049690         -0.09287230          0.03492020         -0.00830490          0.01207350         -0.02356150          0.03703100         -0.04346640
        143.00980000          0.35895920         -0.16842450          0.06548770         -0.01572940          0.02604550         -0.05741360          0.04081040         -0.05005720
         66.21805000          0.27590170         -0.18918780          0.07702400         -0.01842520          0.02385160         -0.04110840          0.11359020         -0.13396720
         29.91896000          0.06596040          0.04616510         -0.01954550          0.00436730          0.00485290         -0.03230330         -0.12393240          0.13606090
         14.30318000         -0.00123720          0.51471840         -0.30058260          0.07696050         -0.14730130          0.37768110         -0.10939550          0.27189300
          6.83945100          0.00195630          0.50418490         -0.45625350          0.12103880         -0.14594950          0.26094310         -1.22496100          1.47458610
          3.01237400         -0.00090710          0.09186060          0.12027270         -0.03966160         -0.03547160         -0.00501200          2.76501310         -5.24583100
          1.41880800          0.00039750         -0.00258700          0.72812930         -0.26313840          0.77851700         -2.43265200         -1.14813300          6.31715330
          0.62362400         -0.00015930          0.00230800          0.40324530         -0.26294560         -0.08070840          2.70448470         -1.32801400         -3.56602700
          0.13409800          0.00006830         -0.00059920          0.01779610          0.43299070         -2.04653000         -0.18863590          4.46581210          1.56932110
          0.06554800         -0.00006470          0.00056840         -0.01018190          0.54643390          1.23053960         -1.98447500         -6.15458300          0.05076780
          0.02958400          0.00003130         -0.00027370          0.00400370          0.19067480          0.54467080          1.81069230          3.05964190         -2.17485400
          0.01183400         -0.00000790          0.00006890         -0.00092400         -0.00022150          0.08868420         -0.15215100         -0.17840820          1.72034160
  1  1  1 15  7
       7048.27100000          0.00017840         -0.00006390          0.00001760         -0.00003520          0.00003830         -0.00005470          0.00005400
       1669.67800000          0.00156680         -0.00056100          0.00015600         -0.00030590          0.00032350         -0.00051490          0.00080030
        541.85710000          0.00871540         -0.00314650          0.00086970         -0.00173610          0.00188620         -0.00269970          0.00268300
        206.42950000          0.03571610         -0.01303980          0.00363280         -0.00712210          0.00752970         -0.01202360          0.01893380
         86.89334000          0.11121530         -0.04192160          0.01162420         -0.02325950          0.02535640         -0.03607640          0.03485680
         39.06309000          0.25160510         -0.09857340          0.02770210         -0.05418060          0.05694880         -0.09331070          0.15977680
         18.24725000          0.38123080         -0.15962520          0.04470710         -0.09199500          0.10353020         -0.14166600          0.10213500
          8.74128900          0.31029020         -0.11507290          0.03304800         -0.06717710          0.07872650         -0.20868190          0.50439900
          4.11933200          0.08812070          0.17705150         -0.06260660          0.13777230         -0.19226940          0.67105100         -2.26790500
          1.91480400          0.00359900          0.47737790         -0.16108730          0.46888220         -0.69137230          0.84618020          2.31120110
          0.85789300          0.00145210          0.41264500         -0.17690520          0.10208170          0.61487770         -2.43522800         -0.39412520
          0.35495000         -0.00033420          0.09948660          0.12091270         -1.04596100          0.92077360          1.93810380         -1.48444000
          0.14198000          0.00020600         -0.00159780          0.64429190         -0.06945110         -1.51537700         -0.27090800          2.48652390
          0.05679200         -0.00009730          0.00267830          0.35827300          0.68819970          0.36824920         -1.06543600         -2.44813000
          0.02271700          0.00003030         -0.00071550          0.01972490          0.18214330          0.70160790          0.99859210          1.28274840
  1  2  2 10  5
        199.83570000          0.00086890         -0.00061410          0.00124530         -0.00144350          0.00222580
         59.72176000          0.00740550         -0.00517230          0.01084020         -0.01243060          0.01898880
         22.74772000          0.03343540         -0.02375470          0.04918380         -0.05807330          0.09232560
          9.56500300          0.10222310         -0.07263280          0.16008170         -0.19535270          0.33205020
          4.28549900          0.21763820         -0.15840410          0.32014190         -0.37455660          0.50021710
          1.95097500          0.31388650         -0.20224890          0.26650740          0.04875240         -1.01976300
          0.87279600          0.32265140         -0.12237590         -0.28152510          0.78022240         -0.16460500
          0.37562100          0.24897740          0.19545300         -0.57570980         -0.11241070          1.43493640
          0.14800900          0.11555480          0.39788320         -0.07034260         -1.10424800         -1.56622400
          0.05920400          0.03978050          0.51436970          0.67373320          0.97098940          0.78798750
  1  3  3  6  3
          9.54130000          0.03498520         -0.08024420          0.16572790
          3.78180000          0.15976610         -0.34830930          0.57437760
          1.49900000          0.39648690         -0.47839020         -0.10199290
          0.59410000          0.45515610          0.22560180         -0.75240290
          0.23550000          0.23977600          0.52997080          0.45286160
          0.09330000          0.05663870          0.19214410          0.43555180
  1  4  4  4  2
          5.39630000          0.08170020         -0.30311870
          2.12100000          0.34540710         -0.60667150
          0.83370000          0.52930680          0.11185800
          0.32770000          0.34012540          0.65216470
# IRON        (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
FE Roos-ATZ-ANO
  5
  1  0  0 21  8
    4316265.00000000          0.00000870         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     646342.40000000          0.00006760         -0.00002020          0.00000660         -0.00000180          0.00000270         -0.00000570          0.00000590         -0.00000700
     147089.70000000          0.00035510         -0.00010650          0.00003470         -0.00000940          0.00001400         -0.00002870          0.00003390         -0.00004070
      41661.52000000          0.00149760         -0.00044950          0.00014670         -0.00003970          0.00006110         -0.00012810          0.00012630         -0.00015070
      13590.77000000          0.00542370         -0.00163470          0.00053290         -0.00014380          0.00021330         -0.00043330          0.00053680         -0.00064370
       4905.75000000          0.01739500         -0.00529340          0.00173040         -0.00046800          0.00072770         -0.00153520          0.00143200         -0.00171170
       1912.74600000          0.04966290         -0.01548620          0.00506480         -0.00136580          0.00200470         -0.00403960          0.00530520         -0.00636670
        792.60430000          0.12335570         -0.04059850          0.01338920         -0.00362260          0.00570610         -0.01216330          0.01046250         -0.01252690
        344.80650000          0.25002290         -0.09250400          0.03080250         -0.00829640          0.01195170         -0.02374360          0.03466550         -0.04179840
        155.89990000          0.35990370         -0.16905000          0.05821830         -0.01577060          0.02569760         -0.05631410          0.03881310         -0.04704460
         72.23091000          0.27899280         -0.19228400          0.06938660         -0.01858720          0.02403850         -0.04348580          0.10640660         -0.13008460
         32.72506000          0.06684860          0.04532080         -0.01668270          0.00410360          0.00461020         -0.02746690         -0.11425850          0.13536570
         15.66762000         -0.00530450          0.52919120         -0.28071900          0.07759400         -0.14507200          0.35854230         -0.08055550          0.16628850
          7.50348300         -0.00219420          0.52613700         -0.43502950          0.12054490         -0.14701850          0.29723730         -1.22133900          1.70571700
          3.31222300         -0.00156720          0.08634040          0.13102650         -0.04091310         -0.02284040         -0.05560670          2.62540500         -5.39768900
          1.55847100          0.00070060         -0.03666660          0.72871520         -0.26246710          0.74958120         -2.35786300         -0.96387930          6.18158200
          0.68391400         -0.00001330         -0.01644200          0.39852760         -0.25768170         -0.07729630          2.62219710         -1.39819200         -3.26150500
          0.14675700          0.00007580         -0.00138020          0.01733970          0.43339760         -1.92800900         -0.09696180          4.14947270          0.90032800
          0.07058300         -0.00006820          0.00098670         -0.00966160          0.54662560          1.06569450         -1.99104900         -5.40974900          0.99723150
          0.03144900          0.00003290         -0.00043850          0.00385200          0.18747110          0.60856320          1.72090500          2.35644950         -2.75224800
          0.01258000         -0.00000840          0.00010900         -0.00090970          0.00270480          0.09196060         -0.10051950          0.12730230          1.86209100
  1  1  1 15  7
       7721.48900000          0.00017940         -0.00005530          0.00001830         -0.00003460          0.00003990         -0.00005450          0.00006250
       1829.12600000          0.00157650         -0.00048580          0.00016140         -0.00030210          0.00034850         -0.00056600          0.00080570
        593.62800000          0.00878210         -0.00273220          0.00090230         -0.00170710          0.00197160         -0.00269790          0.00309860
        226.20540000          0.03607770         -0.01136920          0.00377270         -0.00706390          0.00815410         -0.01330770          0.01915800
         95.26145000          0.11272930         -0.03684800          0.01213510         -0.02300820          0.02661730         -0.03603850          0.04130870
         42.85920000          0.25609280         -0.08750780          0.02898860         -0.05424340          0.06262640         -0.10609660          0.16004550
         20.04971000          0.38909430         -0.14330720          0.04708140         -0.09111680          0.10665340         -0.13086550          0.14569940
          9.62088500          0.31513030         -0.09976090          0.03395630         -0.06773050          0.09339330         -0.27286100          0.46212610
          4.54137100          0.07892750          0.18578570         -0.06721070          0.14812740         -0.23558910          0.87476560         -2.46528000
          2.11350000         -0.01959520          0.47909010         -0.17287650          0.46037010         -0.68343630          0.58764220          2.86141310
          0.94720100         -0.01837930          0.40815100         -0.16620750          0.03915710          0.63114560         -2.29424000         -1.06044600
          0.39124300         -0.00505370          0.09750330          0.14589740         -0.91332880          0.89696110          1.92836100         -0.96776360
          0.15649700          0.00027940         -0.00155180          0.61178550         -0.15696580         -1.38206000         -0.28128930          2.16152290
          0.06259900         -0.00022310          0.00263140          0.35925890          0.64005450          0.16944950         -1.03870800         -2.25377400
          0.02504000          0.00006380         -0.00070260          0.04073560          0.28359880          0.76562060          0.93879990          1.18630030
  1  2  2 10  5
        217.36880000          0.00090860         -0.00072370          0.00125890         -0.00161930          0.00209630
         64.99976000          0.00775700         -0.00612900          0.01092110         -0.01394030          0.01981100
         24.77314000          0.03509610         -0.02813160          0.04980140         -0.06542380          0.08767690
         10.43614000          0.10690640         -0.08623050          0.16077490         -0.22105340          0.35342280
          4.67965300          0.22354780         -0.18379140          0.32346140         -0.41836770          0.46566330
          2.12562200          0.31482280         -0.22300410          0.24231990          0.18487330         -1.18418500
          0.94524200          0.31706310         -0.09948400         -0.34487070          0.78688110          0.22287920
          0.40268500          0.24533970          0.24250460         -0.54964040         -0.34311580          1.12168860
          0.15665100          0.11980180          0.42175960          0.03680090         -0.87041820         -1.51115100
          0.06266000          0.04248370          0.43580570          0.65109530          0.90154760          0.84889270
  1  3  3  6  3
         11.27490000          0.03258760         -0.07378730          0.15048480
          4.46900000          0.15612850         -0.35717230          0.61759580
          1.77130000          0.40094740         -0.48333090         -0.15246510
          0.70210000          0.45321070          0.23975430         -0.74400380
          0.27830000          0.23899830          0.52100980          0.50331810
          0.11030000          0.05966160          0.18732480          0.38453650
  1  4  4  4  2
          6.37680000         -0.07181810         -0.29275760
          2.50640000         -0.35672040         -0.60349290
          0.98510000         -0.51716410          0.16179090
          0.38720000         -0.29398480          0.62253900
# COBALT      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CO Roos-ATZ-ANO
  5
  1  0  0 21  8
    4676708.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     700317.20000000          0.00006700         -0.00002040          0.00000760         -0.00000170          0.00000350         -0.00000550          0.00000500         -0.00000730
     159373.00000000          0.00035240         -0.00010750          0.00004000         -0.00000890          0.00001770         -0.00002790          0.00002820         -0.00004220
      45140.67000000          0.00148620         -0.00045380          0.00016920         -0.00003790          0.00007790         -0.00012220          0.00010730         -0.00015810
      14725.75000000          0.00538250         -0.00165000          0.00061480         -0.00013730          0.00026890         -0.00042470          0.00044430         -0.00066600
       5315.44800000          0.01726470         -0.00534190          0.00199590         -0.00044680          0.00093000         -0.00145680          0.00122610         -0.00180440
       2072.49800000          0.04930400         -0.01562390          0.00584290         -0.00130530          0.00252090         -0.00399180          0.00436640         -0.00656500
        858.82310000          0.12253550         -0.04092880          0.01543990         -0.00346240          0.00732690         -0.01146260          0.00906970         -0.01329910
        373.64370000          0.24860380         -0.09312740          0.03551540         -0.00794870          0.01498120         -0.02386790          0.02829760         -0.04290580
        168.96820000          0.35837910         -0.16965500          0.06696130         -0.01512480          0.03342110         -0.05222480          0.03494890         -0.05088960
         78.31971000          0.27841060         -0.19245090          0.07961680         -0.01794030          0.02931210         -0.04836930          0.08403480         -0.13104100
         35.53724000          0.06785880          0.04347140         -0.01872100          0.00395780          0.00996530         -0.01193170         -0.08208740          0.13014280
         17.04735000         -0.00115750          0.51737040         -0.31042280          0.07479190         -0.19610040          0.30946350         -0.08532520          0.14081640
          8.17553400          0.00192300          0.50464650         -0.46054150          0.11490080         -0.17626490          0.39054300         -0.99683840          1.90270160
          3.61157800         -0.00088960          0.09201290          0.13587240         -0.04223380         -0.03861910         -0.28532140          2.06965250         -5.66431000
          1.69746800          0.00038520         -0.00234550          0.73020260         -0.24686420          1.08415130         -2.05903400         -0.52725830          6.13287560
          0.74363600         -0.00015140          0.00224230          0.39330010         -0.24198820         -0.42626710          2.57812780         -1.41835500         -2.89561700
          0.15832500          0.00006130         -0.00053850          0.01679520          0.37226090         -1.91956200         -0.61815020          3.49227510         -0.04434280
          0.07500900         -0.00005670          0.00050120         -0.00930160          0.56759560          1.37322520         -1.30766700         -4.08162000          2.30677710
          0.03309300          0.00002780         -0.00024560          0.00375190          0.21737940          0.27764580          1.32262520          1.06531310         -3.40497900
          0.01323700         -0.00000730          0.00006420         -0.00090600          0.00352470          0.13569010          0.10033550          0.75922510          1.87662620
  1  1  1 15  7
       8421.84200000          0.00017490         -0.00006400          0.00001880         -0.00003830          0.00003990         -0.00005370          0.00006910
       1995.00000000          0.00153770         -0.00056240          0.00016620         -0.00033620          0.00035810         -0.00059270          0.00077510
        647.48550000          0.00857460         -0.00316260          0.00093160         -0.00189450          0.00197280         -0.00266360          0.00343880
        246.77950000          0.03528970         -0.01316530          0.00389910         -0.00789320          0.00841770         -0.01400160          0.01847170
        103.96890000          0.11048560         -0.04258770          0.01259830         -0.02567960          0.02674400         -0.03561910          0.04674610
         46.81052000          0.25156270         -0.10095360          0.03016540         -0.06112280          0.06551270         -0.11341290          0.15132130
         21.92703000          0.38208840         -0.16409550          0.04922890         -0.10201960          0.10577100         -0.12402180          0.19630070
         10.53715000          0.30945670         -0.11461140          0.03475150         -0.07728850          0.10794080         -0.31891370          0.38612870
          4.98067800          0.08757280          0.18585070         -0.07188090          0.18257780         -0.29257760          1.05617000         -2.54420900
          2.31982400          0.00382660          0.48071240         -0.18284560          0.51785750         -0.65412750          0.30098160          3.24317070
          1.03960900          0.00151230          0.40513110         -0.15347360         -0.05554230          0.76754230         -2.12182000         -1.60291700
          0.42892100         -0.00028530          0.09651020          0.15599370         -0.93997170          0.67550470          1.98305320         -0.49723420
          0.17156800          0.00020140         -0.00155780          0.59752060         -0.05577780         -1.32197400         -0.43478180          1.84870480
          0.06862700         -0.00009280          0.00261270          0.36419420          0.61553970          0.22022440         -0.93174570         -2.08922500
          0.02745100          0.00002890         -0.00069720          0.04018450          0.23599690          0.76020010          0.91738300          1.13243920
  1  2  2 10  5
        237.59280000          0.00092700         -0.00084720          0.00120630         -0.00171410          0.00205160
         71.08881000          0.00793870         -0.00721600          0.01046470         -0.01490830          0.02182970
         27.11903000          0.03606410         -0.03323240          0.04802990         -0.06950530          0.08697790
         11.44826000          0.10968160         -0.10231590          0.15456280         -0.23750360          0.39857290
          5.13954200          0.22645780         -0.21395030          0.31068290         -0.45108020          0.41507500
          2.33269400          0.31367760         -0.24295660          0.20905210          0.26005330         -1.33335300
          1.03403000          0.31243550         -0.06620310         -0.35934790          0.80108240          0.58326830
          0.43789900          0.24628330          0.29378190         -0.51288440         -0.47137080          0.79678900
          0.16896300          0.12633170          0.41673020          0.07429740         -0.71721040         -1.37039400
          0.06758500          0.03900340          0.37130920          0.68550190          0.82498910          0.82987170
  1  3  3  6  3
         12.84030000          0.03236910         -0.07453890          0.14591660
          5.08940000          0.15788750         -0.37667740          0.63322140
          2.01720000          0.41073330         -0.47481310         -0.20378170
          0.79960000          0.45170690          0.27648130         -0.71363400
          0.31690000          0.22855470          0.50315310          0.53295500
          0.12560000          0.05597530          0.17676000          0.36751160
  1  4  4  4  2
          7.26210000         -0.05941470          0.31279870
          2.85440000         -0.34983510          0.62959060
          1.12190000         -0.50665640         -0.21050110
          0.44100000         -0.27189220         -0.60009940
# NICKEL      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
NI Roos-ATZ-ANO
  5
  1  0  0 21  8
    5048010.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000110
     755918.10000000          0.00006680         -0.00002040          0.00000770         -0.00000170          0.00000360         -0.00000560          0.00000630         -0.00000900
     172026.20000000          0.00035100         -0.00010760          0.00004030         -0.00000890          0.00001810         -0.00002900          0.00003640         -0.00004420
      48724.57000000          0.00148020         -0.00045410          0.00017020         -0.00003750          0.00007960         -0.00012620          0.00013480         -0.00020330
      15894.89000000          0.00536130         -0.00165120          0.00061850         -0.00013620          0.00027480         -0.00044210          0.00057700         -0.00066150
       5737.46800000          0.01719850         -0.00534630          0.00200800         -0.00044320          0.00094960         -0.00150170          0.00152700         -0.00246440
       2237.05100000          0.04912750         -0.01564110          0.00587970         -0.00129480          0.00257820         -0.00416600          0.00571490         -0.00610190
        927.03020000          0.12216700         -0.04099880          0.01554880         -0.00343810          0.00748690         -0.01179840          0.01115040         -0.01987330
        403.34610000          0.24810880         -0.09339290          0.03580900         -0.00790000          0.01536150         -0.02506610          0.03757780         -0.03554580
        182.42820000          0.35826230         -0.17040030          0.06764850         -0.01506930          0.03423590         -0.05358670          0.04129610         -0.09667710
         84.58917000          0.27910230         -0.19374000          0.08065480         -0.01791070          0.03032360         -0.05236170          0.11727590         -0.05833300
         38.42293000          0.06830140          0.04354050         -0.01892620          0.00392190          0.00992020         -0.00783680         -0.12728780         -0.09347020
         18.46879000         -0.00118350          0.51950270         -0.31545840          0.07504680         -0.20137340          0.31051000         -0.05821800          0.75915220
