************************************************************************
* This file is part of OpenMolcas.                                     *
*                                                                      *
* OpenMolcas is free software; you can redistribute it and/or modify   *
* it under the terms of the GNU Lesser General Public License, v. 2.1. *
* OpenMolcas is distributed in the hope that it will be useful, but it *
* is provided "as is" and without any express or implied warranties.   *
* For more details see the full text of the license in the file        *
* LICENSE or in <http://www.gnu.org/licenses/>.                        *
************************************************************************
aug-cc-pVTZ
Ref:  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).

/H.aug-cc-pVTZ.Dunning.6s3p2d.4s3p2d..
Ref:  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
HYDROGEN     (5s,2p,1d) -> [3s,2p,1d], Diffuse (1s,1p,1d)
Options
OrbitalEnergies
EndOptions
          1.   2
* S-type functions
    6    4
          33.87000000
           5.09500000
           1.15900000
           0.32580000
           0.10270000
           0.02526000
  0.00606800  0.00000000  0.00000000  0.00000000
  0.04530800  0.00000000  0.00000000  0.00000000
  0.20282200  0.00000000  0.00000000  0.00000000
  0.50390300  1.00000000  0.00000000  0.00000000
  0.38342100  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.50
* P-type functions
    3    3
           1.40700000
           0.38800000
           0.10200000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* D-type functions
    2    2
           1.05700000
           0.24700000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/He.aug-cc-pVTZ.Woon.7s3p2d.4s3p2d..
Ref:  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
HELIUM       (6s,2p,1d) -> [3s,2p,1d], Diffuse (1s,1p,1d)
Options
OrbitalEnergies
EndOptions
          2.   2
* S-type functions
    7    4
         234.00000000
          35.16000000
           7.98900000
           2.21200000
           0.66690000
           0.20890000
           0.05138000
  0.00258700  0.00000000  0.00000000  0.00000000
  0.01953300  0.00000000  0.00000000  0.00000000
  0.09099800  0.00000000  0.00000000  0.00000000
  0.27205000  0.00000000  0.00000000  0.00000000
  0.47806500  1.00000000  0.00000000  0.00000000
  0.30773700  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.91795
* P-type functions
    3    3
           3.04400000
           0.75800000
           0.19930000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* D-type functions
    2    2
           1.96500000
           0.45920000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/B.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6769 (1992).
BORON        (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
          5.   3
* S-type functions
   11    5
        5473.00000000
         820.90000000
         186.80000000
          52.83000000
          17.08000000
           5.99900000
           2.20800000
           0.58790000
           0.24150000
           0.08610000
           0.02914000
  0.00055500 -0.00011200  0.00000000  0.00000000  0.00000000
  0.00429100 -0.00086800  0.00000000  0.00000000  0.00000000
  0.02194900 -0.00448400  0.00000000  0.00000000  0.00000000
  0.08444100 -0.01768300  0.00000000  0.00000000  0.00000000
  0.23855700 -0.05363900  0.00000000  0.00000000  0.00000000
  0.43507200 -0.11900500  0.00000000  0.00000000  0.00000000
  0.34195500 -0.16582400  0.00000000  0.00000000  0.00000000
  0.03685600  0.12010700  1.00000000  0.00000000  0.00000000
 -0.00954500  0.59598100  0.00000000  0.00000000  0.00000000
  0.00236800  0.41102100  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -7.69533  -0.49469
* P-type functions
    6    4
          12.05000000
           2.61300000
           0.74750000
           0.23850000
           0.07698000
           0.02096000
  0.01311800  0.00000000  0.00000000  0.00000000
  0.07989600  0.00000000  0.00000000  0.00000000
  0.27727500  0.00000000  0.00000000  0.00000000
  0.50427000  1.00000000  0.00000000  0.00000000
  0.35368000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.30986
* D-type functions
    3    3
           0.66100000
           0.19900000
           0.06040000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.49000000
           0.16300000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/C.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6769 (1992).
CARBON       (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
          6.   3
* S-type functions
   11    5
        8236.00000000
        1235.00000000
         280.80000000
          79.27000000
          25.59000000
           8.99700000
           3.31900000
           0.90590000
           0.36430000
           0.12850000
           0.04402000
  0.00053100 -0.00011300  0.00000000  0.00000000  0.00000000
  0.00410800 -0.00087800  0.00000000  0.00000000  0.00000000
  0.02108700 -0.00454000  0.00000000  0.00000000  0.00000000
  0.08185300 -0.01813300  0.00000000  0.00000000  0.00000000
  0.23481700 -0.05576000  0.00000000  0.00000000  0.00000000
  0.43440100 -0.12689500  0.00000000  0.00000000  0.00000000
  0.34612900 -0.17035200  0.00000000  0.00000000  0.00000000
  0.03937800  0.14038200  1.00000000  0.00000000  0.00000000
 -0.00898300  0.59868400  0.00000000  0.00000000  0.00000000
  0.00238500  0.39538900  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -11.32554  -0.70563
* P-type functions
    6    4
          18.71000000
           4.13300000
           1.20000000
           0.38270000
           0.12090000
           0.03569000
  0.01403100  0.00000000  0.00000000  0.00000000
  0.08686600  0.00000000  0.00000000  0.00000000
  0.29021600  0.00000000  0.00000000  0.00000000
  0.50100800  1.00000000  0.00000000  0.00000000
  0.34340600  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.43335
* D-type functions
    3    3
           1.09700000
           0.31800000
           0.10000000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.76100000
           0.26800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/N.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6769 (1992).