          8.86819000          0.00191620          0.50372390         -0.46110780          0.11324250         -0.18303880          0.44043500         -1.49958200          1.30065970
          3.91887000         -0.00088450          0.09139080          0.14489870         -0.04393570         -0.02175280         -0.39622500          3.49240710         -6.12425400
          1.83985300          0.00038170         -0.00227360          0.73044870         -0.24438380          1.09749980         -2.00536500         -2.19076500          8.02386720
          0.80466300         -0.00014830          0.00220820          0.38778550         -0.23485420         -0.46797710          2.63047080         -0.54559010         -5.04603200
          0.16984600          0.00005850         -0.00051330          0.01622800          0.36865540         -1.85498200         -0.80559900          3.59606440          3.82795330
          0.07937000         -0.00005370          0.00047480         -0.00891480          0.57243370          1.32221160         -1.12092700         -5.23758600         -3.83962400
          0.03470000          0.00002660         -0.00023480          0.00364400          0.21592430          0.29731170          1.36863090          2.76688540          1.38030780
          0.01388000         -0.00000710          0.00006240         -0.00089650          0.00028770          0.11571620         -0.01542830         -0.16839860          0.13715750
  1  1  1 15  7
       9148.79600000          0.00017360         -0.00006400          0.00001960         -0.00004290          0.00004470         -0.00004950          0.00007490
       2167.17100000          0.00152660         -0.00056290          0.00017310         -0.00037840          0.00042100         -0.00057910          0.00072140
        703.38570000          0.00852130         -0.00316920          0.00097220         -0.00212800          0.00221460         -0.00245930          0.00372750
        268.13420000          0.03513410         -0.01321830          0.00407440         -0.00891460          0.00994010         -0.01374210          0.01723880
        113.00780000          0.11025030         -0.04287100          0.01321020         -0.02898040          0.03007480         -0.03294680          0.05160920
         50.91339000          0.25168060         -0.10196740          0.03171290         -0.06949990          0.07851530         -0.11296890          0.13785590
         23.87740000          0.38250460         -0.16592570          0.05192370         -0.11563460          0.11657620         -0.11265270          0.24807380
         11.48924000          0.30893670         -0.11411670          0.03605130         -0.09018240          0.15823130         -0.33933110          0.26394790
          5.43688400          0.08722900          0.18968800         -0.07725320          0.22442350         -0.46936450          1.23179260         -2.46405900
          2.53383700          0.00392060          0.48171720         -0.19414970          0.59429600         -0.66531670         -0.17715500          3.41213180
          1.13530900          0.00153920          0.40202030         -0.14772330         -0.16225690          1.24799050         -1.71378400         -2.01147200
          0.46789100         -0.00026550          0.09551930          0.17187530         -1.03404300          0.06088250          2.09813720         -0.04219670
          0.18715600          0.00019940         -0.00154890          0.60426630          0.15003200         -1.22401600         -0.94192350          1.52019810
          0.07486200         -0.00009090          0.00258830          0.35544100          0.61273400          0.59511470         -0.58235760         -1.98531700
          0.02994500          0.00002840         -0.00069060          0.02125060          0.09486060          0.50804730          0.95110920          1.17899740
  1  2  2 10  5
        258.86670000          0.00095250         -0.00092610          0.00123660         -0.00177870          0.00201940
         77.49604000          0.00817990         -0.00792440          0.01074820         -0.01571750          0.02331780
         29.58972000          0.03730820         -0.03662670          0.04958940         -0.07273200          0.08728670
         12.51527000          0.11328720         -0.11305370          0.15987740         -0.25411760          0.43666370
          5.62446800          0.23147570         -0.23263250          0.31923220         -0.46309120          0.33746420
          2.55130300          0.31613600         -0.24935030          0.17919010          0.36602760         -1.39216000
          1.12806000          0.31084320         -0.03532690         -0.41307200          0.75610370          0.84327470
          0.47537300          0.24210240          0.32694740         -0.47494000         -0.60471820          0.52596860
          0.18212800          0.12298390          0.41969840          0.17118430         -0.55810490         -1.25860300
          0.07285100          0.03516760          0.31817540          0.63979400          0.78181900          0.83751330
  1  3  3  6  3
         14.21560000          0.03449540         -0.07796490          0.15327660
          5.63450000          0.16793190         -0.39359110          0.64450370
          2.23330000          0.42354040         -0.45649420         -0.26415270
          0.88520000          0.44325990          0.31147600         -0.67746640
          0.35090000          0.21579090          0.49201070          0.56328290
          0.13910000          0.05136220          0.16482550          0.34102040
  1  4  4  4  2
          8.03990000          0.06441670          0.23374940
          3.16010000          0.39422640          0.43638820
          1.24210000          0.54552060         -0.18016960
          0.48820000          0.26876230         -0.40409970
# COPPER      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CU Roos-ATZ-ANO
  5
  1  0  0 21  8
    9148883.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
    1369956.00000000          0.00003470         -0.00001070          0.00000400          0.00000000          0.00000170         -0.00000290          0.00000450         -0.00000230
     311782.60000000          0.00018240         -0.00005610          0.00002100         -0.00000450          0.00000940         -0.00001540          0.00002310         -0.00002080
      88318.80000000          0.00077000         -0.00023700          0.00008860         -0.00001870          0.00003650         -0.00006340          0.00010180         -0.00004030
      28815.53000000          0.00279760         -0.00086380          0.00032360         -0.00006950          0.00014820         -0.00023880          0.00035130         -0.00036510
      10403.46000000          0.00905600         -0.00280830          0.00105020         -0.00022030          0.00042260         -0.00074630          0.00122040         -0.00031450
       4057.79100000          0.02644080         -0.00832980          0.00312940         -0.00067530          0.00147000         -0.00232870          0.00335440         -0.00407660
       1682.97400000          0.06918040         -0.02245400          0.00843860         -0.00176120          0.00328320         -0.00594890          0.00999050         -0.00081870
        733.75430000          0.15647990         -0.05456570          0.02077020         -0.00452220          0.01014890         -0.01569050          0.02190010         -0.03274590
        333.26770000          0.28318800         -0.11339210          0.04369710         -0.00904300          0.01588480         -0.03044290          0.05407200          0.01311410
        156.43380000          0.34834740         -0.18512600          0.07460190         -0.01670180          0.04068720         -0.05907700          0.07563410         -0.17835700
         74.69721000          0.21729720         -0.15873810          0.06696040         -0.01288420          0.01192630         -0.04167230          0.10389400          0.21183130
         33.32262000          0.03723950          0.16600910         -0.07944260          0.01333560          0.01022030          0.03684610         -0.14016800         -0.65625550
         16.62237000         -0.00258070          0.56808840         -0.38487520          0.09790590         -0.29168770          0.38295340         -0.51266650          2.25317130
          8.20826000          0.00156040          0.39505050         -0.37246620          0.07249740         -0.02332030          0.36386430         -1.35039800         -2.36524200
          3.60940000         -0.00067990          0.05193440          0.31938580         -0.06056550         -0.06553060         -0.83790950          5.69338790         -0.04477630
          1.68344900          0.00026190         -0.00105780          0.70435860         -0.29718440          1.32294460         -1.33277500         -6.48947600          2.02007030
          0.73375700         -0.00008680          0.00123940          0.27996240         -0.10637610         -1.05594100          2.35852380          2.95092940         -1.74255400
          0.11020700          0.00001770         -0.00011970          0.00579100          0.79532710         -1.23087800         -1.82846500         -0.33495160          1.87734720
          0.03878600         -0.00001290          0.00008860         -0.00266520          0.30758250          1.65313940          1.20324560         -0.67362260         -3.24805400
          0.01551400          0.00000490         -0.00003400          0.00095220          0.01483550         -0.20155160          0.04477910          0.84894100          2.28299140
  1  1  1 15  7
       9713.25300000          0.00017840         -0.00006580          0.00002260         -0.00004700          0.00004950         -0.00004950          0.00008520
       2300.88900000          0.00156860         -0.00057820          0.00019820         -0.00041560          0.00048660         -0.00057500          0.00066690
        746.77060000          0.00875430         -0.00325660          0.00112040         -0.00232770          0.00245540         -0.00245860          0.00423610
        284.68060000          0.03608110         -0.01357800          0.00466570         -0.00979250          0.01150310         -0.01366260          0.01591960
        119.99990000          0.11299150         -0.04399850          0.01521570         -0.03165890          0.03321540         -0.03298940          0.05943580
         54.07386000          0.25664090         -0.10418090          0.03608110         -0.07599310          0.09109850         -0.11166080          0.12028890
         25.37321000          0.38518750         -0.16768020          0.05925500         -0.12447490          0.12482900         -0.11756650          0.32080280
         12.20962000          0.30288080         -0.10714430          0.03709930         -0.09551570          0.19632250         -0.31552630          0.05813440
          5.75742100          0.08164480          0.20500460         -0.09339450          0.27896170         -0.67869170          1.38184500         -2.24967500
          2.67340200          0.00338810          0.48293960         -0.22900240          0.62767590         -0.49863740         -0.71329270          3.46521320
          1.18683500          0.00157700          0.39022330         -0.12323690         -0.32615190          1.47981130         -1.10903600         -2.38153200
          0.48159300         -0.00022080          0.09437740          0.23118240         -1.00099000         -0.46342030          1.92129990          0.45280510
          0.19263700          0.00021200         -0.00154480          0.60241090          0.33267140         -0.93055400         -1.20000300          1.12676700
          0.07705500         -0.00008950          0.00264390          0.30652420          0.54404040          0.69217010         -0.31796600         -1.81213600
          0.03082200          0.00002840         -0.00072740          0.01307760          0.05542390          0.36845720          0.93548990          1.16594150
  1  2  2 10  5
        249.34970000          0.00126400         -0.00155310          0.00186920         -0.00233540          0.00250410
         74.63837000          0.01063890         -0.01311300          0.01612510         -0.02290710          0.03579450
         28.37641000          0.04720950         -0.05895500          0.07240920         -0.09394700          0.11182290
         11.94893000          0.13793660         -0.17782060          0.23628630         -0.37675940          0.69073690
          5.31764600          0.26266750         -0.32716810          0.38296120         -0.32713530         -0.47089260
          2.36441700          0.33241630         -0.24099740         -0.16793750          0.95009690         -0.93387540
          1.01238600          0.30779900          0.18960650         -0.68246030         -0.04648790          1.66534460
          0.40677300          0.21664100          0.50340450          0.08869930         -0.88560220         -1.12144000
          0.14733100          0.08407720          0.30703590          0.60278640          0.54282850          0.03505110
          0.05893200          0.00504380          0.03253970          0.14438100          0.32722400          0.52780360
  1  3  3  6  3
         15.43330000          0.03901820         -0.08437670          0.16168310
          6.11720000          0.18754340         -0.41437330          0.63482610
          2.42460000          0.44621250         -0.41723570         -0.31075760
          0.96100000          0.42647410          0.35876800         -0.63188760
          0.38090000          0.19155910          0.47774570          0.56734020
          0.15100000          0.04165180          0.15423760          0.35009790
  1  4  4  4  2
          8.72860000          0.06945940         -0.37915410
          3.43080000          0.43698750         -0.59662630
          1.34850000          0.54147510          0.36137810
          0.53000000          0.21743970          0.51267840
# ZINC        (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
ZN Roos-ATZ-ANO
  5
  1  0  0 21  8
    5820021.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000110
     871523.40000000          0.00006650         -0.00002050          0.00000780         -0.00000170          0.00000270         -0.00000590          0.00000620         -0.00000870
     198335.00000000          0.00034950         -0.00010800          0.00004080         -0.00000910          0.00001370         -0.00003010          0.00003550         -0.00004410
      56176.31000000          0.00147380         -0.00045590          0.00017230         -0.00003860          0.00005980         -0.00013300          0.00013450         -0.00019630
      18325.82000000          0.00533830         -0.00165780          0.00062590         -0.00013990          0.00020950         -0.00045660          0.00055910         -0.00066710
       6614.95500000          0.01712710         -0.00536850          0.00203290         -0.00045590          0.00071120         -0.00158960          0.00153650         -0.00235740
       2579.19900000          0.04894090         -0.01571240          0.00595460         -0.00133090          0.00197450         -0.00428140          0.00550530         -0.00624260
       1068.84900000          0.12179340         -0.04122570          0.01576690         -0.00354270          0.00559090         -0.01258460          0.01138320         -0.01879910
        465.10450000          0.24765890         -0.09406410          0.03637540         -0.00814300          0.01189240         -0.02556620          0.03591620         -0.03741000
        210.41300000          0.35824320         -0.17199640          0.06892730         -0.01561320          0.02539150         -0.05827530          0.04414830         -0.08931210
         97.61629000          0.27981700         -0.19585000          0.08237330         -0.01853580          0.02475170         -0.05034830          0.10815450         -0.07339220
         44.38020000          0.06857580          0.04532440         -0.02009310          0.00413200          0.00312860         -0.02002860         -0.10561150         -0.05598320
         21.42308000         -0.00131270          0.52445220         -0.32530080          0.07898840         -0.14558310          0.36143710         -0.11899220          0.69639940
         10.30891000          0.00191630          0.50060100         -0.46020860          0.11413160         -0.14872710          0.36964340         -1.30557700          1.27778720
          4.55364500         -0.00087910          0.08947690          0.16339080         -0.04867670          0.03235680         -0.27535280          3.03037740         -5.79535100
          2.13282100          0.00037780         -0.00217430          0.72999360         -0.25153870          0.66517080         -2.09870600         -1.56620700          7.35018950
          0.92969700         -0.00014330          0.00213750          0.37667470         -0.23375600         -0.09666510          2.46453010         -0.95620310         -4.35362100
          0.19214700          0.00005410         -0.00046910          0.01508170          0.43801720         -1.65751300         -0.10951070          3.60138580          2.53567550
          0.08759500         -0.00004910          0.00043030         -0.00822400          0.55217390          0.75108880         -1.76128800         -4.88296500         -1.74265200
          0.03770200          0.00002470         -0.00021650          0.00344840          0.16985730          0.73491840          1.53073600          2.36980120         -0.38523160
          0.01508100         -0.00000670          0.00005910         -0.00087620          0.00249730          0.07323190         -0.07747830         -0.03405900          0.89112170
  1  1  1 15  7
      10684.58000000          0.00017140         -0.00006410          0.00001680         -0.00003600          0.00004200         -0.00005340          0.00007280
       2530.90300000          0.00150870         -0.00056380          0.00014820         -0.00031830          0.00037880         -0.00055550          0.00073030
        821.48200000          0.00843680         -0.00318040          0.00083380         -0.00178740          0.00208760         -0.00265780          0.00363330
        313.25220000          0.03489610         -0.01331030          0.00350650         -0.00753410          0.00897610         -0.01321770          0.01751550
        132.10940000          0.10993590         -0.04336340          0.01141350         -0.02449690          0.02862580         -0.03621650          0.05048070
         59.58751000          0.25205640         -0.10373190          0.02756400         -0.05930450          0.07089200         -0.10721320          0.14163670
         28.00399000          0.38327840         -0.16900020          0.04514620         -0.09830750          0.11494810         -0.13684650          0.23802270
         13.50425000          0.30782600         -0.11286720          0.03039090         -0.07579650          0.11746310         -0.28150200          0.29538670
          6.40188100          0.08651150          0.19638980         -0.06646510          0.18815810         -0.33659140          1.01539170         -2.38916100
          2.98576900          0.00408220          0.48297950         -0.16153150          0.46903910         -0.64064250          0.25916240          2.97771040
          1.33690200          0.00158570          0.39676170         -0.13642790         -0.03999370          0.74529540         -1.95908200         -1.23898700
          0.54996100         -0.00023230          0.09411040          0.11657870         -0.81822090          0.70157210          1.69317510         -0.86403040
          0.21998400          0.00019580         -0.00153060          0.54683600         -0.22067370         -1.15028400         -0.04944150          2.10218020
          0.08799400         -0.00008780          0.00254790          0.41490790          0.53820720         -0.05687820         -1.23518600         -2.15106500
          0.03519800          0.00002740         -0.00067970          0.07954380          0.36284880          0.84283010          1.00611850          1.08537290
  1  2  2 10  5
        305.01150000          0.00102500         -0.00138600          0.00152390         -0.00179460          0.00178500
         91.40003000          0.00884670         -0.01201630          0.01363620         -0.01752960          0.02611880
         34.95829000          0.04068310         -0.05596400          0.06257500         -0.07605900          0.08325370
         14.83697000          0.12323990         -0.17605410          0.21698560         -0.30775460          0.52970350
          6.68074800          0.24793300         -0.34913890          0.40159130         -0.40478260         -0.04624890
          3.02902600          0.33086680         -0.27309330         -0.16958970          0.86315710         -1.22731000
          1.33483900          0.31736350          0.21104720         -0.70399180          0.12409940          1.44555740
          0.55860800          0.22301480          0.51804310          0.13084190         -0.93622630         -0.44625940
          0.21174300          0.08092210          0.26108130          0.59401250          0.39627950         -0.72163950
          0.08469700          0.00354320          0.02024490          0.18018630          0.51834500          0.92500470
  1  3  3  6  3
         16.57440000          0.04557150         -0.09412220          0.18733420
          6.56950000          0.21536030         -0.43664550          0.65450530
          2.60390000          0.46964770         -0.37405330         -0.44338020
          1.03210000          0.40406900          0.42861550         -0.54524920
          0.40910000          0.16303650          0.47241450          0.66776630
          0.16210000          0.02361610          0.09871230          0.24004600
  1  4  4  4  2
          9.37400000         -0.09254470          0.42041750
          3.68440000         -0.47648320          0.55152460
          1.44820000         -0.50522730         -0.42970440
          0.56920000         -0.19574530         -0.47388660
# BASIS="NASA Ames cc-pVTZ"
#C.W. Bauschlicher, Jr., Theor. Chem. Acc. 103, 141 (1999)
#C.W. Bauschlicher, Jr., Theor. Chim Acta 92, 183 (1995)
#A. Ricca and C. W. Bauschlicher, Jr. Theor. Chem. Acc. 106, 314 (2001)
#
# TITANIUM    (21s,16p,9d,2f,1g) -> [7s,8p,6d,2f,1g]
TI NASA-Ames-cc-pVTZ
 21
  1  0  0 17  3
    5309148.10000000          0.00000400         -0.00000100          0.00000000
     794951.65000000          0.00003400         -0.00001000          0.00000400
     180907.56000000          0.00018000         -0.00005300          0.00001800
      51241.93300000          0.00075900         -0.00022400          0.00008100
      16717.44900000          0.00275700         -0.00081800          0.00028900
       6035.26590000          0.00892500         -0.00265900          0.00095100
       2353.85710000          0.02606200         -0.00787900          0.00281200
        976.14646000          0.06819000         -0.02122200          0.00760200
        425.43563000          0.15434900         -0.05142200          0.01859200
        193.04677000          0.28028200         -0.10670200          0.03908500
         90.43936900          0.34840000         -0.17468600          0.06649800
         43.02071300          0.22170500         -0.15604100          0.06204600
         19.19055500          0.04001800          0.12932300         -0.05624900
          9.42571600         -0.00213800          0.53846400         -0.31808900
          4.60524300          0.00172200          0.43570800         -0.40582700
          2.03783400         -0.00080200          0.06811700          0.17043200
          0.98003200          0.00035600         -0.00243600          0.69759600
  1  0  0  1  1
          0.44562500          1.00000000
  1  0  0  1  1
          0.10641700          1.00000000
  1  0  0  1  1
          0.05257100          1.00000000
  1  0  0  1  1
          0.02435700          1.00000000
  1  1  1 10  2
       7999.80450000          0.00008800         -0.00002900
       1894.45150000          0.00077700         -0.00026100
        615.18748000          0.00440400         -0.00148200
        234.92741000          0.01866400         -0.00635700
         99.21375300          0.06207200         -0.02147700
         44.91614000          0.15907700         -0.05713400
         21.24971700          0.29697000         -0.11046600
         10.33045800          0.36880100         -0.14814700
          5.10498000          0.23482600         -0.05542600
          2.44069000          0.04935600          0.24556200
  1  1  1  1  1
          1.15120500          1.00000000
  1  1  1  1  1
          0.52955600          1.00000000
  1  1  1  1  1
          0.22119000          1.00000000
  1  1  1  1  1
          0.08800000          1.00000000
  1  1  1  1  1
          0.03500000          1.00000000
  1  1  1  1  1
          0.01400000          1.00000000
  1  2  2  4  1
         89.56920100          0.00196600
         26.58435600          0.01471900
          9.77103200          0.05820800
          3.96193300          0.15816800
  1  2  2  1  1
          1.68926900          1.00000000
  1  2  2  1  1
          0.71567100          1.00000000
  1  2  2  1  1
          0.29381100          1.00000000
  1  2  2  1  1
          0.11083100          1.00000000
  1  2  2  1  1
          0.04400000          1.00000000
  1  3  3  1  1
          1.27522000          1.00000000
  1  3  3  1  1
          0.29275000          1.00000000
  1  4  4  1  1
          0.63000000          1.00000000
# IRON        (20s,15p,10d,2f,1g) -> [6s,8p,6d,2f,1g]
FE NASA-Ames-cc-pVTZ
 19
  1  0  0 18  4
    4316265.30000000          0.00000900         -0.00000300          0.00000100          0.00000000
     646342.42000000          0.00006700         -0.00002000          0.00000800          0.00000200
     147089.73000000          0.00035400         -0.00010800          0.00004000          0.00000900
      41661.52200000          0.00149400         -0.00045400          0.00016800          0.00003600
      13590.76500000          0.00541100         -0.00165000          0.00061100          0.00013100
       4905.75000000          0.01735300         -0.00534200          0.00198400          0.00042500
       1912.74580000          0.04954000         -0.01561900          0.00580600          0.00124200
        792.60434000          0.12303400         -0.04088800          0.01532800          0.00328400
        344.80648000          0.24929100         -0.09290700          0.03521000          0.00755300
        155.89989000          0.35856000         -0.16893700          0.06622500          0.01427200
         72.23090800          0.27747900         -0.19099100          0.07845200          0.01699600
         32.72506500          0.06720100          0.04396800         -0.01878600         -0.00403800
         15.66762200         -0.00115500          0.51545300         -0.30518700         -0.06963000
          7.50348300          0.00193100          0.50516300         -0.45933800         -0.11009600
          3.31222300         -0.00089300          0.09237500          0.12705800          0.03847200
          1.55847100          0.00038500         -0.00240300          0.72923500          0.22624000
          0.68391400         -0.00015100          0.00224600          0.39926300          0.25066100
          0.14675700          0.00005600         -0.00049400          0.01649000         -0.31982700
  1  0  0  1  1
          0.07058300          1.00000000
  1  0  0  1  1
          0.03144900          1.00000000
  1  1  1  9  2
       7721.48860000          0.00017600         -0.00006400
       1829.12580000          0.00155100         -0.00056200
        593.62795000          0.00863900         -0.00315600
        226.20536000          0.03548200         -0.01310900
         95.26145400          0.11080500         -0.04228300
         42.85920300          0.25153600         -0.09985100
         20.04971300          0.38166900         -0.16204600
          9.62088500          0.30991000         -0.11496300
          4.54137100          0.08786400          0.18174200
  1  1  1  1  1
          2.11350000          1.00000000
  1  1  1  1  1
          0.94720100          1.00000000
  1  1  1  1  1
          0.39124300          1.00000000
  1  1  1  1  1
          0.15648000          1.00000000
  1  1  1  1  1
          0.06259200          1.00000000
  1  1  1  1  1
          0.02503700          1.00000000
  1  2  2  5  1
        217.36883000          0.00094500
         64.99975500          0.00806000
         24.77313700          0.03650400
         10.43614000          0.11103400
          4.67965300          0.23254500
  1  2  2  1  1
          2.12562300          1.00000000
  1  2  2  1  1
          0.94524200          1.00000000
  1  2  2  1  1
          0.40268500          1.00000000
  1  2  2  1  1
          0.15665100          1.00000000
  1  2  2  1  1
          0.06266000          1.00000000
  1  3  3  1  1
          3.26595300          1.00000000
  1  3  3  1  1
          0.78678700          1.00000000
  1  4  4  1  1
          2.24800000          1.00000000
#  Def2-SV(P)
# Elements                             References
# --------                             ----------
# H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te I Xe Cs Ba La Hf Ta W Re Os Ir Pt Au Hg Tl Pb Bi Po At Rn : F. Weigend and R. Ahlrichs, Phys. Chem. Chem. Phys. 7, 3297 (2005)
#
# HYDROGEN
H  Ahlrichs-def2-SVP
  3
  1  0  0  3  1
        13.0107010              0.19682158E-01
         1.9622572              0.13796524
         0.44453796             0.47831935
  1  0  0  1  1
         0.12194962             1.0000000
  1  1  1  1  1
         0.8000000              1.0000000
# HELIUM
He  Ahlrichs-def2-SVP
  3
  1  0  0  3  1
        38.354936737             0.23814288905E-01
         5.7689081479             0.15490906777
         1.2399407035             0.46998096633
  1  0  0  1  1
         0.29757815953             1.0000000000
  1  1  1  1  1
         1.0000000000             1.0000000000
# LITHIUM
Li  Ahlrichs-def2-SVP
  5
  1  0  0  5  1
        266.27785516             0.64920150325E-02
        40.069783447             0.47747863215E-01
        9.0559944389             0.20268796111
        2.4503009051             0.48606574817
        0.72209571855             0.43626977955
  1  0  0  1  1
        0.52810884721E-01         1.0000000000
  1  0  0  1  1
        0.20960948798E-01         1.0000000000
  1  1  1  2  1
        1.4500000000             0.25860000000
        0.30000000000             1.0000000000
  1  1  1  1  1
        0.82000000000E-01         1.0000000000
# BERYLLIUM
Be  Ahlrichs-def2-SVP
  5
  1  0  0  5  1
        515.18616125             0.55615307983E-02
        77.511037595             0.41190068062E-01
        17.552481693             0.17913378108
        4.8028940596             0.44736716455
        1.4516214316             0.42009581920
  1  0  0  1  1
        0.13281633620             1.0000000000
  1  0  0  1  1
        0.45837372213E-01         1.0000000000
  1  1  1  3  1
        3.6316917145             -0.29033998305E-01
        0.71695694366             -0.16877854032
        0.19541932860             -0.51403419628
  1  1  1  1  1
        0.60515465890E-01         1.0000000000
# BORON
B  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
        839.31830086             -0.55929201074E-02
        126.26464843             -0.41565520771E-01
        28.620600763             -0.18299816983
        7.8793722710             -0.46540391866
        2.4088857172             -0.44173884791
  1  0  0  1  1
        0.25105109036             1.0000000000
  1  0  0  1  1
        0.83648866069E-01         1.0000000000
  1  1  1  3  1
        6.0332223619             -0.35603672456E-01
        1.2499157866             -0.19895775769
        0.33871676350             -0.50850202618
  1  1  1  1  1
        0.96415632351E-01         1.0000000000
  1  2  2  1  1
        0.50000000000             1.0000000000
# CARBON
C  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
        1238.4016938             0.54568832082E-02
        186.29004992             0.40638409211E-01
        42.251176346             0.18025593888
        11.676557932             0.46315121755
        3.5930506482             0.44087173314
  1  0  0  1  1
        0.40245147363             1.0000000000
  1  0  0  1  1
        0.13090182668             1.0000000000
  1  1  1  3  1
        9.4680970621             0.38387871728E-01
        2.0103545142             0.21117025112
        0.54771004707             0.51328172114
  1  1  1  1  1
        0.15268613795             1.0000000000
  1  2  2  1  1
        0.80000000000             1.0000000000
# NITROGEN
N  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
        1712.8415853             -0.53934125305E-02
        257.64812677             -0.40221581118E-01
        58.458245853             -0.17931144990
        16.198367905             -0.46376317823
        5.0052600809             -0.44171422662
  1  0  0  1  1
        0.58731856571             1.0000000000
  1  0  0  1  1
        0.18764592253             1.0000000000
  1  1  1  3  1
        13.571470233             -0.40072398852E-01
        2.9257372874             -0.21807045028
        0.79927750754            -0.51294466049
  1  1  1  1  1
 0.21954348034 1.0000000000
  1  2  2  1  1
 1.0000000000 1.0000000000
# OXYGEN
O  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
 2266.1767785 -0.53431809926E-02
 340.87010191 -0.39890039230E-01
 77.363135167 -0.17853911985
 21.479644940 -0.46427684959
 6.6589433124 -0.44309745172
  1  0  0  1  1
 0.80975975668 1.0000000000
  1  0  0  1  1
 0.25530772234 1.0000000000
  1  1  1  3  1
 17.721504317 0.43394573193E-01
 3.8635505440 0.23094120765
 1.0480920883 0.51375311064
  1  1  1  1  1
 0.27641544411 1.0000000000
  1  2  2  1  1
 1.2000000000 1.0000000000
# FLUORINE
F  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
 2894.8325990 -0.53408255515E-02
 435.41939120 -0.39904258866E-01
 98.843328866 -0.17912768038
 27.485198001 -0.46758090825
 8.5405498171 -0.44653131020
  1  0  0  1  1
 1.0654578038 1.0000000000
  1  0  0  1  1
 0.33247346748 1.0000000000
  1  1  1  3  1
 22.696633924 -0.45212874436E-01
 4.9872339257 -0.23754317067
 1.3491613954 -0.51287353587
  1  1  1  1  1
 0.34829881977 1.0000000000
  1  2  2  1  1
 1.4000000000 1.0000000000
# NEON
Ne  Ahlrichs-def2-SVP
  6
  1  0  0  5  1
 3598.9736625 -0.53259297003E-02
 541.32073112 -0.39817417969E-01
 122.90450062 -0.17914358188
 34.216617022 -0.46893582977
 10.650584124 -0.44782537577
  1  0  0  1  1
 1.3545953960 1.0000000000
  1  0  0  1  1
 0.41919362639 1.0000000000
  1  1  1  3  1
 28.424053785 -0.46031944795E-01
 6.2822510953 -0.23993183041
 1.6978715079 -0.50871724964
  1  1  1  1  1
 0.43300700172 1.0000000000
  1  2  2  1  1
 1.8880000000 1.0000000000
# SODIUM
Na  Ahlrichs-def2-SVP
  7
  1  0  0  5  1
 4098.2003908 -0.58535911879E-02
 616.49374031 -0.43647161872E-01
 139.96644001 -0.19431465884
 39.073441051 -0.48685065731
 11.929847205 -0.41881705137
  1  0  0  3  1
 20.659966030 0.85949689854E-01
 1.9838860978 -0.56359144041
 0.64836323942 -0.51954009048
  1  0  0  1  1
 0.52443967404E-01 1.0000000000
  1  0  0  1  1
 0.28048160742E-01 1.0000000000
  1  1  1  5  1
 75.401862017 0.15435362532E-01
 17.274818978 0.99738293184E-01
 5.1842347425 0.31209593966
 1.6601211973 0.49295674807
 0.51232528958 0.32420398318
  1  1  1  1  1
 0.52000000000E-01 1.0000000000
  1  2  2  1  1
 0.13100000000 1.0000000000
# MAGNESIUM
Mg  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 4953.8339196 -0.57778967498E-02
 745.18044154 -0.43124761082E-01
 169.21604972 -0.19268216987
 47.300672019 -0.48641439116
 14.461336973 -0.42550894077
  1  0  0  3  1
 24.768174789 0.87956969984E-01
 2.4940945349 -0.55165058128
 0.87807584533 -0.53443294833
  1  0  0  1  1
 0.87212782497E-01 1.0000000000
  1  0  0  1  1
 0.33599293780E-01 1.0000000000
  1  1  1  5  1
 98.053010494 -0.14480564601E-01
 22.586932277 -0.95495750787E-01
 6.8391509842 -0.30787672651
 2.2332843818 -0.49936292886
 0.71606599387 -0.31503476213
  1  1  1  1  1
 0.18914796195 1.0000000000
  1  1  1  1  1
 0.53768755187E-01 1.0000000000
  1  2  2  1  1
 0.10100000000 1.0000000000
# ALUMINUM
Al  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 5887.5727030 0.13483347987E-02
 885.61225996 0.10071576809E-01
 201.13604899 0.45132454056E-01
 56.284974674 0.11461268043
 17.229551243 0.10159608943
  1  0  0  3  1
 29.340249922 0.69347454208E-01
 3.0439630420 -0.42528117679
 1.1285539518 -0.41449832210
  1  0  0  1  1
 0.14234175160 1.0000000000
  1  0  0  1  1
 0.54400192313E-01 1.0000000000
  1  1  1  5  1
 145.11918809 0.63963373134E-02
 33.717894833 0.44189359965E-01
 10.369863083 0.15581575993
 3.5135616036 0.28635286951
 1.1980050273 0.22921423248
  1  1  1  1  1
 0.26583005913 1.0000000000
  1  1  1  1  1
 0.71003361994E-01 1.0000000000
  1  2  2  1  1
 0.30000000000 1.0000000000
# SILICON
Si  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 6903.7118686 0.13373962995E-02
 1038.4346419 0.99966546241E-02
 235.87581480 0.44910165101E-01
 66.069385169 0.11463638540
 20.247945761 0.10280063858
  1  0  0  3  1
 34.353481730 0.70837285010E-01
 3.6370788192 -0.43028836252
 1.4002048599 -0.41382774969
  1  0  0  1  1
 0.20484414805 1.0000000000
  1  0  0  1  1
 0.77994095468E-01 1.0000000000
  1  1  1  5  1
 179.83907373 0.61916656462E-02
 41.907258846 0.43399431982E-01
 12.955294367 0.15632019351
 4.4383267393 0.29419996982
 1.5462247904 0.23536823814
  1  1  1  1  1
 0.35607612302 1.0000000000
  1  1  1  1  1
 0.10008513762 1.0000000000
  1  2  2  1  1
 0.35000000000 1.0000000000
# PHOSPHORUS
P  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 8002.4795106 0.57503489302E-02
 1203.6813590 0.43007628959E-01
 273.44227031 0.19363986252
 76.655541517 0.49651693399
 23.516927435 0.44983262479
  1  0  0  3  1
 39.791683439 0.95188129789E-01
 4.2770343323 -0.57649840368
 1.6940256888 -0.54239583865
  1  0  0  1  1
 0.27567674644 1.0000000000
  1  0  0  1  1
 0.10495590099 1.0000000000
  1  1  1  5  1
 219.50755823 0.92100565257E-02
 51.274155030 0.65409765745E-01
 15.921595892 0.24033730279
 5.5069913481 0.46318321788
 1.9537719426 0.37392563382
  1  1  1  1  1
 0.47803397932 1.0000000000
  1  1  1  1  1
 0.13657952621 1.0000000000
  1  2  2  1  1
 0.45000000000 1.0000000000
# SULFUR
S  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 9184.9303010 -0.22294387756E-02
 1381.5105503 -0.16683029937E-01
 313.87147580 -0.75262436116E-01
 88.053870623 -0.19376827038
 27.039914905 -0.17718020803
  1  0  0  3  1
 45.648731303 -0.10736062573
 4.9664522326 0.65066293018
 2.0116242047 0.59712155354
  1  0  0  1  1
 0.35661077013 1.0000000000
  1  0  0  1  1
 0.13507221477 1.0000000000
  1  1  1  5  1
 261.98233439 -0.92729929822E-02
 61.306894736 -0.66547669241E-01
 19.103729887 -0.24828595903
 6.6567720378 -0.48703847402
 2.3959635161 -0.39337850312
  1  1  1  1  1
 0.61776161679 1.0000000000
  1  1  1  1  1
 0.16993376871 1.0000000000
  1  2  2  1  1
 0.55000000000 1.0000000000
# CHLORINE
Cl  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 10449.827566 0.19708362484E-02
 1571.7365221 0.14754727977E-01
 357.12065523 0.66679112875E-01
 100.25185935 0.17228924084
 30.812727554 0.15883786100
  1  0  0  3  1
 51.923789434 -0.10009298909
 5.7045760975 0.60841752753
 2.3508376809 0.54352153355
  1  0  0  1  1
 0.44605124672 1.0000000000
  1  0  0  1  1
 0.16848856190 1.0000000000
  1  1  1  5  1
 307.66790569 -0.87801484118E-02
 72.102015515 -0.63563355471E-01
 22.532680262 -0.24016428276
 7.8991765444 -0.47798866557
 2.8767268321 -0.38515850005
  1  1  1  1  1
 0.77459363955 1.0000000000
  1  1  1  1  1
 0.21037699698 1.0000000000
  1  2  2  1  1
 0.65000000000 1.0000000000
# ARGON
Ar  Ahlrichs-def2-SVP
  8
  1  0  0  5  1
 11797.119765 0.20214479973E-02
 1774.3522753 0.15139852688E-01
 403.18875733 0.68525400873E-01
 113.24933999 0.17762929207
 34.835298193 0.16496495001
  1  0  0  3  1
 58.614775042 -0.10343394000
 6.4922045078 0.63133365899
 2.7117014403 0.54887572301
  1  0  0  1  1
 0.54412974538 1.0000000000
  1  0  0  1  1
 0.20517411136 1.0000000000
  1  1  1  5  1
 356.28707256 -0.87321783271E-02
 83.593132866 -0.63680317444E-01
 26.186704029 -0.24311906886
 9.2257275925 -0.48956069653
 3.3922754954 -0.39229190040
  1  1  1  1  1
 0.94740534010 1.0000000000
  1  1  1  1  1
 0.25659135062 1.0000000000
  1  2  2  1  1
 0.69600000000 1.0000000000
# POTASSIUM
K  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 31478.746764 0.39838653994E-02
 4726.8876066 0.30501759762E-01
 1075.4345353 0.15073752622
 303.39811023 0.51912939801
 98.327112831 1.0366957005
 33.636222177 0.76398963199
  1  0  0  3  1
 65.639209962 -0.28242617106
 7.3162592218 1.6914935860
 2.8902580135 1.2965331953
  1  0  0  3  1
 4.5459748965 -0.76343555273E-02
 0.70404124062 0.25635718960E-01
 0.28266888959 0.16606859208E-01
  1  0  0  1  1
 0.29058164020E-01 1.0000000000
  1  0  0  1  1
 0.12111638157E-01 1.0000000000
  1  1  1  5  1
 361.22492154 0.20906479823E-01
 84.670222166 0.15043641740
 26.469088236 0.55440061077
 9.2658077615 1.0409009991
 3.3423388293 0.67825341194
  1  1  1  3  1
 1.5100876104 0.75248191146
 0.56568375163 1.3708585031
 0.20817008495 0.66047633079
  1  1  1  1  1
 0.41737000000E-01 1.0000000000
  1  2  2  1  1
 0.35300000000 1.0000000000
  1  2  2  1  1
 0.98000000000E-01 1.0000000000
# CALCIUM
Ca  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 35138.713929 0.39482520740E-02
 5276.4111348 0.30234243552E-01
 1200.4692589 0.14952019681
 338.71810542 0.51597345713
 109.85385922 1.0339510296
 37.608880299 0.76937933526
  1  0  0  3  1
 73.107977555 -0.28268525011
 8.2407705688 1.6796092142
 3.2959812993 1.2803766016
  1  0  0  3  1
 5.2341800914 -0.76868604561E-02
 0.84187220515 0.25382375978E-01
 0.36510294029 0.16512171511E-01
  1  0  0  1  1
 0.51222402884E-01 1.0000000000
  1  0  0  1  1
 0.19825111408E-01 1.0000000000
  1  1  1  5  1
 413.11313893 0.20327135354E-01
 96.935786224 0.14730276362
 30.372154659 0.54887167322
 10.684776830 1.0440659818
 3.8821258350 0.68653490684
  1  1  1  3  1
 1.7993016295 0.75410246871
 0.69189056530 1.3409296599
 0.26364024096 0.56391989435
  1  1  1  1  1
 0.74979000000E-01 1.0000000000
  1  2  2  3  1
 5.4979093879 0.73770011433E-01
 1.3177128032 0.26052853169
 0.32188682649 0.45233836380
  1  2  2  1  1
 0.70528614919E-01 1.0000000000
# SCANDIUM
Sc  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 38956.081804 0.39293205858E-02
 5849.5733637 0.30093221229E-01
 1330.8813154 0.14890370950
 375.55534165 0.51464282906
 121.87261370 1.0337708070
 41.760243729 0.77436851627
  1  0  0  3  1
 81.060633953 -0.28318552316
 9.2059823972 1.6770806984
 3.7063215732 1.2594733678
  1  0  0  3  1
 5.9888909988 -0.77821367493E-02
 0.97363432378 0.25499692745E-01
 0.42041019223 0.16191560820E-01
  1  0  0  1  1
 0.59440551913E-01 1.0000000000
  1  0  0  1  1
 0.22897806303E-01 1.0000000000
  1  1  1  5  1
 466.31481262 0.19984300385E-01
 109.51217097 0.14561043072
 34.375921827 0.54687466223
 12.142096955 1.0479006012
 4.4336767669 0.68894890327
  1  1  1  3  1
 2.0971291866 0.75619214724
 0.80977606956 1.3178212235
 0.30834046588 0.54312268173
  1  1  1  1  1
 0.89748000000E-01 1.0000000000
  1  2  2  4  1
 19.240334928 0.27039082144E-01
 5.1178995899 0.13803684743
 1.6554278827 0.34869086403
 0.54016355610 0.48594185717
  1  2  2  1  1
 0.16211214518 0.34374449689
# TITANIUM
Ti  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 42961.512185 0.39127635355E-02
 6450.9759169 0.29969820489E-01
 1467.7210915 0.14836352707
 414.20997355 0.51347285324
 134.48715840 1.0335365483
 46.122209796 0.77854233930
  1  0  0  3  1
 89.447762543 -0.28385401259
 10.223346060 1.6772785333
 4.1353774271 1.2411928456
  1  0  0  3  1
 6.7896181452 -0.78399994518E-02
 1.1106730691 0.25495493019E-01
 0.47565975578 0.16061172892E-01
  1  0  0  1  1
 0.65986956934E-01 1.0000000000
  1  0  0  1  1
 0.25210342250E-01 1.0000000000
  1  1  1  5  1
 522.03684782 0.19754179642E-01
 122.68649489 0.14460677619
 38.572903611 0.54669004165
 13.672169319 1.0531647540
 5.0118529359 0.69111213363
  1  1  1  3  1
 2.4131928282 0.75803437136
 0.93252270050 1.3036241399
 0.35429058390 0.53638653300
  1  1  1  1  1
 0.10156100000 1.0000000000
  1  2  2  4  1
 23.465125957 0.26536380115E-01
 6.3332593832 0.13796453963
 2.0766489946 0.35312644228
 0.69027361954 0.48647124166
  1  2  2  1  1
 0.21088738554 0.33026314258
# VANADIUM
V  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 47160.376060 0.14498688908E-02
 7081.4110871 0.11106435251E-01
 1611.1621223 0.55005423585E-01
 454.72940551 0.19060252591
 147.71321208 0.38435022957
 50.699538950 0.29095546792
  1  0  0  3  1
 98.262492669 -0.10942337856
 11.294293099 0.64539490399
 4.5853360105 0.47117880777
  1  0  0  3  1
 7.6359689588 -0.22454949054
 1.2539836689 0.72594852764
 0.53271935387 0.45560582748
  1  0  0  1  1
 0.72246239566E-01 1.0000000000
  1  0  0  1  1
 0.27358087448E-01 1.0000000000
  1  1  1  5  1
 580.55044988 0.97315110917E-02
 136.52341127 0.71531241137E-01
 42.983958820 0.27197688414
 15.282798763 0.52618988893
 5.6202495154 0.34452533498
  1  1  1  3  1
 2.7485386415 0.34040396496
 1.0618550073 0.57983996120
 0.40235518645 0.23911643083
  1  1  1  1  1
 0.11124800000 1.0000000000
  1  2  2  4  1
 27.358434017 0.26641927050E-01
 7.4540604253 0.13995311726
 2.4633917847 0.35751066639
 0.82480925277 0.48488354148
  1  2  2  1  1
 0.25257904742 0.32332844995
# CHROMIUM
Cr  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 51528.086349 0.14405823106E-02
 7737.2103487 0.11036202287E-01
 1760.3748470 0.54676651806E-01
 496.87706544 0.18965038103
 161.46520598 0.38295412850
 55.466352268 0.29090050668
  1  0  0  3  1
 107.54732999 -0.10932281100
 12.408671897 0.64472599471
 5.0423628826 0.46262712560
  1  0  0  3  1
 8.5461640165 -0.22711013286
 1.3900441221 0.73301527591
 0.56066602876 0.44225565433
  1  0  0  1  1
 0.71483705972E-01 1.0000000000
  1  0  0  1  1
 0.28250687604E-01 1.0000000000
  1  1  1  5  1
 640.48536096 0.96126715203E-02
 150.69711194 0.70889834655E-01
 47.503755296 0.27065258990
 16.934120165 0.52437343414
 6.2409680590 0.34107994714
  1  1  1  3  1
 3.0885463206 0.33973986903
 1.1791047769 0.57272062927
 0.43369774432 0.24582728206
  1  1  1  1  1
 0.12067500000 1.0000000000
  1  2  2  4  1
 27.559479426 0.30612488044E-01
 7.4687020327 0.15593270944
 2.4345903574 0.36984421276
 0.78244754808 0.47071118077
  1  2  2  1  1
 0.21995774311 0.33941649889
# MANGANESE
Mn  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 56137.009037 0.14321304702E-02
 8429.2063943 0.10972509162E-01
 1917.8277233 0.54382468712E-01
 541.36230198 0.18884335129
 176.00069142 0.38198025054
 60.500477010 0.29156772596
  1  0  0  3  1
 117.17282882 -0.10933661328
 13.596973368 0.64305039431
 5.5483996341 0.45848970584
  1  0  0  3  1
 9.4662853530 -0.22538977259
 1.5595006070 0.72307758657
 0.65230205868 0.45300721536
  1  0  0  1  1
 0.84003734475E-01 1.0000000000
  1  0  0  1  1
 0.31256098581E-01 1.0000000000
  1  1  1  5  1
 706.00497535 0.95055518167E-02
 166.19728820 0.70356271142E-01
 52.452061906 0.27005556982
 18.746932862 0.52574344602
 6.9282991622 0.34254033223
  1  1  1  3  1
 3.4772204938 0.33994073736
 1.3406906449 0.57203836254
 0.50498803038 0.23847605831
  1  1  1  1  1
 0.12765000000 1.0000000000
  1  2  2  4  1
 35.423264935 0.26985304111E-01
 9.7814221451 0.14383458648
 3.2673488767 0.36418958377
 1.1026472189 0.48152670661
  1  2  2  1  1
 0.33743205934 0.31458754360
# IRON
Fe  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 60923.640643 0.14302254466E-02
 9147.8893982 0.10958790038E-01
 2081.3505927 0.54332554248E-01
 587.55977067 0.18884995009
 191.09043990 0.38253069946
 65.732730112 0.29308335984
  1  0  0  3  1
 127.25891928 -0.10964564925
 14.830913010 0.64387631332
 6.0653307408 0.45472347323
  1  0  0  3  1
 10.449943710 -0.22539639952
 1.7245228003 0.72164398156
 0.71772177325 0.44985492922
  1  0  0  1  1
 0.91449828308E-01 1.0000000000
  1  0  0  1  1
 0.33706691021E-01 1.0000000000
  1  1  1  5  1
 773.43750995 0.94325735144E-02
 182.15149714 0.70029620575E-01
 57.547272758 0.26993651996
 20.614988935 0.52700011047
 7.6348557890 0.34284148028
  1  1  1  3  1
 3.8719327990 0.33974402988
 1.4924724132 0.56842594005
 0.56061284958 0.23649365839
  1  1  1  1  1
 0.13491500000 1.0000000000
  1  2  2  4  1
 38.968133419 0.27879664382E-01
 10.800067078 0.14858319982
 3.6136457999 0.36905479496
 1.2129967888 0.47745100883
  1  2  2  1  1
 0.36524393170 0.31418142304
# COBALT
Co  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 65902.208257 0.14284614936E-02
 9895.3896027 0.10946072783E-01
 2251.4305789 0.54285953890E-01
 635.61097084 0.18885179079
 206.78820681 0.38301634994
 71.179242971 0.29443551266
  1  0  0  3  1
 137.77268040 -0.10990221736
 16.118079243 0.64455537395
 6.6030327710 0.45116787924
  1  0  0  3  1
 11.479915788 -0.22593846910
 1.8956426324 0.72231409008
 0.78466232067 0.44903812296
  1  0  0  1  1
 0.98425774432E-01 1.0000000000
  1  0  0  1  1
 0.35945741932E-01 1.0000000000
  1  1  1  5  1
 843.64358575 0.93866097254E-02
 198.76386994 0.69880208716E-01
 62.854963098 0.27037070345
 22.562842280 0.52904786880
 8.3713209127 0.34357029579
  1  1  1  3  1
 4.2858719800 0.34027999036
 1.6508041817 0.56693392384
 0.61834231096 0.23617979783
  1  1  1  1  1
 0.14130800000 1.0000000000
  1  2  2  4  1
 42.927867612 0.28487788365E-01
 11.942533053 0.15206951283
 4.0046495664 0.37310913999
 1.3413193804 0.47549837676
  1  2  2  1  1
 0.40015009743 0.31346831424
# NICKEL
Ni  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 71074.803211 0.14260386729E-02
 10672.020941 0.10928236994E-01
 2428.1389007 0.54212626938E-01
 685.53595148 0.18874768902
 223.10072863 0.38324616985
 76.842014042 0.29550637144
  1  0  0  3  1
 148.71122016 -0.11014443059
 17.459154987 0.64521426988
 7.1625280665 0.44797838103
  1  0  0  3  1
 12.556137125 -0.22645403224
 2.0735740488 0.72320959286
 0.85382640602 0.44868026476
  1  0  0  1  1
 0.10536766271 1.0000000000
  1  0  0  1  1
 0.38134087688E-01 1.0000000000
  1  1  1  5  1
 916.73608662 0.93439635610E-02
 216.06139913 0.69737374902E-01
 68.383914817 0.27073495012
 24.593843952 0.53078301549
 9.1392960204 0.34410229438
  1  1  1  3  1
 4.7193371746 0.34076082016
 1.8161849234 0.56580169611