NITROGEN     (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
          7.   3
* S-type functions
   11    5
       11420.00000000
        1712.00000000
         389.30000000
         110.00000000
          35.57000000
          12.54000000
           4.64400000
           1.29300000
           0.51180000
           0.17870000
           0.05760000
  0.00052300 -0.00011500  0.00000000  0.00000000  0.00000000
  0.00404500 -0.00089500  0.00000000  0.00000000  0.00000000
  0.02077500 -0.00462400  0.00000000  0.00000000  0.00000000
  0.08072700 -0.01852800  0.00000000  0.00000000  0.00000000
  0.23307400 -0.05733900  0.00000000  0.00000000  0.00000000
  0.43350100 -0.13207600  0.00000000  0.00000000  0.00000000
  0.34747200 -0.17251000  0.00000000  0.00000000  0.00000000
  0.04126200  0.15181400  1.00000000  0.00000000  0.00000000
 -0.00850800  0.59994400  0.00000000  0.00000000  0.00000000
  0.00238400  0.38746200  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -15.62909  -0.94531
* P-type functions
    6    4
          26.63000000
           5.94800000
           1.74200000
           0.55500000
           0.17250000
           0.04910000
  0.01467000  0.00000000  0.00000000  0.00000000
  0.09176400  0.00000000  0.00000000  0.00000000
  0.29868300  0.00000000  0.00000000  0.00000000
  0.49848700  1.00000000  0.00000000  0.00000000
  0.33702300  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.56758
* D-type functions
    3    3
           1.65400000
           0.46900000
           0.15100000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           1.09300000
           0.36400000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/O.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6769 (1992).
OXYGEN       (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
          8.   3
* S-type functions
   11    5
       15330.00000000
        2299.00000000
         522.40000000
         147.30000000
          47.55000000
          16.76000000
           6.20700000
           1.75200000
           0.68820000
           0.23840000
           0.07376000
  0.00050800 -0.00011500  0.00000000  0.00000000  0.00000000
  0.00392900 -0.00089500  0.00000000  0.00000000  0.00000000
  0.02024300 -0.00463600  0.00000000  0.00000000  0.00000000
  0.07918100 -0.01872400  0.00000000  0.00000000  0.00000000
  0.23068700 -0.05846300  0.00000000  0.00000000  0.00000000
  0.43311800 -0.13646300  0.00000000  0.00000000  0.00000000
  0.35026000 -0.17574000  0.00000000  0.00000000  0.00000000
  0.04272800  0.16093400  1.00000000  0.00000000  0.00000000
 -0.00815400  0.60341800  0.00000000  0.00000000  0.00000000
  0.00238100  0.37876500  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -20.66866  -1.24433
* P-type functions
    6    4
          34.46000000
           7.74900000
           2.28000000
           0.71560000
           0.21400000
           0.05974000
  0.01592800  0.00000000  0.00000000  0.00000000
  0.09974000  0.00000000  0.00000000  0.00000000
  0.31049200  0.00000000  0.00000000  0.00000000
  0.49102600  1.00000000  0.00000000  0.00000000
  0.33633700  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.63192
* D-type functions
    3    3
           2.31400000
           0.64500000
           0.21400000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           1.42800000
           0.50000000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/F.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6769 (1992).
FLUORINE     (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
          9.   3
* S-type functions
   11    5
       19500.00000000
        2923.00000000
         664.50000000
         187.50000000
          60.62000000
          21.42000000
           7.95000000
           2.25700000
           0.88150000
           0.30410000
           0.09158000
  0.00050700 -0.00011700  0.00000000  0.00000000  0.00000000
  0.00392300 -0.00091200  0.00000000  0.00000000  0.00000000
  0.02020000 -0.00471700  0.00000000  0.00000000  0.00000000
  0.07901000 -0.01908600  0.00000000  0.00000000  0.00000000
  0.23043900 -0.05965500  0.00000000  0.00000000  0.00000000
  0.43287200 -0.14001000  0.00000000  0.00000000  0.00000000
  0.34996400 -0.17678200  0.00000000  0.00000000  0.00000000
  0.04323300  0.17162500  1.00000000  0.00000000  0.00000000
 -0.00789200  0.60504300  0.00000000  0.00000000  0.00000000
  0.00238400  0.36951200  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -26.38273  -1.57254
* P-type functions
    6    4
          43.88000000
           9.92600000
           2.93000000
           0.91320000
           0.26720000
           0.07361000
  0.01666500  0.00000000  0.00000000  0.00000000
  0.10447200  0.00000000  0.00000000  0.00000000
  0.31726000  0.00000000  0.00000000  0.00000000
  0.48734300  1.00000000  0.00000000  0.00000000
  0.33460400  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.73001
* D-type functions
    3    3
           3.10700000
           0.85500000
           0.29200000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           1.91700000
           0.72400000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Ne.aug-cc-pVTZ.Kendall.11s6p3d2f.5s4p3d2f..