 0.67840750720 0.23616717361
  1  1  1  1  1
 0.14658800000 1.0000000000
  1  2  2  4  1
 47.093832108 0.28982316948E-01
 13.146463975 0.15494995950
 4.4170548925 0.37633115111
 1.4771565078 0.47365096014
  1  2  2  1  1
 0.43735921792 0.31247837833
# COPPER
Cu  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 76381.348056 0.14336079896E-02
 11468.777499 0.10986749865E-01
 2609.4246495 0.54513652465E-01
 736.75033098 0.18990128258
 239.82419958 0.38581959211
 82.656829252 0.29790607498
  1  0  0  3  1
 160.13544196 -0.11146778567
 18.834177695 0.65349301031
 7.7176595741 0.44770534421
  1  0  0  3  1
 13.710846717 -0.22870911122
 2.2349895670 0.73464423031
 0.87818360069 0.43273070874
  1  0  0  1  1
 0.87187458064E-01 1.0000000000
  1  0  0  1  1
 0.32969114665E-01 1.0000000000
  1  1  1  5  1
 991.24075782 0.93878498798E-02
 233.69376116 0.70208282458E-01
 74.020930927 0.27323522220
 26.664967447 0.53580792728
 9.9192087478 0.34575794906
  1  1  1  3  1
 5.1519553926 0.34229108083
 1.9638205828 0.56456592484
 0.71560097037 0.24078584318
  1  1  1  1  1
 0.15506500000 1.0000000000
  1  2  2  4  1
 47.335049590 0.32375547758E-01
 13.161666077 0.16810218684
 4.3693777244 0.38477707982
 1.4132925109 0.46147880178
  1  2  2  1  1
 0.38878001452 0.32388873258
# ZINC
Zn  Ahlrichs-def2-SVP
  10
  1  0  0  6  1
 82000.711629 0.14210764000E-02
 12312.471777 0.10891499487E-01
 2801.3944193 0.54057188059E-01
 790.99424302 0.18847463904
 257.56551079 0.38346549346
 88.814933400 0.29723794197
  1  0  0  3  1
 171.86353716 -0.11051849523
 20.302534785 0.64607716984
 8.3464123068 0.44220117322
  1  0  0  3  1
 14.847536940 -0.22705309278
 2.4495029507 0.72433217935
 0.99845821824 0.44836495592
  1  0  0  1  1
 0.11891307937 1.0000000000
  1  0  0  1  1
 0.42297428760E-01 1.0000000000
  1  1  1  5  1
 1071.5185372 0.92767797235E-02
 252.69712152 0.69541149434E-01
 80.100829126 0.27156772564
 28.903393172 0.53401355573
 10.768899879 0.34501323446
  1  1  1  3  1
 5.6446212530 0.34129600164
 2.1678291347 0.56390521973
 0.80540898341 0.23676109735
  1  1  1  1  1
 0.16245500000 1.0000000000
  1  2  2  4  1
 56.088939191 0.29588869140E-01
 15.751908917 0.15872571404
 5.3115812367 0.37976229159
 1.7737904917 0.46898959172
  1  2  2  1  1
 0.51975583665 0.30907149078
# GALLIUM
Ga  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 87842.126296 0.14271588798E-02
 13189.496402 0.10938894097E-01
 3000.9482141 0.54308200127E-01
 847.38425966 0.18951055983
 276.00980642 0.38615185918
 95.216672071 0.30051082719
  1  0  0  3  1
 184.00703968 -0.11124461963
 21.827051433 0.64831322918
 9.0026963761 0.44358383594
  1  0  0  3  1
 16.033176938 -0.23014299555
 2.6707724878 0.72946861516
 1.1252834170 0.46214976951
  1  0  0  1  1
 0.15967608829 1.0000000000
  1  0  0  1  1
 0.57643044753E-01 1.0000000000
  1  1  1  5  1
 1167.2665844 0.90974021307E-02
 275.38062789 0.68456273343E-01
 87.375073070 0.26922293888
 31.597254670 0.53507897882
 11.824122798 0.35279062760
  1  1  1  3  1
 6.2881845133 0.33938244530
 2.5199853240 0.56871947608
 1.0169726306 0.27717694939
  1  1  1  1  1
 0.24748373604 1.0000000000
  1  1  1  1  1
 0.66685294163E-01 1.0000000000
  1  2  2  4  1
 65.354237674 0.27370146382E-01
 18.504656747 0.15099463976
 6.3179620632 0.37485328545
 2.1641389426 0.47510606851
  1  2  2  1  1
 0.66693092754 0.29843287401
  1  2  2  1  1
 0.20700000000 1.0000000000
# GERMANIUM
Ge  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 93889.836642 0.14233976060E-02
 14097.497528 0.10910795654E-01
 3207.5477309 0.54183705943E-01
 905.76727269 0.18922820349
 295.11014693 0.38612847001
 101.84713141 0.30164050736
  1  0  0  3  1
 196.56719662 -0.11118770940
 23.405292522 0.64616007369
 9.6839116702 0.44188904568
  1  0  0  3  1
 17.269736544 -0.23027421375
 2.8964622160 0.73017169398
 1.2553621412 0.46197222255
  1  0  0  1  1
 0.20213081492 1.0000000000
  1  0  0  1  1
 0.73867910982E-01 1.0000000000
  1  1  1  5  1
 1259.2085995 0.90115464252E-02
 297.15626382 0.67986841689E-01
 94.353387522 0.26853856488
 34.176329677 0.53659649219
 12.816139615 0.35633514961
  1  1  1  3  1
 6.8471029784 0.33900693119
 2.7717363939 0.56809365264
 1.1458418175 0.27246539884
  1  1  1  1  1
 0.30679631536 1.0000000000
  1  1  1  1  1
 0.89283644115E-01 1.0000000000
  1  2  2  4  1
 74.782168177 0.25755860205E-01
 21.310849759 0.14536816132
 7.3464792363 0.37134209859
 2.5656271395 0.48002998436
  1  2  2  1  1
 0.81981773070 0.28978790744
  1  2  2  1  1
 0.24600000000 1.0000000000
# ARSENIC
As  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 100146.52554 0.14258349617E-02
 15036.861711 0.10930176963E-01
 3421.2902833 0.54294174610E-01
 966.16965717 0.18976078153
 314.87394026 0.38775195453
 108.70823790 0.30402812040
  1  0  0  3  1
 209.54238950 -0.11162094204
 25.038221139 0.64697607762
 10.390964343 0.44223608673
  1  0  0  3  1
 18.555090093 -0.22994190569
 3.1281217449 0.73319107613
 1.3884885073 0.45533653943
  1  0  0  1  1
 0.24714362141 1.0000000000
  1  0  0  1  1
 0.91429428670E-01 1.0000000000
  1  1  1  5  1
 1355.6443507 0.89182507898E-02
 319.99929270 0.67454750717E-01
 101.67734092 0.26759772110
 36.886323845 0.53776844520
 13.861115909 0.35992570244
  1  1  1  3  1
 7.4260666912 0.34036849637
 3.0316247187 0.57030149334
 1.2783078340 0.26606170238
  1  1  1  1  1
 0.37568503356 1.0000000000
  1  1  1  1  1
 0.11394805454 1.0000000000
  1  2  2  4  1
 84.445514539 0.24518402724E-01
 24.190416102 0.14107454677
 8.4045015119 0.36875228915
 2.9808970748 0.48409561362
  1  2  2  1  1
 0.97909243359 0.28250268781
  1  2  2  1  1
 0.29300000000 1.0000000000
# SELENIUM
Se  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 106612.20027 0.14274889113E-02
 16007.604701 0.10943525114E-01
 3642.1699707 0.54374171596E-01
 1028.5912993 0.19018092947
 335.30298888 0.38913021696
 115.80129154 0.30620207088
  1  0  0  3  1
 222.93325020 -0.11198808009
 26.726257934 0.64752124207
 11.124501923 0.44241976651
  1  0  0  3  1
 19.888520061 -0.22857227762
 3.3668473803 0.73591359951
 1.5249277839 0.44330199577
  1  0  0  1  1
 0.29630037912 1.0000000000
  1  0  0  1  1
 0.11009288974 1.0000000000
  1  1  1  5  1
 1455.9068120 0.88203597043E-02
 343.75101831 0.66875851967E-01
 109.29554964 0.26640578080
 39.707711022 0.53834928422
 14.950185232 0.36303281993
  1  1  1  3  1
 8.0208962094 0.34153807025
 3.2934649756 0.57257906583
 1.4058602438 0.25549813222
  1  1  1  1  1
 0.45076123226 1.0000000000
  1  1  1  1  1
 0.13353413325 1.0000000000
  1  2  2  4  1
 94.494024044 0.23490101098E-01
 27.188185260 0.13747735767
 9.5091567352 0.36649929124
 3.4170516853 0.48750989884
  1  2  2  1  1
 1.1479590083 0.27657943383
  1  2  2  1  1
 0.33800000000 1.0000000000
# BROMINE
Br  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 113286.38776 0.14283037779E-02
 17009.626303 0.10950417496E-01
 3870.1842567 0.54421006604E-01
 1093.0357227 0.19047907695
 356.39721797 0.39024642737
 123.12539643 0.30814432514
  1  0  0  3  1
 236.74084007 -0.11228065671
 28.468661070 0.64775962312
 11.883443722 0.44235575986
  1  0  0  3  1
 21.269633312 -0.22642576323
 3.6129226841 0.73823712008
 1.6626648969 0.42683868694
  1  0  0  1  1
 0.34823793232 1.0000000000
  1  0  0  1  1
 0.13019031394 1.0000000000
  1  1  1  5  1
 1560.2801881 0.87166669072E-02
 368.47859205 0.66243637420E-01
 117.22978849 0.26495610385
 42.648909248 0.53839160587
 16.087225096 0.36579387888
  1  1  1  3  1
 8.6352810058 0.34248787366
 3.5613665502 0.57500678213
 1.5292626609 0.24330394172
  1  1  1  1  1
 0.53064294848 1.0000000000
  1  1  1  1  1
 0.15702758965 1.0000000000
  1  2  2  4  1
 104.85518642 0.22650147581E-01
 30.281143688 0.13455483230
 10.651394267 0.36474454537
 3.8699456233 0.49044587056
  1  2  2  1  1
 1.3240876762 0.27137289040
  1  2  2  1  1
 0.38900000000 1.0000000000
# KRYPTON
Kr  Ahlrichs-def2-SVP
  12
  1  0  0  6  1
 120165.64875 0.14294234496E-02
 18042.500169 0.10959597020E-01
 4105.1800388 0.54479647470E-01
 1159.4447248 0.19081239122
 378.13810346 0.39140445949
 130.67610045 0.31007346689
  1  0  0  3  1
 250.96373353 -0.11258604011
 30.265930380 0.64816322524
 12.668110757 0.44240238994
  1  0  0  3  1
 22.697940101 -0.22391964908
 3.8673017398 0.74060953026
 1.8013706671 0.40803658445
  1  0  0  1  1
 0.40308639136 1.0000000000
  1  0  0  1  1
 0.15170527749 1.0000000000
  1  1  1  5  1
 1668.5736623 0.86215009803E-02
 394.13862798 0.65665506884E-01
 125.46644854 0.26366576697
 45.704992729 0.53867658574
 17.270133229 0.36865167502
  1  1  1  3  1
 9.2699487770 0.34346189015
 3.8364617719 0.57784776196
 1.6467163312 0.23075615197
  1  1  1  1  1
 0.61479686489 1.0000000000
  1  1  1  1  1
 0.18319467414 1.0000000000
  1  2  2  4  1
 115.55868603 0.21945485333E-01
 33.477985864 0.13211212879
 11.834450207 0.36333306964
 4.3408254894 0.49300484446
  1  2  2  1  1
 1.5079273157 0.26676858913
  1  2  2  1  1
 0.44300000000 1.0000000000
# RUBIDIUM
Rb  Ahlrichs-def2-SVP
  10
  1  0  0  3  1
 4.6687885071 0.29008526793
 2.9442428420 -0.67740090428
 0.58171262989 0.45712389487
  1  0  0  1  1
 0.45147933555 1.0000000000
  1  0  0  1  1
 0.21604923532 1.0000000000
  1  0  0  1  1
 0.32088816526E-01 1.0000000000
  1  0  0  1  1
 0.13833878175E-01 1.0000000000
  1  1  1  4  1
 5.5234179480 0.51234729472E-01
 3.4120149646 -0.17337025646
 0.76899021792 0.43339683188
 0.33088071786 0.55354332721
  1  1  1  1  1
 0.13423268441 1.0000000000
  1  1  1  1  1
 0.20642679613E-01 1.0000000000
  1  2  2  1  1
 0.22600000000 1.0000000000
  1  2  2  1  1
 0.27432280711E-01 1.0000000000
#  Def2-TZVP
# Elements                             References
# --------                             ----------
# H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te I Xe Cs Ba La Hf Ta W Re Os Ir Pt Au Hg Tl Pb Bi Po At Rn : F. Weigend and R. Ahlrichs, Phys. Chem. Chem. Phys. 7, 3297 (2005)
#
# HYDROGEN
H  Ahlrichs-def2-TZVP
  4
  1  0  0  3  1
        34.061341000         0.60251978000E-02
        5.1235746000         0.45021094000E-01
        1.1646626000         0.20189726000
  1  0  0  1  1
        0.32723041000         1.0000000000
  1  0  0  1  1
        0.10307241000         1.0000000000
  1  1  1  1  1
        0.80000000000         1.0000000000
# HELIUM
He  Ahlrichs-def2-TZVP
  4
  1  0  0  3  1
        98.078321616         0.75803064967E-02
        14.764404247         0.54848620937E-01
        3.3185831473         0.22074382186
  1  0  0  1  1
        0.87413869551         1.0000000000
  1  0  0  1  1
        0.24459897208         1.0000000000
  1  1  1  1  1
        1.0000000000        1.0000000000
# LITHIUM
Li  Ahlrichs-def2-TZVP
  8
  1  0  0  6  1
        6269.2628010         0.20540968826E-03
        940.31612431         0.15916554089E-02
        214.22107528         0.82869829707E-02
        60.759840184         0.33856374249E-01
        19.915152032         0.11103225876
        7.3171509797         0.27449383329
  1  0  0  2  1
        2.9724674216         0.23792456411
        1.2639852314         0.30765411924
  1  0  0  1  1
        0.51427489953         1.0000000000
  1  0  0  1  1
        0.77030885901E-01     1.0000000000
  1  0  0  1  1
        0.28938896433E-01     1.0000000000
  1  1  1  1  1
        0.40000000000         1.0000000000
  1  1  1  1  1
        0.60000000000E-01     1.0000000000
  1  1  1  1  1
        3.3270000000         1.0000000000
# BERYLLIUM
Be  Ahlrichs-def2-TZVP
  9
  1  0  0  6  1
 4700.2365626 0.23584389316E-03
 704.82845622 0.18243791019E-02
 160.43110478 0.93966148224E-02
 45.425347336 0.36908924159E-01
 14.798334125 0.10897561281
 5.3512452537 0.21694284551
  1  0  0  2  1
 2.1542044819 0.44695408857
 0.93363744400 0.20866985771
  1  0  0  1  1
 0.18791432989 1.0000000000
  1  0  0  1  1
 0.74648267947E-01 1.0000000000
  1  0  0  1  1
 0.32650484598E-01 1.0000000000
  1  1  1  1  1
 3.6316917145 -0.29033998305E-01
  1  1  1  2  1
 0.71695694366 -0.16877854032
 0.19541932860 -0.51403419628
  1  1  1  1  1
 0.60515465890E-01 1.0000000000
  1  2  2  1  1
 0.18000000000 1.0000000000
# BORON
B  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 8564.8660687 0.22837198155E-03
 1284.1516263 0.17682576447E-02
 292.27871604 0.91407080516E-02
 82.775469176 0.36342638989E-01
 27.017939269 0.11063458441
 9.8149619660 0.23367344321
  1  0  0  2  1
 3.9318559059 0.41818777978
 1.6595599712 0.22325473798
  1  0  0  1  1
 0.35762965239 1.0000000000
  1  0  0  1  1
 0.14246277496 1.0000000000
  1  0  0  1  1
 0.60560594768E-01 1.0000000000
  1  1  1  4  1
 22.453875803 0.50265575179E-02
 5.1045058330 0.32801738965E-01
 1.4986081344 0.13151230768
 0.50927831315 0.33197167769
  1  1  1  1  1
 0.18147077798 0.47314319570
  1  1  1  1  1
 0.64621893904E-01 0.25802783943
  1  2  2  1  1
 0.66100000000 1.0000000000
  1  2  2  1  1
 0.19900000000 1.0000000000
  1  3  3  1  1
 0.49000000000 1.0000000000
# CARBON
C  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 13575.349682 0.22245814352E-03
 2035.2333680 0.17232738252E-02
 463.22562359 0.89255715314E-02
 131.20019598 0.35727984502E-01
 42.853015891 0.11076259931
 15.584185766 0.24295627626
  1  0  0  2  1
 6.2067138508 0.41440263448
 2.5764896527 0.23744968655
  1  0  0  1  1
 0.57696339419 1.0000000000
  1  0  0  1  1
 0.22972831358 1.0000000000
  1  0  0  1  1
 0.95164440028E-01 1.0000000000
  1  1  1  4  1
 34.697232244 0.53333657805E-02
 7.9582622826 0.35864109092E-01
 2.3780826883 0.14215873329
 0.81433208183 0.34270471845
  1  1  1  1  1
 0.28887547253 0.46445822433
  1  1  1  1  1
 0.10056823671 0.24955789874
  1  2  2  1  1
 1.0970000000 1.0000000000
  1  2  2  1  1
 0.31800000000 1.0000000000
  1  3  3  1  1
 0.76100000000 1.0000000000
# NITROGEN
N  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 19730.800647 0.21887984991E-03
 2957.8958745 0.16960708803E-02
 673.22133595 0.87954603538E-02
 190.68249494 0.35359382605E-01
 62.295441898 0.11095789217
 22.654161182 0.24982972552
  1  0  0  2  1
 8.9791477428 0.40623896148
 3.6863002370 0.24338217176
  1  0  0  1  1
 0.84660076805 1.0000000000
  1  0  0  1  1
 0.33647133771 1.0000000000
  1  0  0  1  1
 0.13647653675 1.0000000000
  1  1  1  4  1
 49.200380510 0.55552416751E-02
 11.346790537 0.38052379723E-01
 3.4273972411 0.14953671029
 1.1785525134 0.34949305230
  1  1  1  1  1
 0.41642204972 0.45843153697
  1  1  1  1  1
 0.14260826011 0.24428771672
  1  2  2  1  1
 1.6540000000 1.0000000000
  1  2  2  1  1
 0.46900000000 1.0000000000
  1  3  3  1  1
 1.0930000000 1.0000000000
# OXYGEN
O  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 27032.382631 0.21726302465E-03
 4052.3871392 0.16838662199E-02
 922.32722710 0.87395616265E-02
 261.24070989 0.35239968808E-01
 85.354641351 0.11153519115
 31.035035245 0.25588953961
  1  0  0  2  1
 12.260860728 0.39768730901
 4.9987076005 0.24627849430
  1  0  0  1  1
 1.1703108158 1.0000000000
  1  0  0  1  1
 0.46474740994 1.0000000000
  1  0  0  1  1
 0.18504536357 1.0000000000
  1  1  1  4  1
 63.274954801 0.60685103418E-02
 14.627049379 0.41912575824E-01
 4.4501223456 0.16153841088
 1.5275799647 0.35706951311
  1  1  1  1  1
 0.52935117943 0.44794207502
  1  1  1  1  1
 0.17478421270 0.24446069663
  1  2  2  1  1
 2.3140000000 1.0000000000
  1  2  2  1  1
 0.64500000000 1.0000000000
  1  3  3  1  1
 1.4280000000 1.0000000000
# FLUORINE
F  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 35479.100441 0.21545014888E-03
 5318.4728983 0.16700686527E-02
 1210.4810975 0.86733211476E-02
 342.85518140 0.35049933175E-01
 112.01943181 0.11165320133
 40.714740248 0.25988506647
  1  0  0  2  1
 16.039678111 0.39422966880
 6.5038186740 0.24998238551
  1  0  0  1  1
 1.5440477509 1.0000000000
  1  0  0  1  1
 0.61223452862 1.0000000000
  1  0  0  1  1
 0.24027979698 1.0000000000
  1  1  1  4  1
 80.233900483 0.63685999134E-02
 18.594010743 0.44303143530E-01
 5.6867902653 0.16867248708
 1.9511006294 0.36166346255
  1  1  1  1  1
 0.66970211298 0.44202901491
  1  1  1  1  1
 0.21651300410 0.24319875730
  1  2  2  1  1
 3.1070000000 1.0000000000
  1  2  2  1  1
 0.85500000000 1.0000000000
  1  3  3  1  1
 1.9170000000 1.0000000000
# NEON
Ne  Ahlrichs-def2-TZVP
  11
  1  0  0  6  1
 45069.464022 0.21687155182E-03
 6755.9768656 0.16812736757E-02
 1537.6502864 0.87356062782E-02
 435.51697667 0.35361266922E-01
 142.28655638 0.11321521454
 51.692153804 0.26654653104
  1  0  0  2  1
 20.315870490 0.39631959951
 8.2021942646 0.25582811251
  1  0  0  1  1
 1.9681276278 1.0000000000
  1  0  0  1  1
 0.77904756001 1.0000000000
  1  0  0  1  1
 0.30229502043 1.0000000000
  1  1  1  4  1
 99.782996032 0.65569234163E-02
 23.176124101 0.45888009138E-01
 7.1163945872 0.17331287812
 2.4418711435 0.36475267512
  1  1  1  1  1
 0.83389605766 0.43831075171
  1  1  1  1  1
 0.26607311301 0.24160029835
  1  2  2  1  1
 4.0140000000 1.0000000000
  1  2  2  1  1
 1.0960000000 1.0000000000
  1  3  3  1  1
 2.5440000000 1.0000000000
# SODIUM
Na  Ahlrichs-def2-TZVP
  12
  1  0  0  7  1
 26041.109927 0.61806342811E-03
 3906.1268548 0.47748604414E-02
 888.97454993 0.24471684829E-01
 251.45497961 0.94755394977E-01
 81.650143512 0.26867496920
 28.904158401 0.47925475440
 10.625782932 0.33248591469
  1  0  0  3  1
 53.769410179 0.19527731872E-01
 16.308243025 0.92648010794E-01
 2.3730384125 -0.39938670172
  1  0  0  2  1
 0.95730772603 1.6428595391
 0.40806460959 0.55692596966
  1  0  0  1  1
 0.49967582329E-01 1.0000000000
  1  0  0  1  1
 0.19268616250E-01 1.0000000000
  1  1  1  5  1
 138.07979989 0.57951891929E-02
 32.232700393 0.41620846251E-01
 9.9816075360 0.16281916885
 3.4822033928 0.36011784647
 1.2299134620 0.44858979889
  1  1  1  1  1
 0.41743959423 0.23040759559
  1  1  1  1  1
 0.30000000000E-01 1.0000000000
  1  1  1  1  1
 0.91000000000E-01 1.0000000000
  1  2  2  1  1
 2.6090000000 1.0000000000
  1  2  2  1  1
 0.43000000000 1.0000000000
  1  2  2  1  1
 0.10000000000 1.0000000000
# MAGNESIUM
Mg  Ahlrichs-def2-TZVP
  12
  1  0  0  7  1
 31438.349555 0.60912311326E-03
 4715.5153354 0.47066196465E-02
 1073.1629247 0.24135820657E-01
 303.57238768 0.93628959834E-01
 98.626251042 0.26646742093
 34.943808417 0.47890929917
 12.859785199 0.33698490286
  1  0  0  3  1
 64.876913004 0.19180889307E-01
 19.725520777 0.90913704392E-01
 2.8951804339 -0.39563756125
  1  0  0  2  1
 1.1960454710 1.6827603373
 0.54329451156 0.52141091954
  1  0  0  1  1
 0.10099104092 1.0000000000
  1  0  0  1  1
 0.36865728085E-01 1.0000000000
  1  1  1  5  1
 179.87189612 0.53799549018E-02
 42.120069376 0.39318014098E-01
 13.120503032 0.15740129476
 4.6257503609 0.35919094128
 1.6695211016 0.45533379310
  1  1  1  1  1
 0.58551012105 0.21986432910
  1  1  1  1  1
 0.18914796195 1.0000000000
  1  1  1  1  1
 0.53768755187E-01 1.0000000000
  1  2  2  1  1
 3.4440000000 1.0000000000
  1  2  2  1  1
 0.29000000000 1.0000000000
  1  2  2  1  1
 0.70000000000E-01 1.0000000000
# ALUMINUM
Al  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 37792.550772 0.57047888709E-03
 5668.0682165 0.44093016538E-02
 1289.8582841 0.22630967411E-01
 364.86596028 0.88025644295E-01
 118.57631515 0.25223701612
 42.024867605 0.45960547169
 15.499501629 0.33277886014
  1  0  0  3  1
 75.208026598 0.19250560190E-01
 23.031408972 0.87906743952E-01
 3.6348797649 -0.34246704535
  1  0  0  2  1
 1.6065049957 1.5106266058
 0.76103394581 0.58071016470
  1  0  0  1  1
 0.16556708849 1.0000000000
  1  0  0  1  1
 0.60041577113E-01 1.0000000000
  1  1  1  5  1
 452.52303192 0.23110812466E-02
 107.08195049 0.18568641823E-01
 34.131021255 0.87216237035E-01
 12.587037428 0.26902101523
 4.9811919704 0.52128324272
  1  1  1  1  1
 2.0070350900 0.60271687494
  1  1  1  1  1
 0.80083714374 1.0000000000
  1  1  1  1  1
 0.20178927472 1.0000000000
  1  1  1  1  1
 0.57895550392E-01 1.0000000000
  1  2  2  2  1
 1.5700000000 0.20000000000
 0.33300000000 1.0000000000
  1  2  2  1  1
 0.11100000000 1.0000000000
  1  3  3  1  1
 0.24400000000 1.0000000000
# SILICON
Si  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 44773.358078 0.55914765868E-03
 6717.1992104 0.43206040189E-02
 1528.8960325 0.22187096460E-01
 432.54746585 0.86489249116E-01
 140.61505226 0.24939889716
 49.857636724 0.46017197366
 18.434974885 0.34250236575
  1  0  0  3  1
 86.533886111 0.21300063007E-01
 26.624606846 0.94676139318E-01
 4.4953057159 -0.32616264859
  1  0  0  2  1
 2.1035045710 1.3980803850
 1.0106094922 0.63865786699
  1  0  0  1  1
 0.23701751489 1.0000000000
  1  0  0  1  1
 0.85703405362E-01 1.0000000000
  1  1  1  5  1
 394.47503628 0.26285693959E-02
 93.137683104 0.20556257749E-01
 29.519608742 0.92070262801E-01
 10.781663791 0.25565889739
 4.1626574778 0.42111707185
  1  1  1  1  1
 1.6247972989 0.34401746318
  1  1  1  1  1
 0.54306660493 1.0000000000
  1  1  1  1  1
 0.20582073956 1.0000000000
  1  1  1  1  1
 0.70053487306E-01 1.0000000000
  1  2  2  2  1
 2.3030000000 0.20000000000
 0.47600000000 1.0000000000
  1  2  2  1  1
 0.16000000000 1.0000000000
  1  3  3  1  1
 0.33600000000 1.0000000000
# PHOSPHORUS
P  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 52426.999233 0.55207164100E-03
 7863.2660552 0.42678595308E-02
 1789.5227333 0.21931529186E-01
 506.27300165 0.85667168373E-01
 164.60698546 0.24840686605
 58.391918722 0.46336753971
 21.643663201 0.35350558156
  1  0  0  3  1
 99.013837620 0.21895679958E-01
 30.550439817 0.95650470295E-01
 5.4537087661 -0.29454270186
  1  0  0  2  1
 2.6503362563 1.3294381200
 1.2726688867 0.66109396473
  1  0  0  1  1
 0.31645005203 1.0000000000
  1  0  0  1  1
 0.11417466938 1.0000000000
  1  1  1  5  1
 472.27219248 0.25710623052E-02
 111.58882756 0.20250297999E-01
 35.445936418 0.91580716787E-01
 12.990776875 0.25749454014
 5.0486221658 0.42862899758
  1  1  1  1  1
 1.9934049566 0.34359817849
  1  1  1  1  1
 0.66527284430 1.0000000000
  1  1  1  1  1
 0.25516832128 1.0000000000
  1  1  1  1  1
 0.90357762251E-01 1.0000000000
  1  2  2  2  1
 3.1200000000 0.20000000000
 0.64800000000 1.0000000000
  1  2  2  1  1
 0.21800000000 1.0000000000
  1  3  3  1  1
 0.45200000000 1.0000000000
# SULFUR
S  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 60700.928104 0.54695944225E-03
 9102.6106854 0.42297224557E-02
 2071.4166009 0.21747824159E-01
 586.02476821 0.85100053589E-01
 190.55395021 0.24799128459
 67.630384260 0.46703640406
 25.127306905 0.36434587550
  1  0  0  3  1
 112.57463010 0.21670040240E-01
 34.795554217 0.93602301760E-01
 6.5115556215 -0.26068001422
  1  0  0  2  1
 3.2399032261 1.2842089435
 1.5477160881 0.66036416584
  1  0  0  1  1
 0.40541030112 1.0000000000
  1  0  0  1  1
 0.14550651059 1.0000000000
  1  1  1  5  1
 564.36716027 0.24796796317E-02
 133.42624379 0.19677930250E-01
 42.468271189 0.89980008258E-01
 15.616527580 0.25705880575
 6.1093988469 0.43515167292
  1  1  1  1  1
 2.4404160198 0.34883240595
  1  1  1  1  1
 0.83882201296 1.0000000000
  1  1  1  1  1
 0.31288746900 1.0000000000
  1  1  1  1  1
 0.10770109004 1.0000000000
  1  2  2  2  1
 3.7560000000 0.20000000000
 0.81200000000 1.0000000000
  1  2  2  1  1
 0.27300000000 1.0000000000
  1  3  3  1  1
 0.55700000000 1.0000000000
# CHLORINE
Cl  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 69507.990945 0.54314897497E-03
 10426.156880 0.41990463961E-02
 2373.2334061 0.21592141679E-01
 671.56420071 0.84598850094E-01
 218.41999790 0.24757249724
 77.572249714 0.47016930228
 28.888815277 0.37436370716
  1  0  0  3  1
 127.10527185 0.25182166603E-01
 39.339582961 0.10786112456
 7.6740679989 -0.27408821574
  1  0  0  2  1
 3.8745627630 1.3213875014
 1.8385832573 0.68636955368
  1  0  0  1  1
 0.50229057542 1.0000000000
  1  0  0  1  1
 0.17962723420 1.0000000000
  1  1  1  5  1
 666.50423284 0.23632663836E-02
 157.64241690 0.18879300374E-01
 50.262520978 0.87206341273E-01
 18.536078105 0.25285612970
 7.2940532777 0.43507154820
  1  1  1  1  1
 2.9433248995 0.35026513165
  1  1  1  1  1
 1.0404970818 1.0000000000
  1  1  1  1  1
 0.38456415080 1.0000000000
  1  1  1  1  1
 0.13069642732 1.0000000000
  1  2  2  2  1
 4.6100000000 0.20000000000
 1.0110000000 1.0000000000
  1  2  2  1  1
 0.33900000000 1.0000000000
  1  3  3  1  1
 0.70600000000 1.0000000000
# ARGON
Ar  Ahlrichs-def2-TZVP
  13
  1  0  0  7  1
 79111.422998 0.51029325002E-03
 11864.746009 0.39463036981E-02
 2700.1642973 0.20307073910E-01
 763.95943485 0.79691825214E-01
 248.45150561 0.23420623836
 88.283581000 0.44833849481
 32.948607069 0.36408167400
  1  0  0  3  1
 142.55358000 0.26387407001E-01
 44.163688009 0.11226433999
 8.9524995000 -0.26178922001
  1  0  0  2  1
 4.5546920941 1.3002484998
 2.1444079001 0.67197237009
  1  0  0  1  1
 0.60708777004 1.0000000000
  1  0  0  1  1
 0.21651431999 1.0000000000
  1  1  1  5  1
 776.77541998 0.22028005003E-02
 183.80107018 0.17694180008E-01
 58.694003175 0.82431293717E-01
 21.701591695 0.24207278863
 8.5821489635 0.42263558251
  1  1  1  1  1
 3.4922679161 0.34151806086
  1  1  1  1  1
 1.2637426998 1.0000000000
  1  1  1  1  1
 0.46607870005 1.0000000000
  1  1  1  1  1
 0.15766003000 1.0000000000
  1  2  2  2  1
 5.5510000000 0.20000000000
 1.2350000000 1.0000000000
  1  2  2  1  1
 0.41200000000 1.0000000000
  1  3  3  1  1
 0.89000000000 1.0000000000
# POTASSIUM
K  Ahlrichs-def2-TZVP
  13
  1  0  0  8  1
 153976.18325 0.23662636107E-03
 23082.497672 0.18342929137E-02
 5253.2344745 0.95310527769E-02
 1486.9550133 0.38638406980E-01
 484.06333726 0.12480768502
 173.56653980 0.29278861009
 67.116381464 0.40633425860
 26.339502054 0.20077215860
  1  0  0  4  1
 172.87693567 -0.24200960936E-01
 53.058649063 -0.11553095040
 7.9212753964 0.57455545175
 3.2108880472 0.57023185107
  1  0  0  2  1
 4.5662070895 -0.22615763466
 0.70209907282 0.75528392045
  1  0  0  1  1
 0.28258942635 1.0000000000
  1  0  0  1  1
 0.35805824617E-01 1.0000000000
  1  0  0  1  1
 0.15819213245E-01 1.0000000000
  1  1  1  6  1
 728.18449873 0.26150689792E-02
 172.13265061 0.20673630835E-01
 54.829847075 0.93205603870E-01
 20.166266494 0.25436518210
 7.8610728806 0.39131132810
 3.1105213132 0.22481345943
  1  1  1  3  1
 11.757337492 -0.25777289217E-01
 1.5139617411 0.57359428604
 0.58328591795 1.0798320002
  1  1  1  1  1
 0.21570478076 1.0000000000
  1  1  1  1  1
 0.41737000000E-01 1.0000000000
  1  2  2  1  1
 0.93000000000 1.0000000000
  1  2  2  1  1
 0.18000000000 1.0000000000
  1  2  2  1  1
 0.54000000000E-01 1.0000000000
# CALCIUM
Ca  Ahlrichs-def2-TZVP
  14
  1  0  0  8  1
 172517.32685 0.23317502546E-03
 25861.519275 0.18076521980E-02
 5885.6618668 0.93943844255E-02
 1665.9730031 0.38108409009E-01
 542.36718148 0.12331203853
 194.57803492 0.29004470954
 75.303597636 0.40587151157
 29.574062589 0.20398410743
  1  0  0  4  1
 191.20074660 -0.24419759759E-01
 58.840299883 -0.11547027448
 8.9642540845 0.56356636717
 3.6856960541 0.56709682704
  1  0  0  2  1
 5.2464289726 -0.22825334325
 0.84862621528 0.72625219172
  1  0  0  1  1
 0.36743300538 1.0000000000
  1  0  0  1  1
 0.66821582613E-01 1.0000000000
  1  0  0  1  1
 0.26759730445E-01 1.0000000000
  1  1  1  6  1
 836.97262058 0.25258346092E-02
 197.93040142 0.20076506686E-01
 63.135558054 0.91302987366E-01
 23.282687170 0.25247029915
 9.1176444932 0.39426326344
 3.6336120139 0.23011559492
  1  1  1  3  1
 13.494163120 -0.26495021951E-01
 1.8139259790 0.55088108210
 0.71981826006 1.0280616620
  1  1  1  1  1
 0.27629576992 1.0000000000
  1  1  1  1  1
 0.74979000000E-01 1.0000000000
  1  1  1  1  1
 0.26927000000E-01 1.0000000000
  1  2  2  2  1
 5.4979093879 0.73770011433E-01
 1.3177128032 0.26052853169
  1  2  2  1  1
 0.32188682649 0.45233836380
  1  2  2  1  1
 0.70528614919E-01 1.0000000000
# SCANDIUM
Sc  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 191612.91874 0.23076475942E-03
 28723.850363 0.17890329946E-02
 6537.0116490 0.92990401140E-02
 1850.3097171 0.37739438011E-01
 602.38855156 0.12227148359
 216.17324766 0.28814821470
 83.712517880 0.40517543099
 32.908707189 0.20566019623
  1  0  0  4  1
 211.34393234 -0.24527991462E-01
 65.128920139 -0.11570158142
 10.034311535 0.55995283317
 4.1596884597 0.56087765073
  1  0  0  2  1
 6.0009041613 -0.22840494325
 0.98255784150 0.71948970378
  1  0  0  1  1
 0.42483192773 1.0000000000
  1  0  0  1  1
 0.77185462096E-01 1.0000000000
  1  0  0  1  1
 0.30147219702E-01 1.0000000000
  1  1  1  6  1
 947.34122823 0.24737208744E-02
 224.09699732 0.19742967060E-01
 71.560334882 0.90357147549E-01
 26.444824490 0.25201602503
 10.393798285 0.39675535929
 4.1606304559 0.23208624517
  1  1  1  3  1
 15.565737135 -0.27129423974E-01
 2.1121544865 0.55109256629
 0.84184709021 1.0090635806
  1  1  1  1  1
 0.32297542652 1.0000000000
  1  1  1  1  1
 0.89748000000E-01 1.0000000000
  1  2  2  4  1
 30.989390993 0.11902837431E-01
 8.6905465069 0.67655856850E-01
 2.9520256337 0.21332539722
 1.0761910745 0.38391075578
  1  2  2  1  1
 0.38338915095 0.43354716259
  1  2  2  1  1
 0.12534686113 0.24509263822
  1  2  2  1  1
 0.41000000000E-01 1.0000000000
  1  3  3  1  1
 0.34500000000 1.0000000000
# TITANIUM
Ti  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 211575.69025 0.23318151011E-03
 31714.945058 0.18079690851E-02
 7217.5476543 0.93984311352E-02
 2042.9394247 0.38156853618E-01
 665.12896208 0.12374757197
 238.74942264 0.29208551143
 92.508691001 0.41226800855
 36.403919209 0.21090534061
  1  0  0  4  1
 232.72624607 -0.24920140738E-01
 71.791209711 -0.11746490087
 11.158534615 0.56503342318
 4.6548135416 0.56211101812
  1  0  0  2  1
 6.8034629174 -0.23011425503
 1.1201076403 0.72103186735
  1  0  0  1  1
 0.48080118839 1.0000000000
  1  0  0  1  1
 0.85157274977E-01 1.0000000000
  1  0  0  1  1
 0.32657477046E-01 1.0000000000
  1  1  1  6  1
 1063.1474732 0.24690839320E-02
 251.56507061 0.19773345523E-01
 80.408554854 0.90987976672E-01
 29.768193269 0.25559900413
 11.736830556 0.40489386764
 4.7142375230 0.23693402558
  1  1  1  3  1
 17.796803704 -0.27878639615E-01
 2.4272698680 0.55672914668
 0.96823445537 1.0055447350
  1  1  1  1  1
 0.37056694165 1.0000000000
  1  1  1  1  1
 0.10156100000 1.0000000000
  1  2  2  4  1
 37.713384723 0.11513835092E-01
 10.692931184 0.67246343996E-01
 3.6728446990 0.21484207775
 1.3588590303 0.38890892779
  1  2  2  1  1
 0.49213295253 0.43040835243
  1  2  2  1  1
 0.16330520653 0.23253305465
  1  2  2  1  1
 0.54000000000E-01 1.0000000000
  1  3  3  1  1
 0.56200000000 1.0000000000
# VANADIUM
V  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 232340.65058 0.23072410092E-03
 34828.841170 0.17888178962E-02
 7926.5448691 0.92992490131E-02
 2243.7733046 0.37761463347E-01
 730.59322944 0.12255909662
 262.32219631 0.28963508811
 101.70403805 0.41004702955
 40.064784617 0.21113610858
  1  0  0  4  1
 255.24014968 -0.24458116338E-01
 78.804646961 -0.11527205366
 12.340598946 0.55174749453
 5.1742019219 0.54504528489
  1  0  0  2  1
 7.6513894469 -0.22967638286
 1.2639759898 0.71683769077
  1  0  0  1  1
 0.53861761721 1.0000000000
  1  0  0  1  1
 0.92719296124E-01 1.0000000000
  1  0  0  1  1
 0.34998055176E-01 1.0000000000
  1  1  1  6  1
 1184.2369151 0.24449826729E-02
 280.23075192 0.19643454466E-01
 89.643627137 0.90796949190E-01
 33.242411253 0.25650768222
 13.144514452 0.40815393750
 5.2948534140 0.23860378268
  1  1  1  3  1
 20.175586851 -0.28241489023E-01
 2.7605865197 0.55574635619
 1.1008900902 0.99319919270
  1  1  1  1  1
 0.42013310739 1.0000000000
  1  1  1  1  1
 0.11124800000 1.0000000000
  1  2  2  4  1
 43.861134864 0.11487174238E-01
 12.516021891 0.68247153977E-01
 4.3313854957 0.21837784195
 1.6138855773 0.39245212296
  1  2  2  1  1
 0.58749573961 0.42634466786
  1  2  2  1  1
 0.19515723011 0.22646562601
  1  2  2  1  1
 0.65000000000E-01 1.0000000000
  1  3  3  1  1
 0.83100000000 1.0000000000
# CHROMIUM
Cr  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 254477.80704 0.23386945693E-03
 38131.797054 0.18142601800E-02
 8675.2930607 0.94363925721E-02
 2455.0099848 0.38343639367E-01
 799.16217787 0.12459194837
 286.90021489 0.29489696029
 111.25413232 0.41846149607
 43.864152636 0.21633763420
  1  0  0  4  1
 279.32669173 -0.23450908111E-01
 86.274732376 -0.11080370027
 13.555756113 0.53028965842
 5.6978112751 0.51603516947
  1  0  0  2  1
 8.5636582615 -0.38109545675
 1.3988296768 1.1991591436
  1  0  0  1  1
 0.57288171116 1.0000000000
  1  0  0  1  1
 0.90096171317E-01 1.0000000000
  1  0  0  1  1
 0.34125885135E-01 1.0000000000
  1  1  1  6  1
 1306.4398864 0.24277326185E-02
 309.25311441 0.19544041017E-01
 98.996273963 0.90651794553E-01
 36.756916451 0.25699279154
 14.566657077 0.40935504891
 5.8739937432 0.23729388849
  1  1  1  3  1
 22.890999695 -0.28166026613E-01
 3.0855001822 0.56034120148
 1.2132329118 0.98119019650
  1  1  1  1  1
 0.44931680699 1.0000000000
  1  1  1  1  1
 0.12067500000 1.0000000000
  1  2  2  4  1
 43.720074476 0.13622964026E-01
 12.391242652 0.78935180133E-01
 4.2639442006 0.23833840000
 1.5525221790 0.39526851122
  1  2  2  1  1
 0.53761929485 0.41061717056
  1  2  2  1  1
 0.16493173074 0.24440410795
  1  2  2  1  1
 0.51000000000E-01 1.0000000000
  1  3  3  1  1
 1.1470000000 1.0000000000
# MANGANESE
Mn  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 277185.00153 0.22838385133E-03
 41550.769890 0.17707650375E-02
 9455.9700152 0.92077209994E-02
 2676.5206482 0.37415971825E-01
 871.46687530 0.12164861426
 312.98306420 0.28824392499
 121.44454051 0.41041600847
 47.922598829 0.21372375145
  1  0  0  4  1
 303.66723163 -0.24589926140E-01
 93.881403187 -0.11602608038
 14.879421214 0.55112059677
 6.2865200745 0.53707560756
  1  0  0  2  1
 9.4858591337 -0.22889262695
 1.5698706158 0.71196169587
  1  0  0  1  1
 0.65903213608 1.0000000000
  1  0  0  1  1
 0.10686292371 1.0000000000
  1  0  0  1  1
 0.39267435433E-01 1.0000000000
  1  1  1  6  1
 1444.7978182 0.23994136455E-02
 342.06551197 0.19369286864E-01
 109.58400891 0.90236108988E-01
 40.747988173 0.25745467851
 16.188626566 0.41272351958
 6.5484505964 0.24087700007
  1  1  1  3  1
 25.357086437 -0.28707174058E-01
 3.4830168782 0.55208100712
 1.3858800906 0.97226901379
  1  1  1  1  1
 0.52555094893 1.0000000000
  1  1  1  1  1
 0.12765000000 1.0000000000
  1  2  2  4  1
 56.563189119 0.11543245295E-01
 16.278734711 0.70299845987E-01
 5.6964273914 0.22450770821
 2.1411147942 0.39703065434
  1  2  2  1  1
 0.78291801938 0.41941039165
  1  2  2  1  1
 0.25952311214 0.21887261673
  1  2  2  1  1
 0.86000000000E-01 1.0000000000
  1  3  3  1  1
 1.3260000000 1.0000000000
# IRON
Fe  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 300784.84637 0.22806273096E-03
 45088.970557 0.17681788761E-02
 10262.516317 0.91927083490E-02
 2905.2897293 0.37355495807E-01
 946.11487137 0.12151108426
 339.87832894 0.28818881468
 131.94425588 0.41126612677
 52.111494077 0.21518583573
  1  0  0  4  1
 329.48839267 -0.24745216477E-01
 101.92332739 -0.11683089050
 16.240462745 0.55293621136
 6.8840675801 0.53601640182
  1  0  0  2  1
 10.470693782 -0.22912708577
 1.7360039648 0.71159319984
  1  0  0  1  1
 0.72577288979 1.0000000000
  1  0  0  1  1
 0.11595528203 1.0000000000
  1  0  0  1  1
 0.41968227746E-01 1.0000000000
  1  1  1  6  1
 1585.3959970 0.23793960179E-02
 375.38006499 0.19253154755E-01
 120.31816501 0.90021836536E-01
 44.788749031 0.25798172356
 17.829278584 0.41492649744
 7.2247153786 0.24207474784
  1  1  1  3  1
 28.143219756 -0.29041755152E-01
 3.8743241412 0.55312260343
 1.5410752281 0.96771136842
  1  1  1  1  1
 0.58285615250 1.0000000000
  1  1  1  1  1
 0.13491500000 1.0000000000
  1  2  2  4  1
 61.996675034 0.11971972255E-01
 17.873732552 0.73210135410E-01
 6.2744782934 0.23103094314
 2.3552337175 0.39910706494
  1  2  2  1  1
 0.85432239901 0.41391589765
  1  2  2  1  1
 0.27869254413 0.21909269782
  1  2  2  1  1
 0.91000000000E-01 1.0000000000
  1  3  3  1  1
 1.5980000000 1.0000000000
# COBALT
Co  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 325817.01553 0.22568462484E-03
 48839.636453 0.17499397533E-02
 11114.937307 0.91003134097E-02
 3146.1603642 0.36996256837E-01
 1024.4378465 0.12044269621
 368.02508816 0.28598731649
 142.91229205 0.40908312004
 56.482649209 0.21500145739
  1  0  0  4  1
 356.40298318 -0.24767059678E-01
 110.31165215 -0.11702139134
 17.659634834 0.55215522200
 7.5059030479 0.53246877060
  1  0  0  2  1
 11.501807176 -0.22942470077
 1.9081994606 0.71180933514
  1  0  0  1  1
 0.79396696891 1.0000000000
  1  0  0  1  1
 0.12444448829 1.0000000000
  1  0  0  1  1
 0.44444645379E-01 1.0000000000
  1  1  1  6  1
 1731.1369144 0.23905767685E-02
 409.91750438 0.19382999967E-01
 131.45648578 0.90905448509E-01
 48.987439714 0.26146681577
 19.537078992 0.42157264570
 7.9287281634 0.24571813557
  1  1  1  3  1
 31.076017584 -0.29438069973E-01
 4.2835180697 0.55615568168
 1.7022921563 0.96772195064
  1  1  1  1  1
 0.64202908602 1.0000000000
  1  1  1  1  1
 0.14130800000 1.0000000000
  1  2  2  4  1
 68.140745239 0.11983845360E-01
 19.685241019 0.73688540475E-01
 6.9322128825 0.23085496779
 2.6025125694 0.39281059225
  1  2  2  1  1
 0.94016837302 0.40203412228
  1  2  2  1  1
 0.30381457794 0.21415606743
  1  2  2  1  1
 0.98000000000E-01 1.0000000000
  1  3  3  1  1
 1.9030000000 1.0000000000
# NICKEL
Ni  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 351535.72935 0.22529386884E-03
 52695.809283 0.17468616223E-02
 11992.468293 0.90849992136E-02
 3394.5776689 0.36940748447E-01
 1105.3594585 0.12032819950
 397.14677769 0.28596715057
 154.27542974 0.40983020196
 61.018723780 0.21620642851
  1  0  0  4  1
 384.45559739 -0.24651279268E-01
 119.04879199 -0.11658505277
 19.137012223 0.54864126676
 8.1526718562 0.52640051122
  1  0  0  2  1
 12.579408642 -0.22797884293
 2.0870866081 0.70703738215
  1  0  0  1  1
 0.86432568555 1.0000000000
  1  0  0  1  1
 0.13283169217 1.0000000000
  1  0  0  1  1
 0.46845327726E-01 1.0000000000
  1  1  1  6  1
 1883.0907486 0.23748258443E-02
 445.95155320 0.19289457172E-01
 143.08430815 0.90718211507E-01
 53.372920722 0.26181414117
 21.321919357 0.42309149832
 8.6643561994 0.24641686015
  1  1  1  3  1
 34.144255211 -0.29677129163E-01
 4.7122455921 0.55616824096
 1.8709231845 0.96357766460
  1  1  1  1  1
 0.70370016267 1.0000000000
  1  1  1  1  1
 0.14658800000 1.0000000000
  1  2  2  4  1
 74.591603465 0.12077454672E-01
 21.590632752 0.74637262154E-01
 7.6246142580 0.23236775502
 2.8632206762 0.39042651680
  1  2  2  1  1
 1.0311063388 0.39509498921
  1  2  2  1  1
 0.33060760691 0.21138769167
  1  2  2  1  1
 0.10600000000 1.0000000000
  1  3  3  1  1
 2.1740000000 1.0000000000
# COPPER
Cu  Ahlrichs-def2-TZVP
  15
  1  0  0  8  1
 377518.79923 0.22811766128E-03
 56589.984311 0.17688035931E-02
 12878.711706 0.91993460227E-02
 3645.3752143 0.37411016434E-01
 1187.0072945 0.12189873737
 426.46421902 0.28983900714
 165.70660164 0.41531872174
 65.598942707 0.21905799287
  1  0  0  4  1
 414.41265811 -0.24682525053E-01
 128.32056039 -0.11716827406
 20.622089750 0.55301315941
 8.7821226045 0.52242718609
  1  0  0  2  1
 13.741372006 -0.22736061821
 2.2431246833 0.71761210873
  1  0  0  1  1
 0.89370549079 1.0000000000
  1  0  0  1  1
 0.10836699534 1.0000000000
  1  0  0  1  1
 0.38806178058E-01 1.0000000000
  1  1  1  6  1
 2034.7596692 0.23524822298E-02
 481.90468106 0.19134070751E-01
 154.67482963 0.90171105278E-01
 57.740576969 0.26063284735
 23.099052811 0.42093485770
 9.3882478591 0.24344615121
  1  1  1  3  1
 37.596171210 -0.28991094530E-01
 5.1240690810 0.54919083831
 2.0119996085 0.93793330488
  1  1  1  1  1
 0.73860686002 1.0000000000
  1  1  1  1  1
 0.15506500000 1.0000000000
  1  2  2  4  1
 74.129460637 0.14363216676E-01
 21.359842587 0.86628177096E-01
 7.4995240537 0.25631430541
 2.7601394169 0.40374062368
  1  2  2  1  1
 0.95362061236 0.39427042447
  1  2  2  1  1
 0.28420862520 0.23091146816
  1  2  2  1  1
 0.85000000000E-01 1.0000000000
  1  3  3  1  1
 2.2330000000 1.0000000000
# ZINC
Zn  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 405924.31028 0.22442017483E-03
 60846.955735 0.17402086626E-02
 13847.343092 0.90513339565E-02
 3919.6158551 0.36817341445E-01
 1276.3594167 0.12004850256
 458.67254435 0.28576057621
 178.28725246 0.41087462062
 70.612192837 0.21816962456
  1  0  0  4  1
 443.88077950 -0.24934274984E-01
 137.55875267 -0.11817955766
 22.268083479 0.55367318468
 9.5217310606 0.52628934936
  1  0  0  2  1
 14.874114065 -0.22929955254
 2.4647517612 0.71135484742
  1  0  0  1  1
 1.0113272238 1.0000000000
  1  0  0  1  1
 0.14919852089 1.0000000000
  1  0  0  1  1
 0.51441872981E-01 1.0000000000
  1  1  1  6  1
 2205.3508534 0.23356240448E-02
 522.35300699 0.19031022634E-01
 167.73055542 0.89955758675E-01
 62.670045373 0.26113248631
 25.109749456 0.42348448173
 10.225142681 0.24618926885
  1  1  1  3  1
 40.713442521 -0.30029667592E-01
 5.6247090696 0.55575254864
 2.2279949116 0.95581013442
  1  1  1  1  1
 0.83354741691 1.0000000000
  1  1  1  1  1
 0.16245500000 1.0000000000
  1  1  1  1  1
 0.47769000000E-01 1.0000000000
  1  2  2  4  1
 88.554315311 0.12728170015E-01
 25.721525557 0.79394499843E-01
 9.1278367624 0.24491506805
 3.4312364064 0.40390526479
  1  2  2  1  1
 1.2308920645 0.40158491145
  1  2  2  1  1
 0.39031845112 0.21579805034
  1  2  2  1  1
 0.12400000000 1.0000000000
  1  3  3  1  1
 2.6140000000 1.0000000000
# GALLIUM
Ga  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 435548.66254 0.23646329650E-03
 65289.589031 0.18335271776E-02
 14858.784256 0.95371863081E-02
 4205.9734729 0.38803412468E-01
 1369.6416431 0.12661604848
 492.30348905 0.30175310292
 191.41923233 0.43543934218
 75.840558665 0.23282363780
  1  0  0  4  1
 474.30810613 -0.26743707958E-01
 147.10297560 -0.12654657542
 23.982599435 0.58840346839
 10.298230094 0.56324271589
  1  0  0  2  1
 16.050381430 -0.24516439508
 2.6988468784 0.74578049593
  1  0  0  1  1
 1.1428588736 1.0000000000
  1  0  0  1  1
 0.20217652251 1.0000000000
  1  0  0  1  1
 0.71980152032E-01 1.0000000000
  1  1  1  6  1
 2432.0171070 0.22434065928E-02
 576.12049582 0.18342265336E-01
 185.11584354 0.87279697167E-01
 69.246572556 0.25684868351
 27.818107777 0.42398378107
 11.420229938 0.25701340043
  1  1  1  3  1
 42.819661530 -0.19326519119E-01
 6.3885901000 0.31571386917
 2.6698993326 0.57617792822
  1  1  1  1  1
 1.0781783834 1.0000000000
  1  1  1  1  1
 0.22796559371 1.0000000000
  1  1  1  1  1
 0.62836234833E-01 1.0000000000
  1  2  2  5  1
 103.92331829 0.11464613652E-01
 30.371094389 0.73625747383E-01
 10.872078097 0.23505107382
 4.1549137954 0.40318563513
 1.5345659145 0.40824748152
  1  2  2  1  1
 0.51114263830 0.20502439263
  1  2  2  1  1
 0.30622000000 1.0000000000
  1  2  2  1  1
 0.11391309000 1.0000000000
  1  3  3  1  1
 0.30996095000 1.0000000000
# GERMANIUM
Ge  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 466115.00592 0.22487264660E-03
 69875.420762 0.17435426729E-02
 15903.276716 0.90691482206E-02
 4501.8233453 0.36906174685E-01
 1466.0570924 0.12050167907
 527.07841728 0.28748641703
 205.00395074 0.41622321885
 81.251596065 0.22397845695
  1  0  0  4  1
 505.74661282 -0.25184609291E-01
 156.96593744 -0.11898929721
 25.761448176 0.54930135870
 11.106654687 0.52939309129
  1  0  0  2  1
 17.272059104 -0.22854595728
 2.9438289048 0.68377930317
  1  0  0  1  1
 1.2839164916 1.0000000000
  1  0  0  1  1
 0.25873337445 1.0000000000
  1  0  0  1  1
 0.93524913177E-01 1.0000000000
  1  1  1  6  1
 2633.9346241 0.22143925310E-02
 624.00161628 0.18140899141E-01
 200.58528404 0.86632184922E-01
 75.097081525 0.25649020592
 30.214388474 0.42658611262
 12.440087567 0.26200527313
  1  1  1  3  1
 45.981316002 -0.20321767678E-01
 6.9945654416 0.32013744527
 2.9686001327 0.59051014555
  1  1  1  1  1
 1.2320988495 1.0000000000
  1  1  1  1  1
 0.28981614974 1.0000000000
  1  1  1  1  1
 0.85564606447E-01 1.0000000000
  1  2  2  5  1
 119.44887581 0.10586544521E-01
 35.062915293 0.69601280945E-01
 12.636924529 0.22807035287
 4.8888672922 0.40301067220
 1.8453195392 0.41304847015
  1  2  2  1  1
 0.63571158892 0.19639209740
  1  2  2  1  1
 0.35492132000 1.0000000000
  1  2  2  1  1
 0.13155709000 1.0000000000
  1  3  3  1  1
 0.36210645000 1.0000000000
# ARSENIC
As  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 498032.42158 0.22740196900E-03
 74656.868743 0.17632816413E-02
 16990.960004 0.91728040381E-02
 4809.6200321 0.37337829344E-01
 1566.2887055 0.12199536117
 563.21360499 0.29137475324
 219.11179978 0.42326351479
 86.866061030 0.22921464278
  1  0  0  4  1
 538.19512479 -0.25254197297E-01
 167.14850224 -0.11915461115
 27.605517159 0.54628495980
 11.947858521 0.53001520976
  1  0  0  2  1
 18.538023133 -0.23479188136
 3.2018985739 0.69167053428
  1  0  0  1  1
 1.4356522077 1.0000000000
  1  0  0  1  1
 0.31837805200 1.0000000000
  1  0  0  1  1
 0.11622632186 1.0000000000
  1  1  1  6  1
 2678.9421546 0.23318955287E-02
 634.61765840 0.19042149977E-01
 203.93967606 0.90229744913E-01
 76.323890369 0.26169037693
 30.664124943 0.41857168155
 12.505056732 0.23447830190
  1  1  1  4  1
 49.256229549 -0.21235539870E-01
 7.7274891466 0.30470206668
 3.5410493476 0.52888373107
 1.6985585501 0.37272250955
  1  1  1  1  1
 0.76848071044 1.0000000000
  1  1  1  1  1
 0.30050823260 1.0000000000
  1  1  1  1  1
 0.98190639437E-01 1.0000000000
  1  2  2  5  1
 135.33289305 0.99291144106E-02
 39.860212744 0.66568843496E-01
 14.446428359 0.22275768307
 5.6432900356 0.40309224382
 2.1668188623 0.41671667946
  1  2  2  1  1
 0.76514970569 0.18935502288
  1  2  2  1  1
 0.42434653000 1.0000000000
  1  2  2  1  1
 0.16331527000 1.0000000000
  1  3  3  1  1
 0.43271941000 1.0000000000
# SELENIUM
Se  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 531071.66696 0.24108973168E-03
 79603.044117 0.18696431441E-02
 18115.844240 0.97271616536E-02
 5127.8923194 0.39604793031E-01
 1669.9130839 0.12948855136
 600.57534527 0.30959437289
 233.70021247 0.45115769216
 92.672443932 0.24579189033
  1  0  0  4  1
 571.57513675 -0.26895707881E-01
 177.63686375 -0.12670989353
 29.517767052 0.57699001719
 12.824399795 0.56369075408
  1  0  0  2  1
 19.848235841 -0.25132415534
 3.4744018486 0.72905416980
  1  0  0  1  1
 1.5988910849 1.0000000000
  1  0  0  1  1
 0.38333469387 1.0000000000
  1  0  0  1  1
 0.14049742459 1.0000000000
  1  1  1  6  1
 2815.3500566 0.25569026854E-02
 666.92558298 0.20874026901E-01
 214.34213188 0.98772096250E-01
 80.246687942 0.28471821221
 32.251081288 0.45003584934
 13.106432562 0.24416091055
  1  1  1  4  1
 53.366108516 -0.21558456273E-01
 8.1827777195 0.32662310638
 3.6239945672 0.57740499319
 1.6341591401 0.34301320826
  1  1  1  1  1
 0.58418320228 1.0000000000
  1  1  1  1  1
 0.23966269279 1.0000000000
  1  1  1  1  1
 0.88785134803E-01 1.0000000000
  1  2  2  5  1
 151.82910279 0.93970276988E-02
 44.839992523 0.64086503991E-01
 16.328999510 0.21834238004
 6.4305057612 0.40314789649
 2.5048025169 0.41966491490
  1  2  2  1  1
 0.90271148434 0.18366663432
  1  2  2  1  1
 0.47683613000 1.0000000000
  1  2  2  1  1
 0.18535160000 1.0000000000
  1  3  3  1  1
 0.48866905000 1.0000000000
# BROMINE
Br  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 565073.25256 0.23660314690E-03
 84701.723179 0.18348332508E-02
 19276.271900 0.95465849860E-02
 5456.4284576 0.38877142153E-01
 1776.9503500 0.12718314231
 639.19398276 0.30437662191
 248.78823961 0.44490940497
 98.678305494 0.24381643058
  1  0  0  4  1
 606.07824568 -0.26527158709E-01
 188.45598484 -0.12484584809
 31.497144506 0.56468683559
 13.736008320 0.55555268564
  1  0  0  2  1
 21.203212766 -0.24940920493
 3.7616420178 0.71213119743
  1  0  0  1  1
 1.7735933962 1.0000000000
  1  0  0  1  1
 0.45197413664 1.0000000000
  1  0  0  1  1
 0.16613377099 1.0000000000
  1  1  1  6  1
 3019.6955723 0.24971049798E-02
 715.35481126 0.20419267596E-01
 229.98328751 0.96897148309E-01
 86.167844615 0.28053901252
 34.667870802 0.44606390473
 14.113870307 0.24410073923
  1  1  1  4  1
 57.085653082 -0.21855950710E-01
 8.8193845840 0.32707075320
 3.9340302872 0.57855229520
 1.7998830384 0.33570987698
  1  1  1  1  1
 0.66899410512 1.0000000000
  1  1  1  1  1
 0.27136238231 1.0000000000
  1  1  1  1  1
 0.10083790243 1.0000000000
  1  2  2  5  1
 168.85370257 0.89663981988E-02
 49.977949919 0.62062059316E-01
 18.274913338 0.21474732384
 7.2455694631 0.40335336746
 2.8562315025 0.42208813080
  1  2  2  1  1
 1.0459621144 0.17874813267
  1  2  2  1  1
 0.56865655000 1.0000000000
  1  2  2  1  1
 0.22031490000 1.0000000000
  1  3  3  1  1
 0.57083312000 1.0000000000
# KRYPTON
Kr  Ahlrichs-def2-TZVP
  16
  1  0  0  8  1
 600250.97575 0.23740610399E-03
 89976.650781 0.18410240539E-02
 20476.814225 0.95795580699E-02
 5796.1554078 0.39020650488E-01
 1887.5913196 0.12772645628
 679.11458519 0.30596521300
 264.38244511 0.44857474437
 104.88368574 0.24722957327
  1  0  0  4  1
 641.47370764 -0.26745279805E-01
 199.57524820 -0.12571122567
 33.545462954 0.56483736390
 14.683955144 0.55972765539
  1  0  0  2  1
 22.603101860 -0.25298771800
 4.0650682991 0.70992159965
  1  0  0  1  1
 1.9611027060 1.0000000000
  1  0  0  1  1
 0.52465147979 1.0000000000
  1  0  0  1  1
 0.19332399511 1.0000000000
  1  1  1  6  1
 3232.9589614 0.24885607974E-02
 765.96442694 0.20379007428E-01
 246.33940810 0.96977188584E-01
 92.365283041 0.28199960954
 37.199509551 0.45116254358
 15.172166534 0.24917131496
  1  1  1  4  1
 60.931321698 -0.22173603519E-01
 9.4792600646 0.32838462778
 4.2564686326 0.58124997120
 1.9729313762 0.32863541783
  1  1  1  1  1
 0.76337108716 1.0000000000
  1  1  1  1  1
 0.30943625526 1.0000000000
  1  1  1  1  1
 0.11569704458 1.0000000000
  1  2  2  5  1
 186.41760904 0.86120284601E-02
 55.274124345 0.60394406304E-01
 20.283219120 0.21181331869
 8.0884536976 0.40366293413
 3.2214033853 0.42402860686
  1  2  2  1  1
 1.1952170102 0.17441742274
  1  2  2  1  1
 0.64800000000 1.0000000000
  1  2  2  1  1
 0.25100000000 1.0000000000
  1  3  3  1  1
 0.62800000000 1.0000000000
#  Def2-QZVP  EMSL  Basis Set Exchange Library  11/25/09 4:23 AM
# Elements                             References
# --------                             ----------
# H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te I Xe Cs Ba La Hf Ta W Re Os Ir Pt Au Hg Tl Pb Bi Po At Rn : F. Weigend and R. Ahlrichs, Phys. Chem. Chem. Phys. 7, 3297 (2005)
#
# HYDROGEN
H  Ahlrichs-def2-QZVP
 10
  1  0  0  4  1
        190.69169000          0.00070815
         28.60553200          0.00546788
          6.50959430          0.02796660
          1.84124550          0.10764538
  1  0  0  1  1
          0.59853725          1.00000000
  1  0  0  1  1
          0.21397624          1.00000000
  1  0  0  1  1
          0.08031629          1.00000000
  1  1  1  1  1
          2.29200000          1.00000000
  1  1  1  1  1
          0.83800000          1.00000000
  1  1  1  1  1
          0.29200000          1.00000000
  1  2  2  1  1
          2.06200000          1.00000000
  1  2  2  1  1
          0.66200000          1.00000000
  1  3  3  1  1
          1.39700000          1.00000000