Ref: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
NEON         (10s,5p,2d,1f) -> [4s,3p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         10.   3
* S-type functions
   11    5
       24350.00000000
        3650.00000000
         829.60000000
         234.00000000
          75.61000000
          26.73000000
           9.92700000
           2.83600000
           1.10200000
           0.37820000
           0.11330000
  0.00050200 -0.00011800  0.00000000  0.00000000  0.00000000
  0.00388100 -0.00091500  0.00000000  0.00000000  0.00000000
  0.01999700 -0.00473700  0.00000000  0.00000000  0.00000000
  0.07841800 -0.01923300  0.00000000  0.00000000  0.00000000
  0.22967600 -0.06036900  0.00000000  0.00000000  0.00000000
  0.43272200 -0.14250800  0.00000000  0.00000000  0.00000000
  0.35064200 -0.17771000  0.00000000  0.00000000  0.00000000
  0.04391100  0.17735200  1.00000000  0.00000000  0.00000000
 -0.00764500  0.60583600  0.00000000  0.00000000  0.00000000
  0.00237500  0.36510900  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -32.77248  -1.93043
* P-type functions
    6    4
          54.70000000
          12.43000000
           3.67900000
           1.14300000
           0.33000000
           0.09175000
  0.01715100  0.00000000  0.00000000  0.00000000
  0.10765600  0.00000000  0.00000000  0.00000000
  0.32168100  0.00000000  0.00000000  0.00000000
  0.48523200  1.00000000  0.00000000  0.00000000
  0.33258400  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -0.85044
* D-type functions
    3    3
           4.01400000
           1.09600000
           0.38600000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           2.54400000
           1.08400000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Al.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
ALUMINUM     (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         13.   3
* S-type functions
   16    6
      205500.00000000
       30780.00000000
        7006.00000000
        1985.00000000
         649.10000000
         235.00000000
          91.62000000
          37.67000000
          15.91000000
           5.85000000
           2.54200000
           1.05700000
           0.29310000
           0.14550000
           0.05650000
           0.02210000
  0.00006788 -0.00001764  0.00000407  0.00000000  0.00000000  0.00000000
  0.00052715 -0.00013720  0.00003166  0.00000000  0.00000000  0.00000000
  0.00276203 -0.00071891  0.00016612  0.00000000  0.00000000  0.00000000
  0.01147280 -0.00301146  0.00069499  0.00000000  0.00000000  0.00000000
  0.03981880 -0.01060140  0.00245511  0.00000000  0.00000000  0.00000000
  0.11504000 -0.03213450  0.00744598  0.00000000  0.00000000  0.00000000
  0.26088700 -0.08031560  0.01882530  0.00000000  0.00000000  0.00000000
  0.39638600 -0.15679400  0.03727720  0.00000000  0.00000000  0.00000000
  0.28459700 -0.16837600  0.04194960  0.00000000  0.00000000  0.00000000
  0.04445830  0.12687900 -0.03543750  0.00000000  0.00000000  0.00000000
 -0.00489838  0.56149400 -0.17513200  0.00000000  0.00000000  0.00000000
  0.00261253  0.43661300 -0.27620300  0.00000000  0.00000000  0.00000000
 -0.00108915  0.03572930  0.10872900  1.00000000  0.00000000  0.00000000
  0.00072207 -0.01145630  0.65280900  0.00000000  0.00000000  0.00000000
 -0.00017849  0.00220201  0.39458700  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -58.50105  -4.91069  -0.39430
* P-type functions
   10    5
         444.40000000
         105.10000000
          33.47000000
          12.33000000
           4.86900000
           1.96100000
           0.78340000
           0.18880000
           0.05557000
           0.01460000
  0.00162786 -0.00028634  0.00000000  0.00000000  0.00000000
  0.01306870 -0.00242308  0.00000000  0.00000000  0.00000000
  0.06123410 -0.01086580  0.00000000  0.00000000  0.00000000
  0.18787000 -0.03643070  0.00000000  0.00000000  0.00000000
  0.36045200 -0.06410740  0.00000000  0.00000000  0.00000000
  0.40845400 -0.09722390  0.00000000  0.00000000  0.00000000
  0.18864000  0.01474370  1.00000000  0.00000000  0.00000000
  0.00976514  0.50344800  0.00000000  0.00000000  0.00000000
 -0.00115057  0.59798400  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -3.21834  -0.21002
* D-type functions
    3    3
           0.10900000
           0.33300000
           0.03560000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.24400000
           0.08580000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Si.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
SILICON      (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         14.   3
* S-type functions
   16    6
      254900.00000000
       38190.00000000
        8690.00000000
        2462.00000000
         804.80000000
         291.30000000
         113.60000000
          46.75000000
          19.82000000
           7.70800000
           3.34000000
           1.40200000
           0.43870000
           0.20700000
           0.07944000
           0.03300000
  0.00006251 -0.00001664  0.00000426  0.00000000  0.00000000  0.00000000
  0.00048555 -0.00012931  0.00003311  0.00000000  0.00000000  0.00000000
  0.00254516 -0.00067883  0.00017402  0.00000000  0.00000000  0.00000000
  0.01058660 -0.00284117  0.00072757  0.00000000  0.00000000  0.00000000
  0.03687870 -0.01005510  0.00258333  0.00000000  0.00000000  0.00000000
  0.10747900 -0.03057740  0.00786354  0.00000000  0.00000000  0.00000000
  0.24793600 -0.07772560  0.02021550  0.00000000  0.00000000  0.00000000
  0.39092700 -0.15423600  0.04073200  0.00000000  0.00000000  0.00000000
  0.30202600 -0.18036800  0.04993580  0.00000000  0.00000000  0.00000000
  0.05592360  0.07982180 -0.02493960  0.00000000  0.00000000  0.00000000
 -0.00402406  0.54744100 -0.19035000  0.00000000  0.00000000  0.00000000
  0.00258030  0.48011900 -0.31835000  0.00000000  0.00000000  0.00000000
 -0.00103821  0.04748460  0.09480360  1.00000000  0.00000000  0.00000000
  0.00060793 -0.01069960  0.68118000  0.00000000  0.00000000  0.00000000
 -0.00015402  0.00219871  0.39567200  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -68.81239  -6.15647  -0.53978