# HELIUM
He Ahlrichs-def2-QZVP
 10
  1  0  0  5  1
       1144.64708090          0.00035862
        171.64596667          0.00277254
         39.06605625          0.01424189
         11.05140199          0.05545735
          3.57255745          0.16170512
  1  0  0  1  1
          1.24294160          1.00000000
  1  0  0  1  1
          0.44807669          1.00000000
  1  0  0  1  1
          0.16411579          1.00000000
  1  1  1  1  1
          5.99400000          1.00000000
  1  1  1  1  1
          1.74500000          1.00000000
  1  1  1  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          4.29900000          1.00000000
  1  2  2  1  1
          1.22300000          1.00000000
  1  3  3  1  1
          2.68000000          1.00000000
# LITHIUM
Li Ahlrichs-def2-QZVP
 13
  1  0  0  9  1
      14853.97708500          0.00004271
       2225.22364770          0.00033235
        504.88739008          0.00175184
        142.45847548          0.00734780
         46.31559958          0.02589984
         16.65533547          0.07667068
          6.43311862          0.18276076
          2.60270439          0.32655434
          1.08972454          0.37000430
  1  0  0  2  1
          4.42365960          0.11120988
          1.23563950          0.79987336
  1  0  0  1  1
          0.46067471          1.00000000
  1  0  0  1  1
          0.09661717          1.00000000
  1  0  0  1  1
          0.04591545          1.00000000
  1  0  0  1  1
          0.02114005          1.00000000
  1  1  1  3  1
          3.26051092          0.00865047
          0.65003043          0.04761412
          0.16941671          0.21001138
  1  1  1  1  1
          0.05573234          1.00000000
  1  1  1  1  1
          0.02048996          1.00000000
  1  1  1  1  1
          3.32700000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  2  2  1  1
          0.07570000          1.00000000
  1  3  3  1  1
          0.13500000          1.00000000
# BERYLLIUM
Be Ahlrichs-def2-QZVP
 14
  1  0  0  8  1
      29646.70440700          0.00003794
       4428.76143540          0.00029605
       1005.47013320          0.00155725
        284.15339578          0.00653232
         92.50435646          0.02311686
         33.31101606          0.06945852
         12.91155331          0.17014371
          5.26654974          0.31682711
  1  0  0  2  1
         22.99538638          0.08179112
          6.62363542          0.80000038
  1  0  0  1  1
          2.22895950          1.00000000
  1  0  0  1  1
          0.95302433          1.00000000
  1  0  0  1  1
          0.24651602          1.00000000
  1  0  0  1  1
          0.10153895          1.00000000
  1  0  0  1  1
          0.04155137          1.00000000
  1  1  1  4  1
         14.09978945          0.00385089
          3.18031885          0.02415238
          0.90489220          0.09792693
          0.30411586          0.29470380
  1  1  1  1  1
          0.11302607          1.00000000
  1  1  1  1  1
          0.04283173          1.00000000
  1  1  1  1  1
          6.40000000          1.00000000
  1  2  2  1  1
          0.36000000          1.00000000
  1  2  2  1  1
          0.09000000          1.00000000
  1  3  3  1  1
          0.29000000          1.00000000
# BORON
B  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      46447.66705600          0.00003839
       6957.68890420          0.00029837
       1583.44284030          0.00156455
        448.46601009          0.00654768
        146.28639262          0.02313901
         52.78438608          0.06961580
         20.51939617          0.17119637
          8.41856593          0.31913192
  1  0  0  2  1
         36.51001831          0.07899062
         10.54185400          0.78926384
  1  0  0  1  1
          3.60040914          1.00000000
  1  0  0  1  1
          1.56170237          1.00000000
  1  0  0  1  1
          0.44997371          1.00000000
  1  0  0  1  1
          0.18075230          1.00000000
  1  0  0  1  1
          0.07159670          1.00000000
  1  1  1  5  1
         72.24046276          0.00086539
         16.80770721          0.00687621
          5.22594107          0.03097669
          1.85083507          0.10432358
          0.72206783          0.26164138
  1  1  1  1  1
          0.29491018          1.00000000
  1  1  1  1  1
          0.12201142          1.00000000
  1  1  1  1  1
          0.04986539          1.00000000
  1  2  2  1  1
          1.11000000          1.00000000
  1  2  2  1  1
          0.40200000          1.00000000
  1  2  2  1  1
          0.14500000          1.00000000
  1  3  3  1  1
          0.88200000          1.00000000
  1  3  3  1  1
          0.31100000          1.00000000
  1  4  4  1  1
          0.67300000          1.00000000
# CARBON
C  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      67025.07102900          0.00003874
      10039.98653800          0.00030108
       2284.93169110          0.00157879
        647.14122130          0.00660871
        211.09472335          0.02336712
         76.17764386          0.07042072
         29.63383916          0.17360345
         12.18778508          0.32292306
  1  0  0  2  1
         53.02600630          0.07489740
         15.25850278          0.76136221
  1  0  0  1  1
          5.24039575          1.00000000
  1  0  0  1  1
          2.29050224          1.00000000
  1  0  0  1  1
          0.69673283          1.00000000
  1  0  0  1  1
          0.27599337          1.00000000
  1  0  0  1  1
          0.10739884          1.00000000
  1  1  1  5  1
        105.12555082          0.00084648
         24.88446107          0.00662740
          7.86372308          0.03012039
          2.84070018          0.09995144
          1.12271373          0.23826299
  1  1  1  1  1
          0.46050726          1.00000000
  1  1  1  1  1
          0.18937531          1.00000000
  1  1  1  1  1
          0.07598379          1.00000000
  1  2  2  1  1
          1.84800000          1.00000000
  1  2  2  1  1
          0.64900000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
  1  3  3  1  1
          1.41900000          1.00000000
  1  3  3  1  1
          0.48500000          1.00000000
  1  4  4  1  1
          1.01100000          1.00000000
# NITROGEN
N  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      90726.88921000          0.00003926
      13590.52880100          0.00030513
       3092.98837810          0.00160006
        875.99876362          0.00669829
        285.74469982          0.02369008
        103.11913417          0.07145541
         40.12855678          0.17632775
         16.52809570          0.32677593
  1  0  0  2  1
         69.39096098          0.08005209
         20.42820060          0.78268064
  1  0  0  1  1
          7.12925880          1.00000000
  1  0  0  1  1
          3.13243049          1.00000000
  1  0  0  1  1
          0.98755779          1.00000000
  1  0  0  1  1
          0.38765721          1.00000000
  1  0  0  1  1
          0.14909883          1.00000000
  1  1  1  5  1
        150.05742670         -0.00086216
         35.49159948         -0.00685713
         11.24786422         -0.03179569
          4.09003052         -0.10537397
          1.62205731         -0.24519708
  1  1  1  1  1
          0.66442262          1.00000000
  1  1  1  1  1
          0.27099770          1.00000000
  1  1  1  1  1
          0.10688750          1.00000000
  1  2  2  1  1
          2.83700000          1.00000000
  1  2  2  1  1
          0.96800000          1.00000000
  1  2  2  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          2.02700000          1.00000000
  1  3  3  1  1
          0.68500000          1.00000000
  1  4  4  1  1
          1.42700000          1.00000000
# OXYGEN
O  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     116506.46908000          0.00004038
      17504.34972400          0.00031255
       3993.45132300          0.00163415
       1133.00631860          0.00682832
        369.99569594          0.02412441
        133.62074349          0.07273021
         52.03564365          0.17934430
         21.46193931          0.33059589
  1  0  0  2  1
         89.83505125          0.09646865
         26.42801084          0.94117481
  1  0  0  1  1
          9.28228246          1.00000000
  1  0  0  1  1
          4.09477285          1.00000000
  1  0  0  1  1
          1.32553491          1.00000000
  1  0  0  1  1
          0.51877231          1.00000000
  1  0  0  1  1
          0.19772676          1.00000000
  1  1  1  5  1
        191.15255810          0.00251157
         45.23335674          0.02003924
         14.35346592          0.09360906
          5.24223718          0.30618127
          2.07924186          0.67810501
  1  1  1  1  1
          0.84282371          1.00000000
  1  1  1  1  1
          0.33617695          1.00000000
  1  1  1  1  1
          0.12863998          1.00000000
  1  2  2  1  1
          3.77500000          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.44400000          1.00000000
  1  3  3  1  1
          2.66600000          1.00000000
  1  3  3  1  1
          0.85900000          1.00000000
  1  4  4  1  1
          1.84600000          1.00000000
# FLUORINE
F  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     132535.97345000          0.00004739
      19758.11258800          0.00037070
       4485.19969470          0.00194508
       1273.81510200          0.00805733
        418.93831236          0.02799288
        152.55721985          0.08273512
         59.82152482          0.19854169
         24.81907693          0.34860632
  1  0  0  2  1
        100.74446673          0.10505069
         30.10372829          0.94068472
  1  0  0  1  1
         10.81428327          1.00000000
  1  0  0  1  1
          4.81728868          1.00000000
  1  0  0  1  1
          1.65593342          1.00000000
  1  0  0  1  1
          0.64893520          1.00000000
  1  0  0  1  1
          0.24778105          1.00000000
  1  1  1  5  1
        240.96654114          0.00303899
         57.02069978          0.02435774
         18.12695212          0.11442926
          6.64574046          0.37064660
          2.63757229          0.79791552
  1  1  1  1  1
          1.06382172          1.00000000
  1  1  1  1  1
          0.41932563          1.00000000
  1  1  1  1  1
          0.15747588          1.00000000
  1  2  2  1  1
          5.01400000          1.00000000
  1  2  2  1  1
          1.72500000          1.00000000
  1  2  2  1  1
          0.58600000          1.00000000
  1  3  3  1  1
          3.56200000          1.00000000
  1  3  3  1  1
          1.14800000          1.00000000
  1  4  4  1  1
          2.37600000          1.00000000
# NEON
Ne Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     160676.27955000          0.00004739
      23953.19503900          0.00037070
       5437.50637110          0.00194508
       1544.27410240          0.00805733
        507.88814269          0.02799288
        184.94847750          0.08273512
         72.52295204          0.19854169
         30.08871357          0.34860632
  1  0  0  2  1
        120.68434940          0.10400597
         36.07429486          0.91999989
  1  0  0  1  1
         13.05209121          1.00000000
  1  0  0  1  1
          5.79747834          1.00000000
  1  0  0  1  1
          2.04786269          1.00000000
  1  0  0  1  1
          0.80214572          1.00000000
  1  0  0  1  1
          0.30548672          1.00000000
  1  1  1  6  1
        498.43397466          0.00043118
        118.14109217          0.00362064
         38.03252973          0.01824534
         14.18373195          0.06513304
          5.78641907          0.16708915
          2.45996222          0.29268020
  1  1  1  1  1
          1.04219995          1.00000000
  1  1  1  1  1
          0.42987749          1.00000000
  1  1  1  1  1
          0.16889708          1.00000000
  1  2  2  1  1
          6.47100000          1.00000000
  1  2  2  1  1
          2.21300000          1.00000000
  1  2  2  1  1
          0.74700000          1.00000000
  1  3  3  1  1
          4.65700000          1.00000000
  1  3  3  1  1
          1.52400000          1.00000000
  1  4  4  1  1
          2.98300000          1.00000000
# SODIUM
Na Ahlrichs-def2-QZVP
 18
  1  0  0 10  1
     379852.20081000          0.00002067
      56886.00637800          0.00016070
      12942.70183800          0.00084463
       3664.30179040          0.00355190
       1194.74174990          0.01275403
        430.98192917          0.03989546
        167.83169424          0.10720154
         69.30666904          0.23339517
         29.95117089          0.36333077
         13.38079110          0.30544771
  1  0  0  3  1
        121.74011283          0.03614243
         37.04414339          0.28820962
         13.99542262          0.79337385
  1  0  0  1  1
          5.98277974          1.00000000
  1  0  0  1  1
          2.48304551          1.00000000
  1  0  0  1  1
          1.04525062          1.00000000
  1  0  0  1  1
          0.43875640          1.00000000
  1  0  0  1  1
          0.06559563          1.00000000
  1  0  0  1  1
          0.03056193          1.00000000
  1  0  0  1  1
          0.01550906          1.00000000
  1  1  1  8  1
        690.77627017          0.00037479
        163.82806121          0.00317754
         52.87646077          0.01633358
         19.81227049          0.05975490
          8.13203788          0.15879329
          3.49690684          0.29049363
          1.51172441          0.36368131
          0.64479295          0.28195867
  1  1  1  1  1
          0.26145823          1.00000000
  1  1  1  1  1
          0.11704726          1.00000000
  1  1  1  1  1
          0.04049475          1.00000000
  1  1  1  1  1
          0.01566671          1.00000000
  1  2  2  1  1
          2.90000000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  2  2  1  1
          0.07570000          1.00000000
  1  3  3  1  1
          0.13500000          1.00000000
# MAGNESIUM
Mg Ahlrichs-def2-QZVP
 19
  1  0  0 10  1
     605967.78753000          0.00001443
      90569.09469200          0.00011250
      20574.25284400          0.00059265
       5818.62848650          0.00249888
       1895.62960750          0.00902308
        683.45941021          0.02857992
        266.18219762          0.07906445
        110.11220010          0.18269338
         47.77704123          0.32157194
         21.54216615          0.35028259
  1  0  0  3  1
        174.12136378          0.02293111
         53.48497250          0.19151778
         20.50021331          0.61155711
  1  0  0  1  1
          9.80568269          1.00000000
  1  0  0  1  1
          3.54029893          1.00000000
  1  0  0  1  1
          1.54508500          1.00000000
  1  0  0  1  1
          0.66540195          1.00000000
  1  0  0  1  1
          0.14355439          1.00000000
  1  0  0  1  1
          0.06662467          1.00000000
  1  0  0  1  1
          0.02977265          1.00000000
  1  1  1  8  1
        893.20460829          0.00034958
        211.78258286          0.00298119
         68.44320054          0.01551785
         25.72726535          0.05757866
         10.60663428          0.15610308
          4.59341265          0.29230913
          2.01004698          0.37219024
          0.87384842          0.27578089
  1  1  1  1  1
          0.35615077          1.00000000
  1  1  1  1  1
          0.18995954          1.00000000
  1  1  1  1  1
          0.07458014          1.00000000
  1  1  1  1  1
          0.02922164          1.00000000
  1  2  2  1  1
          3.81000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05200000          1.00000000
  1  3  3  1  1
          0.16000000          1.00000000
# ALUMINUM
Al Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
     754550.78265000          0.00001342
     112999.38922000          0.00010433
      25715.83175900          0.00054842
       7283.60302830          0.00230891
       2376.00087960          0.00833100
        857.65468087          0.02641796
        334.38922598          0.07344365
        138.48504731          0.17184039
         60.15036881          0.31041980
         27.12761086          0.35669191
  1  0  0  3  1
        225.36500065          0.02152204
         69.34196812          0.18531780
         26.61933571          0.63533181
  1  0  0  1  1
         12.34942067          1.00000000
  1  0  0  1  1
          4.58787860          1.00000000
  1  0  0  1  1
          2.05713381          1.00000000
  1  0  0  1  1
          0.90864549          1.00000000
  1  0  0  1  1
          0.24226988          1.00000000
  1  0  0  1  1
          0.11248137          1.00000000
  1  0  0  1  1
          0.04815649          1.00000000
  1  1  1  8  1
       1489.61195220          0.00020177
        353.01399267          0.00175081
        114.40764069          0.00944247
         43.31218611          0.03686800
         18.02732222          0.10892874
          7.96754324          0.23265901
          3.60903995          0.34643587
          1.64560816          0.33440810
  1  1  1  2  1
         34.73118749          0.01782307
          1.25530836         -0.59991264
  1  1  1  1  1
          0.73635534          1.00000000
  1  1  1  1  1
          0.24686466          1.00000000
  1  1  1  1  1
          0.09482197          1.00000000
  1  1  1  1  1
          0.03621417          1.00000000
  1  2  2  1  1
          1.97000000          1.00000000
  1  2  2  1  1
          0.43700000          1.00000000
  1  2  2  1  1
          0.19500000          1.00000000
  1  2  2  1  1
          0.08000000          1.00000000
  1  3  3  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.40100000          1.00000000
  1  4  4  1  1
          0.35700000          1.00000000
# SILICON
Si Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
     918070.69565000          0.00001266
     137485.25386000          0.00009841
      31287.77271400          0.00051731
       8861.61056970          0.00217854
       2890.69431560          0.00786569
       1043.40639790          0.02498755
        406.80160276          0.06976182
        168.48360207          0.16473363
         73.18562882          0.30285603
         32.99848542          0.36007260
  1  0  0  3  1
        278.78751325          0.02018546
         85.91022872          0.17720407
         32.99260403          0.63587861
  1  0  0  1  1
         15.03369325          1.00000000
  1  0  0  1  1
          5.72575148          1.00000000
  1  0  0  1  1
          2.61465210          1.00000000
  1  0  0  1  1
          1.17578332          1.00000000
  1  0  0  1  1
          0.35432331          1.00000000
  1  0  0  1  1
          0.16248336          1.00000000
  1  0  0  1  1
          0.06833246          1.00000000
  1  1  1  8  1
       1775.88505160          0.00020187
        420.83786849          0.00175443
        136.42290243          0.00950395
         51.70099174          0.03732574
         21.55945600          0.11085396
          9.55592001          0.23756407
          4.35298195          0.35295784
          2.00969644          0.32885932
  1  1  1  2  1
         46.41815378          0.02585882
          1.90764178         -0.59874866
  1  1  1  1  1
          0.92337222          1.00000000
  1  1  1  1  1
          0.34515720          1.00000000
  1  1  1  1  1
          0.13656835          1.00000000
  1  1  1  1  1
          0.05298706          1.00000000
  1  2  2  1  1
          2.64500000          1.00000000
  1  2  2  1  1
          0.60800000          1.00000000
  1  2  2  1  1
          0.27200000          1.00000000
  1  2  2  1  1
          0.11300000          1.00000000
  1  3  3  1  1
          0.21200000          1.00000000
  1  3  3  1  1
          0.54100000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
# PHOSPHOROUS
P  Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1090561.71380000          0.00001214
     163316.39461000          0.00009440
      37166.60745100          0.00049622
      10526.88094500          0.00209000
       3433.99760280          0.00754892
       1239.53604800          0.02401042
        483.27456199          0.06723147
        200.16911586          0.15978670
         86.96039483          0.29735907
         39.21128337          0.36187172
  1  0  0  3  1
        336.75883662          0.01915472
        103.72179793          0.17134079
         39.77186124          0.63689656
  1  0  0  1  1
         17.88861295          1.00000000
  1  0  0  1  1
          6.96445569          1.00000000
  1  0  0  1  1
          3.21980921          1.00000000
  1  0  0  1  1
          1.46699440          1.00000000
  1  0  0  1  1
          0.47765438          1.00000000
  1  0  0  1  1
          0.21637789          1.00000000
  1  0  0  1  1
          0.09023589          1.00000000
  1  1  1  8  1
       2019.67113740          0.00021359
        478.60125090          0.00185688
        155.14942504          0.01007069
         58.81635658          0.03960515
         24.54451278          0.11736068
         10.88357106          0.24950541
          4.96247913          0.36421288
          2.30029123          0.31764127
  1  1  1  2  1
         59.37134502          0.39432918
          3.06945910         -6.35229604
  1  1  1  1  1
          1.06344017          1.00000000
  1  1  1  1  1
          0.45022152          1.00000000
  1  1  1  1  1
          0.18267271          1.00000000
  1  1  1  1  1
          0.07161033          1.00000000
  1  2  2  1  1
          3.34300000          1.00000000
  1  2  2  1  1
          0.80700000          1.00000000
  1  2  2  1  1
          0.36500000          1.00000000
  1  2  2  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          0.70300000          1.00000000
  1  4  4  1  1
          0.59700000          1.00000000
# SULFUR
S  Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1273410.90230000          0.00001177
     190697.83007000          0.00009148
      43397.88533000          0.00048090
      12291.80967700          0.00202572
       4009.74208240          0.00731901
       1447.35310300          0.02330050
        564.30102913          0.06538621
        233.74506243          0.15614450
        101.56402814          0.29318564
         45.80590719          0.36287914
  1  0  0  3  1
        394.27281503          0.01875331
        121.72249591          0.16870727
         46.75412596          0.63806831
  1  0  0  1  1
         20.92300825          1.00000000
  1  0  0  1  1
          8.26855678          1.00000000
  1  0  0  1  1
          3.86293457          1.00000000
  1  0  0  1  1
          1.77946848          1.00000000
  1  0  0  1  1
          0.61064260          1.00000000
  1  0  0  1  1
          0.27412269          1.00000000
  1  0  0  1  1
          0.11325939          1.00000000
  1  1  1  8  1
       2189.89304590          0.00023913
        518.94596592          0.00207720
        168.19560151          0.01124242
         63.74528279          0.04406993
         26.59703308          0.12918779
         11.77425145          0.26910820
          5.35343790          0.37855929
          2.47019118          0.29692135
  1  1  1  2  1
         82.12028835         -0.03942032
          4.95235329          0.64048403
  1  1  1  1  1
          1.08282620          1.00000000
  1  1  1  1  1
          0.49271277          1.00000000
  1  1  1  1  1
          0.20483451          1.00000000
  1  1  1  1  1
          0.08074362          1.00000000
  1  2  2  1  1
          4.15900000          1.00000000
  1  2  2  1  1
          1.01900000          1.00000000
  1  2  2  1  1
          0.46400000          1.00000000
  1  2  2  1  1
          0.19400000          1.00000000
  1  3  3  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          0.86900000          1.00000000
  1  4  4  1  1
          0.68300000          1.00000000
# CHLORINE
Cl Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1467459.00950000          0.00001148
     219756.16433000          0.00008923
      50010.77030100          0.00046911
      14164.82391800          0.00197624
       4620.74655250          0.00714199
       1667.89916350          0.02275322
        650.29199265          0.06395978
        269.38037376          0.15331059
        117.06752106          0.28986952
         52.81176684          0.36348071
  1  0  0  3  1
        461.42769988          0.01801946
        142.12665355          0.16489442
         54.43783877          0.63891588
  1  0  0  1  1
         24.16077022          1.00000000
  1  0  0  1  1
          9.70835403          1.00000000
  1  0  0  1  1
          4.56406967          1.00000000
  1  0  0  1  1
          2.11947448          1.00000000
  1  0  0  1  1
          0.75722365          1.00000000
  1  0  0  1  1
          0.33747225          1.00000000
  1  0  0  1  1
          0.13860775          1.00000000
  1  1  1  8  1
       2501.94578900          0.00024243
        592.88059285          0.00210800
        192.18089186          0.01143269
         72.87571049          0.04495670
         30.43635837          0.13197476
         13.49017890          0.27493639
          6.14780714          0.38347236
          2.84509448          0.28871944
  1  1  1  2  1
        105.39397936         -0.03431176
          6.73697385          0.64060819
  1  1  1  1  1