* P-type functions
   10    5
         481.50000000
         113.90000000
          36.23000000
          13.34000000
           5.25200000
           2.12000000
           0.85610000
           0.25280000
           0.07889000
           0.02370000
  0.00192045 -0.00040522  0.00000000  0.00000000  0.00000000
  0.01535520 -0.00335896  0.00000000  0.00000000  0.00000000
  0.07139910 -0.01528600  0.00000000  0.00000000  0.00000000
  0.21305200 -0.04892180  0.00000000  0.00000000  0.00000000
  0.39035400 -0.08550080  0.00000000  0.00000000  0.00000000
  0.39372100 -0.11213700  0.00000000  0.00000000  0.00000000
  0.13256500  0.06182740  1.00000000  0.00000000  0.00000000
  0.00395630  0.55191900  0.00000000  0.00000000  0.00000000
  0.00033162  0.52349200  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -4.25598  -0.29703
* D-type functions
    3    3
           0.15900000
           0.48100000
           0.05560000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.33600000
           0.12500000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/P.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
PHOSPHORUS   (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         15.   3
* S-type functions
   16    6
      312400.00000000
       46800.00000000
       10650.00000000
        3018.00000000
         986.80000000
         357.40000000
         139.60000000
          57.63000000
          24.60000000
          10.12000000
           4.28300000
           1.80500000
           0.61580000
           0.27820000
           0.10550000
           0.04090000
  0.00005770 -0.00001567  0.00000431  0.00000000  0.00000000  0.00000000
  0.00044830 -0.00012172  0.00003342  0.00000000  0.00000000  0.00000000
  0.00234939 -0.00063967  0.00017589  0.00000000  0.00000000  0.00000000
  0.00978265 -0.00267426  0.00073434  0.00000000  0.00000000  0.00000000
  0.03414670 -0.00949831  0.00261775  0.00000000  0.00000000  0.00000000
  0.10020400 -0.02893490  0.00797852  0.00000000  0.00000000  0.00000000
  0.23437200 -0.07451210  0.02079400  0.00000000  0.00000000  0.00000000
  0.38243400 -0.14993800  0.04244460  0.00000000  0.00000000  0.00000000
  0.31808800 -0.18946700  0.05634360  0.00000000  0.00000000  0.00000000
  0.07077880  0.03632700 -0.01273580  0.00000000  0.00000000  0.00000000
 -0.00181799  0.52881600 -0.19649500  0.00000000  0.00000000  0.00000000
  0.00216180  0.51911500 -0.35355500  0.00000000  0.00000000  0.00000000
 -0.00083474  0.06055470  0.07414070  1.00000000  0.00000000  0.00000000
  0.00043230 -0.00925695  0.70091200  0.00000000  0.00000000  0.00000000
 -0.00011425  0.00210372  0.40473900  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -79.96965  -7.51102  -0.69636
* P-type functions
   10    5
         504.90000000
         119.40000000
          37.96000000
          13.95000000
           5.45700000
           2.17700000
           0.80100000
           0.28770000
           0.09714000
           0.03070000
  0.00233728 -0.00055524  0.00000000  0.00000000  0.00000000
  0.01854100 -0.00445913  0.00000000  0.00000000  0.00000000
  0.08496930 -0.02063500  0.00000000  0.00000000  0.00000000
  0.24461500 -0.06176940  0.00000000  0.00000000  0.00000000
  0.42276600 -0.10892400  0.00000000  0.00000000  0.00000000
  0.36843900 -0.10559900  0.00000000  0.00000000  0.00000000
  0.07727340  0.15348300  1.00000000  0.00000000  0.00000000
 -0.00379005  0.57698100  0.00000000  0.00000000  0.00000000
  0.00159939  0.42243900  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -5.40088  -0.39161
* D-type functions
    3    3
           0.21600000
           0.65200000
           0.07750000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.45200000
           0.16500000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/S.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
SULFUR       (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         16.   3
* S-type functions
   16    6
      374100.00000000
       56050.00000000
       12760.00000000
        3615.00000000
        1183.00000000
         428.80000000
         167.80000000
          69.47000000
          29.84000000
          12.72000000
           5.24400000
           2.21900000
           0.77670000
           0.34900000
           0.13220000
           0.04970000
  0.00005421 -0.00001498  0.00000435  0.00000000  0.00000000  0.00000000
  0.00042086 -0.00011620  0.00003371  0.00000000  0.00000000  0.00000000
  0.00220698 -0.00061158  0.00017767  0.00000000  0.00000000  0.00000000
  0.00919258 -0.00255370  0.00074112  0.00000000  0.00000000  0.00000000
  0.03211230 -0.00908708  0.00264591  0.00000000  0.00000000  0.00000000
  0.09466830 -0.02770450  0.00807487  0.00000000  0.00000000  0.00000000
  0.22363000 -0.07200200  0.02122760  0.00000000  0.00000000  0.00000000
  0.37439300 -0.14643900  0.04383230  0.00000000  0.00000000  0.00000000
  0.32910800 -0.19515000  0.06127160  0.00000000  0.00000000  0.00000000
  0.08470380  0.00819193 -0.00361510  0.00000000  0.00000000  0.00000000
  0.00044085  0.51660100 -0.20451000  0.00000000  0.00000000  0.00000000
  0.00164827  0.54217800 -0.38187100  0.00000000  0.00000000  0.00000000
 -0.00062233  0.06884300  0.08268440  1.00000000  0.00000000  0.00000000
  0.00030131 -0.00918072  0.71414700  0.00000000  0.00000000  0.00000000
 -0.00008413  0.00226832  0.39379100  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -92.00447  -9.00431  -0.87955
* P-type functions
   10    5
         574.40000000
         135.80000000
          43.19000000
          15.87000000
           6.20800000
           2.48300000
           0.86880000
           0.32290000
           0.10980000
           0.03510000
  0.00242264 -0.00062010  0.00000000  0.00000000  0.00000000
  0.01927960 -0.00493882  0.00000000  0.00000000  0.00000000
  0.08854010 -0.02326470  0.00000000  0.00000000  0.00000000
  0.25465400 -0.06851950  0.00000000  0.00000000  0.00000000
  0.43398400 -0.12389600  0.00000000  0.00000000  0.00000000
  0.35495300 -0.09694990  0.00000000  0.00000000  0.00000000
  0.06189410  0.22821500  1.00000000  0.00000000  0.00000000
 -0.00502977  0.56939400  0.00000000  0.00000000  0.00000000
  0.00209813  0.36630200  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -6.68253  -0.43737
* D-type functions
    3    3
           0.26900000
           0.81900000
           0.10100000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.55700000
           0.21800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Cl.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
CHLORINE     (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         17.   3
* S-type functions
   16    6
      456100.00000000
       68330.00000000
       15550.00000000
        4405.00000000
        1439.00000000
         520.40000000
         203.10000000
          83.96000000
          36.20000000
          15.83000000
           6.33400000
           2.69400000
           0.97680000
           0.43130000
           0.16250000
           0.05910000
  0.00004930 -0.00001383  0.00000419  0.00000000  0.00000000  0.00000000
  0.00038303 -0.00010728  0.00003244  0.00000000  0.00000000  0.00000000
  0.00200854 -0.00056508  0.00017111  0.00000000  0.00000000  0.00000000
  0.00838558 -0.00236135  0.00071418  0.00000000  0.00000000  0.00000000
  0.02947030 -0.00845886  0.00256705  0.00000000  0.00000000  0.00000000
  0.08783250 -0.02596380  0.00788552  0.00000000  0.00000000  0.00000000
  0.21147300 -0.06863620  0.02108670  0.00000000  0.00000000  0.00000000
  0.36536400 -0.14187400  0.04422640  0.00000000  0.00000000  0.00000000
  0.34088400 -0.19931900  0.06516700  0.00000000  0.00000000  0.00000000
  0.10213300 -0.01956620  0.00603012  0.00000000  0.00000000  0.00000000
  0.00311675  0.49974100 -0.20649500  0.00000000  0.00000000  0.00000000
  0.00105751  0.56373600 -0.40587100  0.00000000  0.00000000  0.00000000
 -0.00037800  0.07903250  0.07595580  1.00000000  0.00000000  0.00000000
  0.00015614 -0.00835091  0.72566100  0.00000000  0.00000000  0.00000000
 -0.00005141  0.00232456  0.39442300  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -104.88469 -10.60777  -1.07311
* P-type functions
   10    5
         663.30000000
         156.80000000
          49.98000000
          18.42000000
           7.24000000
           2.92200000
           1.02200000
           0.38180000
           0.13010000
           0.04190000
  0.00240448 -0.00065215  0.00000000  0.00000000  0.00000000
  0.01921480 -0.00519445  0.00000000  0.00000000  0.00000000
  0.08850970 -0.02469380  0.00000000  0.00000000  0.00000000
  0.25602000 -0.07281670  0.00000000  0.00000000  0.00000000
  0.43692700 -0.13403000  0.00000000  0.00000000  0.00000000
  0.35033400 -0.09477420  0.00000000  0.00000000  0.00000000
  0.05854950  0.26228900  1.00000000  0.00000000  0.00000000
 -0.00458423  0.56466700  0.00000000  0.00000000  0.00000000
  0.00226970  0.34125000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -8.07252  -0.50652
* D-type functions
    3    3
           1.04600000
           0.34400000
           0.13500000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.70600000
           0.31200000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Ar.aug-cc-pVTZ.Woon.16s10p3d2f.6s5p3d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
ARGON        (15s,9p,2d,1f) -> [5s,4p,2d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         18.   3
* S-type functions
   16    6
      545000.00000000
       81640.00000000
       18580.00000000
        5261.00000000
        1717.00000000
         619.90000000
         241.60000000
          99.79000000
          43.15000000
          19.14000000
           7.48800000
           3.20500000
           1.19600000
           0.52040000
           0.19540000
           0.06850000
  0.00004558 -0.00001296  0.00000405  0.00000000  0.00000000  0.00000000
  0.00035411 -0.00010043  0.00003137  0.00000000  0.00000000  0.00000000
  0.00185797 -0.00052958  0.00016565  0.00000000  0.00000000  0.00000000
  0.00776851 -0.00221396  0.00069166  0.00000000  0.00000000  0.00000000
  0.02742320 -0.00796845  0.00249790  0.00000000  0.00000000  0.00000000
  0.08238360 -0.02458030  0.00771074  0.00000000  0.00000000  0.00000000
  0.20123000 -0.06577980  0.02087140  0.00000000  0.00000000  0.00000000
  0.35678100 -0.13794200  0.04439650  0.00000000  0.00000000  0.00000000
  0.34956300 -0.20163000  0.06802240  0.00000000  0.00000000  0.00000000
  0.11826600 -0.04128340  0.01413500  0.00000000  0.00000000  0.00000000
  0.00560190  0.48468000 -0.20748900  0.00000000  0.00000000  0.00000000
  0.00048347  0.57922400 -0.42504500  0.00000000  0.00000000  0.00000000
 -0.00014809  0.08790830  0.07048550  1.00000000  0.00000000  0.00000000
  0.00002920 -0.00727553  0.73362700  0.00000000  0.00000000  0.00000000
 -0.00002316  0.00232884  0.39600500  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -118.61039 -12.32219  -1.27735
* P-type functions
   10    5
         761.80000000
         180.20000000
          57.50000000
          21.24000000
           8.38800000
           3.41600000
           1.20600000
           0.45230000
           0.15450000
           0.04870000
  0.00236976 -0.00066721  0.00000000  0.00000000  0.00000000
  0.01901990 -0.00532717  0.00000000  0.00000000  0.00000000
  0.08808070 -0.02554940  0.00000000  0.00000000  0.00000000
  0.25637700 -0.07571970  0.00000000  0.00000000  0.00000000
  0.43871100 -0.14113300  0.00000000  0.00000000  0.00000000
  0.34756900 -0.09327680  0.00000000  0.00000000  0.00000000
  0.05667400  0.28287200  1.00000000  0.00000000  0.00000000
 -0.00523882  0.56245000  0.00000000  0.00000000  0.00000000
  0.00164376  0.32505900  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 2
 -9.57150  -0.59102
* D-type functions
    3    3
           0.41000000
           1.25400000
           0.16900000
  1.00000000  0.00000000  0.00000000
  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  1.00000000
 0
* F-type functions
    2    2
           0.89000000
           0.40600000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Fe.aug-cc-pVTZ.Balabanov.21s17p9d3f2g.8s7p5d3f2g..