          1.24210958          1.00000000
  1  1  1  1  1
          0.55669714          1.00000000
  1  1  1  1  1
          0.23387801          1.00000000
  1  1  1  1  1
          0.09316449          1.00000000
  1  2  2  1  1
          5.19100000          1.00000000
  1  2  2  1  1
          1.27600000          1.00000000
  1  2  2  1  1
          0.58300000          1.00000000
  1  2  2  1  1
          0.24300000          1.00000000
  1  3  3  1  1
          0.42300000          1.00000000
  1  3  3  1  1
          1.08900000          1.00000000
  1  4  4  1  1
          0.82700000          1.00000000
# ARGON
Ar Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1673421.94940000          0.00001125
     250601.75373000          0.00008743
      57030.91212000          0.00045962
      16153.30391500          0.00193639
       5269.41092880          0.00699940
       1902.03155410          0.02231207
        741.57677159          0.06280808
        307.20901906          0.15101141
        133.52786203          0.28713661
         60.25338129          0.36385490
  1  0  0  3  1
        522.02426206          0.01807132
        161.51290469          0.16449220
         62.12636943          0.63897335
  1  0  0  1  1
         27.59093001          1.00000000
  1  0  0  1  1
         11.17552888          1.00000000
  1  0  0  1  1
          5.29590651          1.00000000
  1  0  0  1  1
          2.47827989          1.00000000
  1  0  0  1  1
          0.91262095          1.00000000
  1  0  0  1  1
          0.40426068          1.00000000
  1  0  0  1  1
          0.16562886          1.00000000
  1  1  1  8  1
       2868.45045810          0.00024010
        679.71869590          0.00209048
        220.36758824          0.01136932
         83.62043973          0.04490198
         34.96432266          0.13237157
         15.52513178          0.27709278
          7.09929798          0.38613980
          3.30213366          0.28492925
  1  1  1  2  1
        128.78765667         -0.03050946
          8.43578680          0.64101621
  1  1  1  1  1
          1.46186619          1.00000000
  1  1  1  1  1
          0.64658010          1.00000000
  1  1  1  1  1
          0.27229296          1.00000000
  1  1  1  1  1
          0.10905182          1.00000000
  1  2  2  1  1
          6.31500000          1.00000000
  1  2  2  1  1
          1.56200000          1.00000000
  1  2  2  1  1
          0.71500000          1.00000000
  1  2  2  1  1
          0.29700000          1.00000000
  1  3  3  1  1
          0.54300000          1.00000000
  1  3  3  1  1
          1.32500000          1.00000000
  1  4  4  1  1
          1.00700000          1.00000000
# POTASSIUM
K  Ahlrichs-def2-QZVP
 22
  1  0  0 11  1
    2022075.13910000          0.00001014
     303044.65568000          0.00007878
      69013.93849000          0.00041381
      19559.24461500          0.00174276
       6383.89349010          0.00630041
       2305.35028580          0.02012535
        899.14418101          0.05696606
        372.59500133          0.13882654
        161.97635247          0.27132285
         73.08555385          0.36383621
         33.59564476          0.24724465
  1  0  0  4  1
        685.49855365          0.00443675
        211.66163373          0.04250272
         80.85140513          0.18467742
         35.10866724          0.29353174
  1  0  0  1  1
         14.40943728          1.00000000
  1  0  0  1  1
          6.86971473          1.00000000
  1  0  0  1  1
          3.21218837          1.00000000
  1  0  0  1  1
          1.26104844          1.00000000
  1  0  0  1  1
          0.61438946          1.00000000
  1  0  0  1  1
          0.27264371          1.00000000
  1  0  0  1  1
          0.07717301          1.00000000
  1  0  0  1  1
          0.04091840          1.00000000
  1  0  0  1  1
          0.01705576          1.00000000
  1  1  1  9  1
       3469.66497180          0.00021340
        822.02356107          0.00186378
        266.58406636          0.01021143
        101.28048161          0.04079960
         42.42949076          0.12257473
         18.91208391          0.26405834
          8.70177790          0.38227165
          4.08545676          0.29998812
          1.86672861          0.07800727
  1  1  1  5  1
         27.54463906         -0.00582230
          9.20988936         -0.02678753
          1.72328774          0.30666848
          0.77969304          0.66927944
          0.34379048          0.60376469
  1  1  1  1  1
          0.14346682          1.00000000
  1  1  1  1  1
          0.06800000          1.00000000
  1  1  1  1  1
          0.03200000          1.00000000
  1  1  1  1  1
          0.01530000          1.00000000
  1  2  2  1  1
          1.70000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.18000000          1.00000000
  1  2  2  1  1
          0.05400000          1.00000000
  1  3  3  1  1
          0.26700000          1.00000000
# CALCIUM
Ca Ahlrichs-def2-QZVP
 22
  1  0  0 11  1
    2433075.43040000          0.00000916
     364160.43015000          0.00007127
      82898.74763700          0.00037434
      23499.73054000          0.00157629
       7671.22459850          0.00570261
       2770.23306870          0.01825574
       1080.68075500          0.05190642
        448.04894531          0.12791239
        194.92007727          0.25586635
         88.03979334          0.36028678
         40.64569672          0.26838462
  1  0  0  4  1
        779.53331918         -0.01840301
        241.18856300         -0.17649441
         92.40386932         -0.77662800
         39.78609034         -1.33521554
  1  0  0  1  1
         18.19586428          1.00000000
  1  0  0  1  1
          8.33214571          1.00000000
  1  0  0  1  1
          3.91901962          1.00000000
  1  0  0  1  1
          1.66670995          1.00000000
  1  0  0  1  1
          0.80891085          1.00000000
  1  0  0  1  1
          0.36174200          1.00000000
  1  0  0  1  1
          0.08237987          1.00000000
  1  0  0  1  1
          0.04794786          1.00000000
  1  0  0  1  1
          0.02230811          1.00000000
  1  1  1  9  1
       4064.22327960          0.00019781
        962.91550624          0.00173075
        312.34501046          0.00952987
        118.76056036          0.03838746
         49.81615313          0.11679256
         22.25967940          0.25637225
         10.28609412          0.37986194
          4.86069824          0.30805761
          2.25256829          0.08575600
  1  1  1  5  1
         31.46755544         -0.00424415
         10.65758906         -0.01957943
          2.05055554          0.21237507
          0.94362089          0.46277871
          0.42709068          0.39177496
  1  1  1  1  1
          0.17788187          1.00000000
  1  1  1  1  1
          0.08600000          1.00000000
  1  1  1  1  1
          0.04150000          1.00000000
  1  1  1  1  1
          0.02000000          1.00000000
  1  2  2  3  1
         16.92401210          0.03554397
          4.46554033          0.18133698
          1.43475762          0.48002060
  1  2  2  1  1
          0.46552377          1.00000000
  1  2  2  1  1
          0.14097711          1.00000000
  1  2  2  1  1
          0.04146701          1.00000000
  1  3  3  1  1
          0.32100000          1.00000000
# SCANDIUM
Sc Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    2855231.12640000          0.00000849
     427433.34221000          0.00006600
      97233.21854500          0.00034741
      27496.22284600          0.00146941
       8948.73244090          0.00534107
       3221.03972920          0.01720065
       1252.05340770          0.04928707
        517.26093376          0.12273535
        224.33127242          0.24910184
        101.10551671          0.35884367
         46.68495786          0.27782811
  1  0  0  4  1
        947.75965484          0.00361230
        293.07262846          0.03561622
        111.70230657          0.16664064
         47.75621521          0.32531051
  1  0  0  1  1
         21.12198401          1.00000000
  1  0  0  1  1
          9.77659222          1.00000000
  1  0  0  1  1
          4.59826993          1.00000000
  1  0  0  1  1
          1.99284878          1.00000000
  1  0  0  1  1
          0.95939954          1.00000000
  1  0  0  1  1
          0.42566790          1.00000000
  1  0  0  1  1
          0.09813220          1.00000000
  1  0  0  1  1
          0.05689422          1.00000000
  1  0  0  1  1
          0.02536991          1.00000000
  1  1  1  9  1
       4611.46802420          0.00019181
       1092.46664580          0.00168019
        354.41923265          0.00927633
        134.83390286          0.03753720
         56.61087393          0.11493045
         25.33660552          0.25446811
         11.74131324          0.37993353
          5.56972686          0.30948776
          2.59499541          0.08697226
  1  1  1  5  1
         35.95119808         -0.00557804
         12.30102023         -0.02593383
          2.38765578          0.27489094
          1.10318236          0.59208047
          0.50008479          0.49113472
  1  1  1  1  1
          0.20796509          1.00000000
  1  1  1  1  1
          0.10100000          1.00000000
  1  1  1  1  1
          0.04800000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  5  1
         73.53117975          0.00225064
         21.76475964          0.01637761
          7.92337017          0.06333045
          3.18478898          0.17056209
          1.34277900          0.30119020
  1  2  2  1  1
          0.56149575          1.00000000
  1  2  2  1  1
          0.22764074          1.00000000
  1  2  2  1  1
          0.08521122          1.00000000
  1  2  2  1  1
          0.03500000          1.00000000
  1  3  3  1  1
          1.48100000          1.00000000
  1  3  3  1  1
          0.34500000          1.00000000
  1  3  3  1  1
          0.11000000          1.00000000
  1  4  4  1  1
          0.24700000          1.00000000
# TITANIUM
Ti Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3070548.86510000          0.00000870
     460777.88643000          0.00006745
     104901.22889000          0.00035477
      29695.86119900          0.00149775
       9678.88926880          0.00543099
       3490.18779120          0.01743936
       1359.22176210          0.04983563
        562.42721208          0.12379634
        244.22296250          0.25057491
        110.16668710          0.35934609
         50.88190336          0.27594243
  1  0  0  4  1
        965.95430789          0.00417739
        299.27072059          0.04027715
        114.83772939          0.17898687
         49.47757895          0.31783044
  1  0  0  1  1
         22.98283998          1.00000000
  1  0  0  1  1
         10.51830504          1.00000000
  1  0  0  1  1
          4.97743906          1.00000000
  1  0  0  1  1
          2.13398468          1.00000000
  1  0  0  1  1
          1.03424573          1.00000000
  1  0  0  1  1
          0.46199775          1.00000000
  1  0  0  1  1
          0.10621264          1.00000000
  1  0  0  1  1
          0.05434035          1.00000000
  1  0  0  1  1
          0.02511022          1.00000000
  1  1  1  9  1
       5169.67554270          0.00018803
       1225.09616380          0.00164735
        397.60051934          0.00911046
        151.36154684          0.03698745
         63.61332177          0.11376330
         28.51456031          0.25345209
         13.24800330          0.38019403
          6.30488078          0.30989136
          2.94935258          0.08741894
  1  1  1  5  1
         40.73877221         -0.00732338
         14.06235846         -0.03428259
          2.74606810          0.35655009
          1.27136881          0.76112035
          0.57610016          0.62716743
  1  1  1  1  1
          0.23981821          1.00000000
  1  1  1  1  1
          0.11000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  5  1
         89.58988007          0.00212230
         26.59141296          0.01591182
          9.77397157          0.06287524
          3.96250837          0.17144171
          1.68905327          0.30565507
  1  2  2  1  1
          0.71539771          1.00000000
  1  2  2  1  1
          0.29366678          1.00000000
  1  2  2  1  1
          0.11079095          1.00000000
  1  2  2  1  1
          0.04500000          1.00000000
  1  3  3  1  1
          2.09300000          1.00000000
  1  3  3  1  1
          0.56200000          1.00000000
  1  3  3  1  1
          0.19100000          1.00000000
  1  4  4  1  1
          0.63400000          1.00000000
# VANADIUM
V  Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3360380.03820000          0.00000870
     502646.73178000          0.00006779
     114247.22867000          0.00035699
      32321.97263000          0.00150755
      10532.94727100          0.00546644
       3798.30044390          0.01754731
       1479.60947150          0.05010659
        612.57405507          0.12431296
        266.22103326          0.25117027
        120.21980126          0.35926016
         55.59118085          0.27505076
  1  0  0  4  1
       1082.47686350          0.00393268
        334.94462061          0.03829848
        128.31559026          0.17259909
         55.31158962          0.31287424
  1  0  0  1  1
         25.10838304          1.00000000
  1  0  0  1  1
         11.66755324          1.00000000
  1  0  0  1  1
          5.53720733          1.00000000
  1  0  0  1  1
          2.37810076          1.00000000
  1  0  0  1  1
          1.15069473          1.00000000
  1  0  0  1  1
          0.51283991          1.00000000
  1  0  0  1  1
          0.11625711          1.00000000
  1  0  0  1  1
          0.05827279          1.00000000
  1  0  0  1  1
          0.02666231          1.00000000
  1  1  1  9  1
       5782.80350050          0.00018345
       1369.93922820          0.00160952
        444.53147129          0.00892423
        169.25617556          0.03637518
         71.16873003          0.11246803
         31.93335837          0.25226108
         14.86533678          0.38039695
          7.09217401          0.31068797
          3.32811578          0.08814120
  1  1  1  5  1
         45.84290602         -0.00566614
         15.94033902         -0.02671898
          3.12571550          0.27354633
          1.44858676          0.57972883
          0.65577903          0.47601111
  1  1  1  1  1
          0.27311627          1.00000000
  1  1  1  1  1
          0.12200000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  5  1
        103.95047414          0.00210072
         30.90168866          0.01601524
         11.42032115          0.06412746
          4.65732723          0.17488906
          1.99636826          0.31003778
  1  2  2  1  1
          0.84967250          1.00000000
  1  2  2  1  1
          0.34953222          1.00000000
  1  2  2  1  1
          0.13165588          1.00000000
  1  2  2  1  1
          0.05200000          1.00000000
  1  3  3  1  1
          2.93300000          1.00000000
  1  3  3  1  1
          0.83100000          1.00000000
  1  3  3  1  1
          0.25700000          1.00000000
  1  4  4  1  1
          1.00900000          1.00000000
# CHROMIUM
Cr Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3637838.68200000          0.00000877
     544864.46100000          0.00006817
     123997.55079000          0.00035845
      35116.73316600          0.00151170
      11455.70229800          0.00547319
       4135.99067120          0.01753943
       1613.25135810          0.05000487
        668.77932380          0.12393519
        291.01365155          0.25039606
        131.57328167          0.35870470
         60.92456793          0.27581149
  1  0  0  4  1
       1196.28996010          0.00773686
        369.76947592          0.07583784
        141.54426084          0.34435149
         60.99922876          0.63249298
  1  0  0  1  1
         27.59911336          1.00000000
  1  0  0  1  1
         12.88211206          1.00000000
  1  0  0  1  1
          6.12475137          1.00000000
  1  0  0  1  1
          2.63328953          1.00000000
  1  0  0  1  1
          1.27084823          1.00000000
  1  0  0  1  1
          0.56483576          1.00000000
  1  0  0  1  1
          0.12596809          1.00000000
  1  0  0  1  1
          0.06204561          1.00000000
  1  0  0  1  1
          0.02814431          1.00000000
  1  1  1  9  1
       6395.87817920          0.00018105
       1515.17015740          0.00158937
        491.70538681          0.00882587
        187.28416675          0.03606895
         78.80034644          0.11189650
         35.39629169          0.25202240
         16.50927888          0.38082266
          7.89473969          0.31035222
          3.71364145          0.08798031
  1  1  1  5  1
         51.25931253         -0.00605420
         17.93493252         -0.02876176
          3.52571742          0.29087768
          1.63391639          0.61267525
          0.73852414          0.50126035
  1  1  1  1  1
          0.30752368          1.00000000
  1  1  1  1  1
          0.13500000          1.00000000
  1  1  1  1  1
          0.05900000          1.00000000
  1  1  1  1  1
          0.02600000          1.00000000
  1  2  2  5  1
        118.24986288          0.00210128
         35.19393570          0.01621227
         13.05781602          0.06558185
          5.34856028          0.17849601
          2.30042337          0.31376763
  1  2  2  1  1
          0.98114328          1.00000000
  1  2  2  1  1
          0.40334183          1.00000000
  1  2  2  1  1
          0.15135590          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          3.73300000          1.00000000
  1  3  3  1  1
          1.14700000          1.00000000
  1  3  3  1  1
          0.36600000          1.00000000
  1  4  4  1  1
          1.38200000          1.00000000
# MANGANESE
Mn Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4289357.64410000          0.00000794
     636361.00285000          0.00006254
     143637.27569000          0.00033226
      40406.34543200          0.00141300
      13104.36341700          0.00515609
       4705.06642550          0.01665957
       1825.71254320          0.04790808
        753.33816229          0.11994904
        326.47253285          0.24550297
        147.10300670          0.35822740
         67.98722687          0.28295764
  1  0  0  4  1
       1300.72667170          0.00760252
        402.72027544          0.07436511
        154.38971348          0.33780475
         66.44338461          0.62779332
  1  0  0  1  1
         30.97531601          1.00000000
  1  0  0  1  1
         14.22298089          1.00000000
  1  0  0  1  1
          6.75982651          1.00000000
  1  0  0  1  1
          2.90870833          1.00000000
  1  0  0  1  1
          1.39665078          1.00000000
  1  0  0  1  1
          0.61792624          1.00000000
  1  0  0  1  1
          0.13439484          1.00000000
  1  0  0  1  1
          0.06519505          1.00000000
  1  0  0  1  1
          0.02941571          1.00000000
  1  1  1  9  1
       6483.26296580          0.00020480
       1556.71348590          0.00175258
        509.73925460          0.00957988
        195.28408089          0.03868136
         82.54254753          0.11832402
         37.21207673          0.26168460
         17.42580446          0.38400629
          8.36913770          0.29704167
          3.94090004          0.07826329
  1  1  1  5  1
         57.20274101         -0.00477491
         20.09093595         -0.02298973
          3.93575538          0.23197066
          1.81819840          0.48435204
          0.81881535          0.39159479
  1  1  1  1  1
          0.34038359          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06300000          1.00000000
  1  1  1  1  1
          0.02700000          1.00000000
  1  2  2  6  1
        200.40254535          0.00089550
         59.89822577          0.00762576
         22.81057017          0.03452322
          9.58741421          0.10552677
          4.29337109          0.22575378
          1.95376184          0.32766534
  1  2  2  1  1
          0.87378874          1.00000000
  1  2  2  1  1
          0.37597749          1.00000000
  1  2  2  1  1
          0.14811548          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          4.35300000          1.00000000
  1  3  3  1  1
          1.32600000          1.00000000
  1  3  3  1  1
          0.40800000          1.00000000
  1  4  4  1  1
          1.75500000          1.00000000
# IRON
Fe Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4313154.43380000          0.00000867
     645875.08253000          0.00006742
     146981.87698000          0.00035449
      41630.61504400          0.00149483
      13580.62010900          0.00541367
       4902.06206130          0.01736246
       1911.29008370          0.04956657
        791.99837852          0.12309090
        344.54799181          0.24936706
        155.78722730          0.35858415
         72.17938032          0.27738222
  1  0  0  4  1
       1417.91250910          0.00748716
        439.23184195          0.07333758
        168.51006820          0.33383144
         72.77626941          0.62022525
  1  0  0  1  1
         32.75296177          1.00000000
  1  0  0  1  1
         15.43433610          1.00000000
  1  0  0  1  1
          7.36393182          1.00000000
  1  0  0  1  1
          3.16988329          1.00000000
  1  0  0  1  1
          1.52437084          1.00000000
  1  0  0  1  1
          0.67496281          1.00000000
  1  0  0  1  1
          0.14718566          1.00000000
  1  0  0  1  1
          0.07008222          1.00000000
  1  0  0  1  1
          0.03120827          1.00000000
  1  1  1  9  1
       7709.05876270          0.00017711
       1826.46663230          0.00155601
        592.84368362          0.00866295
        225.93763245          0.03556595
         95.16475889          0.11098847
         42.82313238          0.25177797
         20.03628658          0.38166911
          9.61593463          0.30963598
          4.53935388          0.08755828
  1  1  1  5  1
         62.99751900         -0.00509104
         22.26274873         -0.02454046
          4.39000649          0.24345605
          2.03289139          0.50781898
          0.91592622          0.41214896
  1  1  1  1  1
          0.38036654          1.00000000
  1  1  1  1  1
          0.16000000          1.00000000
  1  1  1  1  1
          0.06700000          1.00000000
  1  1  1  1  1
          0.02800000          1.00000000
  1  2  2  6  1
        218.33430163          0.00093700
         65.25629262          0.00800088
         24.86694482          0.03630529
         10.47339930          0.11057190
          4.69470050          0.23219589
          2.13159825          0.32922860
  1  2  2  1  1
          0.94748005          1.00000000
  1  2  2  1  1
          0.40346489          1.00000000
  1  2  2  1  1
          0.15687415          1.00000000
  1  2  2  1  1
          0.06200000          1.00000000
  1  3  3  1  1
          5.10300000          1.00000000
  1  3  3  1  1
          1.59800000          1.00000000
  1  3  3  1  1
          0.50500000          1.00000000
  1  4  4  1  1
          2.12800000          1.00000000
# COBALT
Co Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4658206.50320000          0.00000866
     697560.87453000          0.00006734
     158759.87124000          0.00035399
      44969.09937900          0.00149264
      14670.71424700          0.00540531
       5295.89472500          0.01733523
       2065.05811670          0.04948664
        855.90627750          0.12289352
        372.48747255          0.24903230
        168.50576608          0.35838320
         78.12876157          0.27777974
  1  0  0  4  1
       1534.51498850          0.00744644
        475.52976096          0.07299360
        182.54836839          0.33243105
         78.91646718          0.61900490
  1  0  0  1  1
         35.50086552          1.00000000
  1  0  0  1  1
         16.79041449          1.00000000
  1  0  0  1  1
          8.02402325          1.00000000
  1  0  0  1  1
          3.45716830          1.00000000
  1  0  0  1  1
          1.65998354          1.00000000
  1  0  0  1  1
          0.73380022          1.00000000
  1  0  0  1  1
          0.15878613          1.00000000
  1  0  0  1  1
          0.07453566          1.00000000
  1  0  0  1  1
          0.03286735          1.00000000
  1  1  1  9  1
       8425.43313520          0.00017492
       1995.87584520          0.00153789
        647.76765681          0.00857525
        246.88261214          0.03529527
        104.00952246          0.11050008
         46.82747814          0.25160925
         21.93444454          0.38209003
         10.54049953          0.30947120
          4.98204194          0.08743687
  1  1  1  5  1
         69.27078713         -0.00611724
         24.58397794         -0.02965504
          4.85622589          0.29163333
          2.24809161          0.60629408
          1.01142860          0.49057440
  1  1  1  1  1
          0.41919905          1.00000000
  1  1  1  1  1
          0.17500000          1.00000000
  1  1  1  1  1
          0.07300000          1.00000000
  1  1  1  1  1
          0.03000000          1.00000000
  1  2  2  6  1
        237.58450966          0.00097593
         71.08689630          0.00834326
         27.11908068          0.03795847
         11.44823905          0.11522936
          5.13918067          0.23843468
          2.33234921          0.33205700
  1  2  2  1  1
          1.03386621          1.00000000
  1  2  2  1  1
          0.43785146          1.00000000
  1  2  2  1  1
          0.16895005          1.00000000
  1  2  2  1  1
          0.06600000          1.00000000
  1  3  3  1  1
          5.97500000          1.00000000
  1  3  3  1  1
          1.90300000          1.00000000
  1  3  3  1  1
          0.59400000          1.00000000
  1  4  4  1  1
          2.50000000          1.00000000
# NICKEL
Ni Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5037649.95320000          0.00000861
     754246.39418000          0.00006694
     171644.16010000          0.00035191
      48617.23028600          0.00148391
      15860.96179500          0.00537363
       5726.00186530          0.01723338
       2232.95473170          0.04921148
        925.49649101          0.12232505
        402.75336913          0.24829252
        182.19422856          0.35825476
         84.49410979          0.27881866
  1  0  0  4  1
       1678.05645860          0.00824629
        519.21358326          0.08150594
        198.95881607          0.37495728
         85.90118070          0.70841744
  1  0  0  1  1
         38.43576012          1.00000000
  1  0  0  1  1
         18.25234935          1.00000000
  1  0  0  1  1
          8.72836169          1.00000000
  1  0  0  1  1
          3.76162457          1.00000000
  1  0  0  1  1
          1.80282173          1.00000000
  1  0  0  1  1
          0.79507141          1.00000000
  1  0  0  1  1
          0.17031720          1.00000000
  1  0  0  1  1
          0.07897124          1.00000000
  1  0  0  1  1
          0.03450349          1.00000000
  1  1  1  9  1
       9156.57014530          0.00017346
       2169.02395260          0.00152572
        703.98918991          0.00851633
        268.36293215          0.03511747
        113.10288796          0.11020275
         50.95553922          0.25162602
         23.89670821          0.38246390
         11.49824152          0.30907230
          5.44109081          0.08719438
  1  1  1  5  1
         75.93856074         -0.00746355
         27.03735018         -0.03645340
          5.34046874          0.35633549
          2.47001814          0.73774122
          1.10950291          0.59439383
  1  1  1  1  1
          0.45899767          1.00000000
  1  1  1  1  1
          0.18700000          1.00000000
  1  1  1  1  1
          0.07620000          1.00000000
  1  1  1  1  1
          0.03100000          1.00000000
  1  2  2  6  1
        258.11131142          0.00237263
         77.25489137          0.02033013
         29.50024003          0.09274849
         12.47744695          0.28082285
          5.60704551          0.57392658
          2.54277442          0.78766059
  1  2  2  1  1
          1.12382968          1.00000000
  1  2  2  1  1
          0.47361171          1.00000000
  1  2  2  1  1
          0.18161858          1.00000000
  1  2  2  1  1
          0.07100000          1.00000000
  1  3  3  1  1
          6.75800000          1.00000000
  1  3  3  1  1
          2.17400000          1.00000000
  1  3  3  1  1
          0.68100000          1.00000000
  1  4  4  1  1
          2.87200000          1.00000000
# COPPER
Cu Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5056467.88980000          0.00000935
     759457.83835000          0.00007232
     173524.88497000          0.00037814
      49327.25998800          0.00158701
      16144.14993000          0.00572207
       5844.59646800          0.01826839
       2284.68127390          0.05189372
        948.88232514          0.12796192
        413.66215455          0.25629891
        187.38942059          0.36064416
         86.87277165          0.26833665
  1  0  0  4  1
       1744.05982870          0.00885871
        540.93295513          0.08652279
        207.99736224          0.38932285
         90.47579304          0.69777200
  1  0  0  1  1
         38.86968770          1.00000000
  1  0  0  1  1
         18.97482915          1.00000000
  1  0  0  1  1
          9.09536446          1.00000000
  1  0  0  1  1
          3.83300202          1.00000000
  1  0  0  1  1
          1.81988915          1.00000000
  1  0  0  1  1
          0.79068098          1.00000000
  1  0  0  1  1
          0.14914142          1.00000000
  1  0  0  1  1
          0.07244809          1.00000000
  1  0  0  1  1
          0.03095993          1.00000000
  1  1  1  9  1
       9720.46145550          0.00017829
       2302.75574520          0.00156781
        747.48498314          0.00874701
        285.00132623          0.03604455
        120.15121609          0.11287209
         54.14526116          0.25647377
         25.40603356          0.38512918
         12.22433147          0.30316512
          5.76387207          0.08167722
  1  1  1  5  1
         83.21083722         -0.00635304
         29.69477913         -0.03138383
          5.82485162          0.30930040
          2.67461812          0.63583926
          1.18418368          0.50946046
  1  1  1  1  1
          0.48043584          1.00000000
  1  1  1  1  1
          0.18700000          1.00000000
  1  1  1  1  1
          0.07620000          1.00000000
  1  1  1  1  1
          0.03100000          1.00000000
  1  2  2  6  1
        249.54025080          0.00124329
         74.68391453          0.01045690
         28.39271712          0.04645124
         11.95596843          0.13541360
          5.32107446          0.25852900
          2.36611895          0.33168128
  1  2  2  1  1
          1.01318640          1.00000000
  1  2  2  1  1
          0.40710036          1.00000000
  1  2  2  1  1
          0.14742541          1.00000000
  1  2  2  1  1
          0.07100000          1.00000000
  1  3  3  1  1
          6.96200000          1.00000000
  1  3  3  1  1
          2.23300000          1.00000000
  1  3  3  1  1
          0.70400000          1.00000000
  1  4  4  1  1
          3.24500000          1.00000000
# ZINC
Zn Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5742307.15070000          0.00000869
     861450.78790000          0.00006736
     196346.05866000          0.00035350
      55682.87073700          0.00148842
      18183.90239400          0.00538409
       6569.64480190          0.01725274
       2563.56132760          0.04923868
       1063.11471760          0.12235812
        462.89771078          0.24835390
        209.52821049          0.35830633
         97.24078799          0.27880260
  1  0  0  4  1
       1929.26899920          0.00830770
        598.07122307          0.08188259
        229.69667336          0.37588060
         99.41681923          0.71067260
  1  0  0  1  1
         44.24110142          1.00000000
  1  0  0  1  1
         21.19436711          1.00000000
  1  0  0  1  1
         10.15873160          1.00000000
  1  0  0  1  1
          4.37461762          1.00000000
  1  0  0  1  1
          2.09014891          1.00000000
  1  0  0  1  1
          0.91869136          1.00000000
  1  0  0  1  1
          0.19278661          1.00000000
  1  0  0  1  1
          0.08732992          1.00000000
  1  0  0  1  1
          0.03755222          1.00000000
  1  1  1  9  1
      10690.44510700          0.00017143
       2532.31593400          0.00150880
        821.94295003          0.00843688
        313.42757800          0.03489810
        132.18314247          0.10993617
         59.62055439          0.25207277
         28.01948887          0.38325658
         13.51170485          0.30787091
          6.40537113          0.08641170
  1  1  1  5  1
         89.98113192         -0.00962628
         32.24176711         -0.04750941
          6.38094486          0.45834100
          2.94779284          0.94473799
          1.32008550          0.75923465
  1  1  1  1  1
          0.54424674          1.00000000
  1  1  1  1  1
          0.25799972          1.00000000
  1  1  1  1  1
          0.09286319          1.00000000
  1  1  1  1  1
          0.03405934          1.00000000
  1  2  2  6  1
        305.22298937          0.00273598
         91.46827320          0.02358523
         34.98698597          0.10858422
         14.84941519          0.32843594
          6.68585457          0.66180236
          3.03094126          0.89165339
  1  2  2  1  1
          1.33550507          1.00000000
  1  2  2  1  1
          0.55883176          1.00000000
  1  2  2  1  1
          0.21180799          1.00000000
  1  2  2  1  1
          0.08300000          1.00000000
  1  3  3  1  1
          8.02000000          1.00000000
  1  3  3  1  1
          2.61400000          1.00000000
  1  3  3  1  1
          0.83600000          1.00000000
  1  4  4  1  1
          3.61700000          1.00000000
# GALLIUM
Ga Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    6623802.02740000          0.00000791
     987904.07075000          0.00006184
     224132.05899000          0.00032636
      63315.19294300          0.00138104
      20611.31270200          0.00501538
       7429.16724820          0.01613094
       2894.20717200          0.04624083
       1198.99157860          0.11579100
        521.82003812          0.23834841
        236.27549237          0.35374256
        109.98395671          0.29055722
  1  0  0  4  1
       2101.25872530          0.00830396
        650.97022519          0.08225413
        250.22438356          0.38021717
        108.17616625          0.74503595
  1  0  0  1  1
         51.05748671          1.00000000
  1  0  0  1  1
         23.64747453          1.00000000
  1  0  0  1  1
         11.36170114          1.00000000
  1  0  0  1  1
          5.01781359          1.00000000
  1  0  0  1  1
          2.41026750          1.00000000
  1  0  0  1  1
          1.07410467          1.00000000
  1  0  0  1  1
          0.25745076          1.00000000
  1  0  0  1  1
          0.12175228          1.00000000
  1  0  0  1  1
          0.05236060          1.00000000
  1  1  1  9  1
      14711.75048300          0.00011131
       3482.14517160          0.00098496
       1130.21866550          0.00558542
        431.54093448          0.02368241
        182.41723648          0.07821159
         82.70675360          0.19503830
         39.22812877          0.34131988
         19.20197994          0.35718665
          9.50569667          0.16395955
  1  1  1  2  1
         92.61561302         -0.08584828
         33.75014816         -0.39435020
  1  1  1  4  1
          7.34822830          0.37941607
          3.78133848          0.71306292
          2.31451831          0.43210001
          0.80346860          0.25838123
  1  1  1  1  1
          1.54237101          1.00000000
  1  1  1  1  1
          0.32910240          1.00000000
  1  1  1  1  1
          0.11834089          1.00000000
  1  1  1  1  1
          0.04162788          1.00000000
  1  2  2  7  1
        363.49565218          0.00087402
        109.01749589          0.00767519
         41.86643071          0.03638898
         17.87927989          0.11325183
          8.12018937          0.23770881
          3.73606114          0.33306060
          1.68268125          0.33130614
  1  2  2  1  1
          0.72655790          1.00000000
  1  2  2  1  1
          0.28498585          1.00000000
  1  2  2  1  1
          0.11200000          1.00000000
  1  3  3  1  1
          0.18100000          1.00000000
  1  3  3  1  1
          0.47100000          1.00000000
  1  4  4  1  1
          0.40320000          1.00000000
# GERMANIUM
Ge Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    7233056.03460000          0.00000766
    1082886.17310000          0.00005960
     246481.46959000          0.00031319
      69862.42695500          0.00131941
      22815.80966200          0.00477361
       8246.53692970          0.01531925
       3219.93672570          0.04390087
       1336.57437060          0.11028574
        582.87737501          0.22912630
        264.59511360          0.34779259
        123.77823320          0.29968722
  1  0  0  4  1
       2311.10558040          0.00750331
        716.27089868          0.07477839
        275.45330910          0.35092882
        118.93292565          0.72055990
  1  0  0  1  1
         58.43569909          1.00000000
  1  0  0  1  1
         26.26157597          1.00000000
  1  0  0  1  1
         12.66488067          1.00000000
  1  0  0  1  1
          5.72695485          1.00000000
  1  0  0  1  1
          2.75550232          1.00000000
  1  0  0  1  1
          1.24328868          1.00000000
  1  0  0  1  1
          0.33107184          1.00000000
  1  0  0  1  1
          0.15964081          1.00000000
  1  0  0  1  1
          0.06846318          1.00000000
  1  1  1  9  1
      16555.71107400          0.00010199
       3914.99037450          0.00090504
       1269.47665180          0.00515585
        484.35437789          0.02201034
        204.64985822          0.07343480
         92.79103209          0.18608955
         44.05506026          0.33330982
         21.60131993          0.36229776
         10.73216923          0.17765186
  1  1  1  2  1
        100.88933962         -0.11146182
         36.64025474         -0.52324324
  1  1  1  4  1
          8.03432241          0.31484763
          4.56134383          0.38737745
          3.17948822          0.50034354
          0.92612041          0.22656708
  1  1  1  1  1
          1.79770409          1.00000000
  1  1  1  1  1
          0.41386865          1.00000000
  1  1  1  1  1
          0.15830799          1.00000000
  1  1  1  1  1
          0.05787704          1.00000000
  1  2  2  7  1
        420.99565921          0.00078212
        126.36209818          0.00695601
         48.66147355          0.03371219
         20.88032553          0.10717291
          9.54182294          0.23161030
          4.43536539          0.33390954
          2.02854219          0.33720676
  1  2  2  1  1
          0.89484935          1.00000000
  1  2  2  1  1
          0.35786074          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  3  3  1  1
          0.54920000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  4  4  1  1
          0.46810000          1.00000000
# ARSENIC
As Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    8217482.61980000          0.00000706
    1230500.37200000          0.00005488
     280225.86648000          0.00028809
      79482.50941500          0.00121298
      25963.78335100          0.00439146
       9381.40101930          0.01412536
       3660.49119720          0.04065792
       1518.23560240          0.10300383
        661.80098920          0.21730077
        300.58642127          0.33995751
        141.11137296          0.31088634
  1  0  0  4  1
       2577.08705800          0.00707530
        798.07872277          0.07138362
        306.57574948          0.34287025
        132.27558802          0.74361403
  1  0  0  1  1
         67.44870223          1.00000000
  1  0  0  1  1
         29.20918044          1.00000000
  1  0  0  1  1
         14.15650933          1.00000000
  1  0  0  1  1
          6.55615067          1.00000000
  1  0  0  1  1
          3.13928472          1.00000000
  1  0  0  1  1
          1.42946310          1.00000000
  1  0  0  1  1
          0.41103391          1.00000000
  1  0  0  1  1
          0.20032453          1.00000000
  1  0  0  1  1
          0.08566993          1.00000000
  1  1  1 10  1
      25198.50427800          0.00005476
       5972.56013810          0.00048572
       1941.91231830          0.00279081
        743.59381104          0.01220151
        315.63828052          0.04266629
        143.96878925          0.11870919
         69.06868316          0.24909407
         34.25430563          0.36061357
         17.37174676          0.29392242
          8.76345556          0.09782906
  1  1  1  5  1
        228.49024582         -0.00249001
         86.31355549         -0.01948252
         36.75136627         -0.06149507
          8.53651495          0.47258065
          4.19351286          1.02360651
  1  1  1  1  1
          2.04649804          1.00000000
  1  1  1  1  1
          0.98000000          1.00000000
  1  1  1  1  1
          0.40534341          1.00000000
  1  1  1  1  1
          0.16655070          1.00000000
  1  1  1  1  1
          0.06598171          1.00000000
  1  2  2  7  1
        479.32599612          0.00071723
        143.96064855          0.00644192
         55.54890922          0.03177650
         23.92758101          0.10276249
         10.98819417          0.22710953
          5.14893563          0.33477474
          2.38368109          0.34175986
  1  2  2  1  1
          1.06882047          1.00000000
  1  2  2  1  1
          0.43305694          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  3  3  1  1
          0.26400000          1.00000000
  1  3  3  1  1
          0.64400000          1.00000000
  1  4  4  1  1
          0.54650000          1.00000000
# SELENIUM
Se Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    9520446.77430000          0.00000633
    1424984.08020000          0.00004927
     324127.57682000          0.00025920
      91774.87695000          0.00109431
      29932.72572500          0.00397061
      10804.61790500          0.01280119
       4214.01347790          0.03698038
       1747.81166330          0.09446135
        762.12160878          0.20274705
        346.45604141          0.32878956
        163.11569304          0.32300253
  1  0  0  4  1
       2614.51530670          0.00791139
        818.68552756          0.07718774
        318.63398991          0.35672062
        139.04844125          0.75846750
  1  0  0  1  1
         78.34873479          1.00000000
  1  0  0  1  1
         31.70429066          1.00000000
  1  0  0  1  1
         15.50585927          1.00000000
  1  0  0  1  1
          7.32274236          1.00000000
  1  0  0  1  1
          3.49694835          1.00000000
  1  0  0  1  1
          1.61215461          1.00000000
  1  0  0  1  1
          0.49587159          1.00000000
  1  0  0  1  1
          0.24092138          1.00000000
  1  0  0  1  1
          0.10231739          1.00000000
  1  1  1 10  1
      25360.21561500          0.00006053
       5993.78966100          0.00053988
       1943.07417550          0.00311305
        742.35316156          0.01359967
        314.62114597          0.04729896
        143.34748044          0.12981488
         68.67361755          0.26569982
         34.01355412          0.36723195
         17.19809962          0.27478356
          8.58303296          0.07925617
  1  1  1  5  1
        236.58209146         -0.00122716
         90.57618321         -0.00925846
         39.08668930         -0.02842873
          9.30843440          0.21201102
          4.61699231          0.47117590
  1  1  1  1  1
          2.26534775          1.00000000
  1  1  1  1  1
          1.08000000          1.00000000
  1  1  1  1  1
          0.47939329          1.00000000
  1  1  1  1  1
          0.19619984          1.00000000
  1  1  1  1  1
          0.07625634          1.00000000
  1  2  2  7  1
        539.48700124          0.00066723
        162.13394435          0.00603993
         62.66179564          0.03023867
         27.07727289          0.09926789
         12.48300393          0.22358036
          5.88646231          0.33574683
          2.75191311          0.34554856
  1  2  2  1  1
          1.25007696          1.00000000
  1  2  2  1  1
          0.51172842          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          0.28400000          1.00000000
  1  3  3  1  1
          0.70970000          1.00000000
  1  4  4  1  1
          0.57300000          1.00000000
# BROMINE
Br Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
   10629044.26400000          0.00000593
    1591918.27390000          0.00004612
     362333.98437000          0.00024245
     102643.11141000          0.00102314
      33489.84666800          0.00371220
      12091.24719000          0.01197811
       4716.19087890          0.03468269
       1956.15980800          0.08906833
        853.08595848          0.19330125
        387.96633666          0.32071145
        182.85156613          0.32996798
  1  0  0  4  1
       3240.40864210          0.00659052
       1000.46319350          0.06843961
        383.37301682          0.34495479
        166.03929698          0.82315542
  1  0  0  1  1
         87.91990699          1.00000000
  1  0  0  1  1
         35.67584007          1.00000000
  1  0  0  1  1
         17.54365784          1.00000000
  1  0  0  1  1
          8.44736604          1.00000000
  1  0  0  1  1
          3.96661806          1.00000000
  1  0  0  1  1
          1.83568160          1.00000000
  1  0  0  1  1
          0.59084779          1.00000000
  1  0  0  1  1
          0.28863218          1.00000000
  1  0  0  1  1
          0.12153381          1.00000000
  1  1  1 10  1
      26566.47657900          0.00006207
       6290.50885660          0.00055132
       2043.31784100          0.00316801
        781.67221007          0.01381660
        331.51078945          0.04801854
        151.09198667          0.13162015
         72.39527817          0.26860052
         35.86951084          0.36827391
         18.13990619          0.27108613
          9.04666889          0.07621534
  1  1  1  5  1
        253.71822146         -0.00137292
         97.25081806         -0.01039381
         42.03489796         -0.03220421
          9.96856736          0.24224770
          4.93958547          0.53557868
  1  1  1  1  1
          2.43828455          1.00000000
  1  1  1  1  1
          1.18000000          1.00000000
  1  1  1  1  1
          0.51047565          1.00000000
  1  1  1  1  1
          0.21215852          1.00000000
  1  1  1  1  1
          0.08394360          1.00000000
  1  2  2  7  1
        601.44434484          0.00062784
        180.85718640          0.00572052
         69.98680634          0.02900252
         30.32471030          0.09644699
         14.02790924          0.22065826
          6.65117021          0.33657642
          3.13541683          0.34872041
  1  2  2  1  1
          1.43935918          1.00000000
  1  2  2  1  1
          0.59350441          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  3  3  1  1
          0.34070000          1.00000000
  1  3  3  1  1
          0.82570000          1.00000000
  1  4  4  1  1
          0.64910000          1.00000000
# KRYPTON
Kr Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
   11713823.00800000          0.00000569
    1755253.39790000          0.00004421
     399717.41924000          0.00023228
     113285.79260000          0.00097974
      36977.20529300          0.00355376
      13355.03658000          0.01146867
       5210.90129880          0.03324163
       2162.11370200          0.08562073
        943.29291023          0.18708767
        429.20724331          0.31497583
        202.40720840          0.33406191
  1  0  0  4  1
       3260.49855210          0.00730915
       1011.10697160          0.07404036
        392.44359273          0.35414962
        173.21702132          0.80188286
  1  0  0  1  1
         96.61998847          1.00000000
  1  0  0  1  1
         38.15828487          1.00000000
  1  0  0  1  1
         18.95951757          1.00000000
  1  0  0  1  1
          9.25059962          1.00000000
  1  0  0  1  1
          4.34865176          1.00000000
  1  0  0  1  1
          2.03803242          1.00000000
  1  0  0  1  1
          0.69110153          1.00000000
  1  0  0  1  1
          0.33506065          1.00000000
  1  0  0  1  1
          0.14074441          1.00000000
  1  1  1 10  1
      28609.33576700          0.00006053
       6773.12363640          0.00053786
       2199.80110790          0.00309354
        841.50201590          0.01351432
        356.92110288          0.04709009
        162.71174351          0.12960370
         78.00426499          0.26607436
         38.68258000          0.36775851
         19.58915869          0.27406904
          9.79908634          0.07877335
  1  1  1  5  1
        261.37786869         -0.00163972
        100.09932146         -0.01203480
         44.01213936         -0.03489149
         10.85401074          0.25212651
          5.43519302          0.57400782
  1  1  1  1  1
          2.70628055          1.00000000
  1  1  1  1  1
          1.31956334          1.00000000
  1  1  1  1  1
          0.58004456          1.00000000
  1  1  1  1  1
          0.24329976          1.00000000
  1  1  1  1  1
          0.09682373          1.00000000
  1  2  2  7  1
        665.35057386          0.00059589
        200.17995366          0.00545943
         77.54508557          0.02798099
         33.67785435          0.09411917
         15.62492833          0.21825216
          7.44278674          0.33739971
          3.53360735          0.35141419
  1  2  2  1  1
          1.63637251          1.00000000
  1  2  2  1  1
          0.67845685          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  3  3  1  1
          0.41300000          1.00000000
  1  3  3  1  1
          0.95570000          1.00000000
  1  4  4  1  1
          0.73950000          1.00000000