Ref: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005).
IRON         (20s,16p,8d,2f,1g) -> [7s,6p,4d,2f,1g], Diffuse (1s,1p,1d,1f,1g)
         26.   4
* S-type functions
   21    8
     4316265.00000000
      646342.40000000
      147089.70000000
       41661.52000000
       13590.77000000
        4905.75000000
        1912.74600000
         792.60430000
         344.80650000
         155.89990000
          72.23091000
          32.72506000
          15.66762000
           7.50348300
           3.31222300
           1.55847100
           0.68391400
           0.14675700
           0.07058300
           0.03144900
           0.01401000
  8.048803E-06 -4.155954E-06  9.532178E-07 -2.063008E-07 -4.009367E-07 -6.966042E-07  0.0000000000  0.0000000000
  6.258306E-05 -3.231401E-05  7.414605E-06 -1.604169E-06 -3.189255E-06 -5.568036E-06  0.0000000000  0.0000000000
  0.0003290239 -0.0001699525  3.898393E-05 -8.438437E-06 -1.623079E-05 -2.813684E-05  0.0000000000  0.0000000000
  0.0013873550 -0.0007171369  0.0001647152 -3.563151E-05 -7.15792E-050 -0.0001252418  0.0000000000  0.0000000000
  0.0050232560 -0.0026036250  0.0005985980 -0.0001295998 -0.0002463958 -0.0004260787  0.0000000000  0.0000000000
  0.0161014000 -0.0083991090  0.0019423900 -0.0004201534 -0.0008544907 -0.0014990600  0.0000000000  0.0000000000
  0.0459003400 -0.0243410900  0.0056872370 -0.0012319540 -0.0023075930 -0.0039791030  0.0000000000  0.0000000000
  0.1136154000 -0.0625194800  0.0150132900 -0.0032489220 -0.0067282920 -0.0118568600  0.0000000000  0.0000000000
  0.2283869000 -0.1365929000  0.0345245500 -0.0074937170 -0.0136616500 -0.0234673400  0.0000000000  0.0000000000
  0.3221159000 -0.2312707000  0.0649582000 -0.0141010200 -0.0306224000 -0.0546773600  0.0000000000  0.0000000000
  0.2383661000 -0.2383734000  0.0771619400 -0.0169160000 -0.0263113700 -0.0439382000  0.0000000000  0.0000000000
  0.0740466700  0.0312383700 -0.0187341100  0.0042189960 -0.0097601830 -0.0237610300  0.0000000000  0.0000000000
  0.0921419700  0.5086818000 -0.3009185000  0.0683381000  0.1801906000  0.3435928000  0.0000000000  0.0000000000
  0.0933979000  0.4987695000 -0.4554661000  0.1098201000  0.1529634000  0.3192960000  0.0000000000  0.0000000000
  0.0157396500  0.0903355200  0.1286463000 -0.0400900500  0.0550541300 -0.1343207000  0.0000000000  0.0000000000
 -0.0004186682 -0.0060053370  0.7183316000 -0.2174739000 -0.9551364000 -2.2210200000  0.0000000000  0.0000000000
  5.376318E-05  0.0002312454  0.4051743000 -0.2465135000  0.2586813000  2.5711420000  0.0000000000  0.0000000000
 -3.816654E-05 -0.0005643680  0.0216822700  0.2731435000  1.8340490000 -0.2292404000  0.0000000000  0.0000000000
  4.319603E-05  0.0004992260 -0.0083435660  0.5748321000 -0.9333240000 -1.8324520000  0.0000000000  0.0000000000
 -3.401019E-06 -0.0001015293  0.0036589790  0.3012713000 -0.6981605000  1.5913330000  1.0000000000  0.0000000000
  0.0000000000  0.0000000000  0.0000000000  0.0000000000  0.0000000000  0.0000000000  0.0000000000  1.0000000000
* P-type functions
   17    7
       17745.69000000
        4200.72100000
        1364.42900000
         522.08060000
         221.45950000
         100.90960000
          48.40115000
          23.98536000
          12.18250000
           6.24229800
           3.11094400
           1.50995800
           0.71084500
           0.27319000
           0.10423300
           0.03829100
           0.01407000
  0.00004100 -0.00001500  0.00000300  0.00000500  0.00001100  0.00000000  0.00000000
  0.00036900 -0.00013000  0.00002900  0.00004200  0.00008700  0.00000000  0.00000000
  0.00212900 -0.00075100  0.00016500  0.00024100  0.00054100  0.00000000  0.00000000
  0.00936900 -0.00332900  0.00073400  0.00108500  0.00222600  0.00000000  0.00000000
  0.03309700 -0.01191200  0.00262600  0.00383100  0.00859300  0.00000000  0.00000000
  0.09443100 -0.03493300  0.00772500  0.01142300  0.02333900  0.00000000  0.00000000
  0.20807700 -0.07998900  0.01773300  0.02579200  0.05884400  0.00000000  0.00000000
  0.33233300 -0.13463600  0.03005500  0.04481800  0.08828900  0.00000000  0.00000000
  0.33298700 -0.13859800  0.03109400  0.04459800  0.12319200  0.00000000  0.00000000
  0.15684300  0.03027800 -0.01004800 -0.01117700 -0.06318600  0.00000000  0.00000000
  0.02154900  0.33321600 -0.08830600 -0.13813400 -0.35490200  0.00000000  0.00000000
 -0.00209500  0.45615300 -0.12982400 -0.18828500 -0.61970800  0.00000000  0.00000000
 -0.00173900  0.28505100 -0.07693700 -0.10739900  0.81298600  0.00000000  0.00000000
 -0.00030000  0.04614400  0.21266100  0.44486300  0.81911800  0.00000000  0.00000000
  0.00002900 -0.00324900  0.57306100  0.64023900 -0.90170500  0.00000000  0.00000000
 -0.00001100  0.00135700  0.36965100  0.06445700 -0.13591300  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
* D-type functions
    9    5
         113.34400000
          33.64140000
          12.33100000
           4.99478000
           2.07280000
           0.83075300
           0.30917800
           0.10013000
           0.03243000
  0.00353000 -0.00389000  0.00569500  0.00000000  0.00000000
  0.02578400 -0.02844200  0.04200100  0.00000000  0.00000000
  0.09911900 -0.11242900  0.17354000  0.00000000  0.00000000
  0.23907300 -0.27425700  0.41015700  0.00000000  0.00000000
  0.35719900 -0.31554600  0.11325200  0.00000000  0.00000000
  0.36218800  0.05710900 -0.76968000  0.00000000  0.00000000
  0.23646100  0.56360400 -0.03164300  0.00000000  0.00000000
  0.06011800  0.38463700  0.71379700  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
* F-type functions
    3    3
           3.27580000
           0.79200000
           0.27490000
 1.00000000  0.00000000  0.00000000
 0.00000000  1.00000000  0.00000000
 0.00000000  0.00000000  1.00000000
* G-type functions
    2    2
           2.08970000
           0.78716000
  1.00000000  0.00000000
  0.00000000  1.00000000
/Ga.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
GALLIUM      (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         31.   3
* S-type functions
   21    7
     6558157.30000000
      982025.34000000
      223467.69000000
       63288.29100000
       20642.94000000
        7450.52240000
        2905.07440000
        1204.21000000
         524.30454000
         237.46563000
         110.57866000
          51.37462400
          24.44084600
          11.76859100
           5.34211900
           2.49503600
           1.09877300
           0.26018000
           0.12707900
           0.05440800
           0.01439800
  0.00000800 -0.00000250  0.00000090  0.00000020  0.00000000  0.00000000  0.00000000
  0.00006220 -0.00001930  0.00000740  0.00000170  0.00000000  0.00000000  0.00000000
  0.00032700 -0.00010140  0.00003870  0.00000900  0.00000000  0.00000000  0.00000000
  0.00137940 -0.00042810  0.00016330  0.00003800  0.00000000  0.00000000  0.00000000
  0.00499930 -0.00155820  0.00059440  0.00013820  0.00000000  0.00000000  0.00000000
  0.01606050 -0.00504690  0.00192920  0.00044890  0.00000000  0.00000000  0.00000000
  0.04601240 -0.01480560  0.00566890  0.00131880  0.00000000  0.00000000  0.00000000
  0.11522240 -0.03894820  0.01502820  0.00350160  0.00000000  0.00000000  0.00000000
  0.23739210 -0.08968320  0.03502220  0.00816730  0.00000000  0.00000000  0.00000000
  0.35319890 -0.16640760  0.06711350  0.01573380  0.00000000  0.00000000  0.00000000
  0.29155000 -0.20040100  0.08501560  0.02002840  0.00000000  0.00000000  0.00000000
  0.08121290  0.01149430 -0.00472120 -0.00101360  0.00000000  0.00000000  0.00000000
  0.00076550  0.49581340 -0.30167370 -0.07501620  0.00000000  0.00000000  0.00000000
  0.00161240  0.52955500 -0.48254890 -0.12579800  0.00000000  0.00000000  0.00000000
 -0.00075300  0.11101850  0.08916950  0.03008570  0.00000000  0.00000000  0.00000000
  0.00031340 -0.00070000  0.72878300  0.24881690  0.00000000  0.00000000  0.00000000
 -0.00013060  0.00222830  0.42885420  0.28437060  0.00000000  0.00000000  0.00000000
  0.00005130 -0.00050140  0.02072490 -0.31105940  0.00000000  0.00000000  0.00000000
 -0.00003790  0.00037090 -0.00871280 -0.58620620  1.00000000  0.00000000  0.00000000
  0.00001090 -0.00010700  0.00203650 -0.27838240  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -378.81805 -48.16849  -6.39460  -0.42446
* P-type functions
   14    6
        8050.16740000
        1907.53610000
         618.62746000
         235.32417000
          98.89964600
          44.24821500
          20.61742900
           9.78051600
           4.44123800
           1.96404500
           0.83357800
           0.19344500
           0.05611700
           0.01930000
  0.00031690 -0.00012030  0.00002000  0.00000000  0.00000000  0.00000000
  0.00276480 -0.00104920  0.00016890  0.00000000  0.00000000  0.00000000
  0.01512040 -0.00581020  0.00096680  0.00000000  0.00000000  0.00000000
  0.05995830 -0.02343450  0.00377970  0.00000000  0.00000000  0.00000000
  0.17331200 -0.07082700  0.01190820  0.00000000  0.00000000  0.00000000
  0.34108200 -0.14655110  0.02356930  0.00000000  0.00000000  0.00000000
  0.38969670 -0.17696600  0.03142330  0.00000000  0.00000000  0.00000000
  0.18398170  0.03638210 -0.01361880  0.00000000  0.00000000  0.00000000
  0.02188960  0.42328480 -0.07340030  0.00000000  0.00000000  0.00000000
  0.00116080  0.49525860 -0.12647850  0.00000000  0.00000000  0.00000000
  0.00027350  0.17974280  0.01585790  0.00000000  0.00000000  0.00000000
  0.00001260  0.00621320  0.50737570  1.00000000  0.00000000  0.00000000
 -0.00000460 -0.00074060  0.60026060  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -42.49412  -4.48235  -0.20849
* D-type functions
   10    4
         244.14741000
          73.06759500
          27.59208100
          11.54651800
           5.04862800
           2.17846500
           0.90025300
           0.33732700
           0.11690000
           0.03870000
  0.00202700  0.00000000  0.00000000  0.00000000
  0.01650880  0.00000000  0.00000000  0.00000000
  0.07038230  0.00000000  0.00000000  0.00000000
  0.19114300  0.00000000  0.00000000  0.00000000
  0.32540920  0.00000000  0.00000000  0.00000000
  0.36781990  0.00000000  0.00000000  0.00000000
  0.27446850  0.00000000  0.00000000  0.00000000
  0.09562320  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -1.19332
* F-type functions
    2    2
           0.28810000
           0.09800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Ge.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
GERMANIUM    (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         32.   3
* S-type functions
   21    7
     7447966.80000000
     1115318.20000000
      253842.65000000
       71915.28500000
       23470.18100000
        8477.49180000
        3308.39080000
        1372.60540000
         598.22007000
         271.38602000
         126.97795000
          60.22206500
          28.01858200
          13.51752200
           6.30940600
           2.90453400
           1.28755600
           0.33655200
           0.16773200
           0.07106900
           0.02737000
  0.00000740 -0.00000230  0.00000090 -0.00000020  0.00000000  0.00000000  0.00000000
  0.00005740 -0.00001790  0.00000690 -0.00000180  0.00000000  0.00000000  0.00000000
  0.00030190 -0.00009400  0.00003620 -0.00000930  0.00000000  0.00000000  0.00000000
  0.00127330 -0.00039640  0.00015280 -0.00003920  0.00000000  0.00000000  0.00000000
  0.00461230 -0.00144250  0.00055630 -0.00014260  0.00000000  0.00000000  0.00000000
  0.01482140 -0.00466750  0.00180180 -0.00046210  0.00000000  0.00000000  0.00000000
  0.04255360 -0.01371530  0.00530850 -0.00136140  0.00000000  0.00000000  0.00000000
  0.10730550 -0.03617970  0.01408770 -0.00361750  0.00000000  0.00000000  0.00000000
  0.22451780 -0.08416790  0.03320130 -0.00853590  0.00000000  0.00000000  0.00000000
  0.34531310 -0.15887670  0.06446210 -0.01665060  0.00000000  0.00000000  0.00000000
  0.30452610 -0.20338070  0.08695400 -0.02259110  0.00000000  0.00000000  0.00000000
  0.09906700 -0.02514100  0.01187450 -0.00321470  0.00000000  0.00000000  0.00000000
  0.00413170  0.45751520 -0.27245340  0.07449980  0.00000000  0.00000000  0.00000000
  0.00103470  0.55719390 -0.50014520  0.14403330  0.00000000  0.00000000  0.00000000
 -0.00048560  0.13970550  0.01085540 -0.00808150  0.00000000  0.00000000  0.00000000
  0.00018050  0.00226450  0.72164690 -0.27041630  0.00000000  0.00000000  0.00000000
 -0.00009120  0.00209270  0.48052130 -0.34016070  0.00000000  0.00000000  0.00000000
  0.00003780 -0.00047390  0.02777380  0.29220840  1.00000000  0.00000000  0.00000000
 -0.00002660  0.00032810 -0.01022970  0.61906570  0.00000000  0.00000000  0.00000000
  0.00000720 -0.00009160  0.00224440  0.28632760  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -405.24403 -52.15019  -7.19090  -0.55331
* P-type functions
   14    6
        6979.59820000
        1654.16480000
         536.02865000
         203.53713000
          85.23753000
          37.84196200
          17.40651200
           7.88149200
           3.53321300
           1.52147300
           0.56270400
           0.19909300
           0.06703100
           0.02136800
  0.00045690 -0.00017560  0.00003480  0.00000000  0.00000000  0.00000000
  0.00395620 -0.00153050  0.00030140  0.00000000  0.00000000  0.00000000
  0.02131430 -0.00831450  0.00164870  0.00000000  0.00000000  0.00000000
  0.08187150 -0.03287180  0.00649820  0.00000000  0.00000000  0.00000000
  0.22237320 -0.09316610  0.01863830  0.00000000  0.00000000  0.00000000
  0.39056590 -0.17555420  0.03506130  0.00000000  0.00000000  0.00000000
  0.35604150 -0.14679120  0.02958920  0.00000000  0.00000000  0.00000000
  0.10703120  0.18629340 -0.04724580  0.00000000  0.00000000  0.00000000
  0.00369410  0.52648620 -0.12498470  0.00000000  0.00000000  0.00000000
  0.00192190  0.39708590 -0.12108010  0.00000000  0.00000000  0.00000000
 -0.00041640  0.05714750  0.13686690  1.00000000  0.00000000  0.00000000
  0.00019170 -0.00334780  0.57547300  0.00000000  0.00000000  0.00000000
 -0.00006120  0.00127380  0.44426890  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -46.23602  -5.16148  -0.28729
* D-type functions
   10    4
         282.23911000
          84.54995700
          32.07365600
          13.49749500
           5.95855000
           2.61078800
           1.10398700
           0.42404900
           0.15200000
           0.05280000
  0.00182750  0.00000000  0.00000000  0.00000000
  0.01515450  0.00000000  0.00000000  0.00000000
  0.06604600  0.00000000  0.00000000  0.00000000
  0.18394700  0.00000000  0.00000000  0.00000000
  0.32278720  0.00000000  0.00000000  0.00000000
  0.37294590  0.00000000  0.00000000  0.00000000
  0.27517300  0.00000000  0.00000000  0.00000000
  0.08852340  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -1.63475
* F-type functions
    2    2
           0.34580000
           0.13230000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/As.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
ARSENIC      (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         33.   3
* S-type functions
   21    7
     8482339.60000000
     1270150.90000000
      289056.96000000
       81879.84900000
       26716.56400000
        9647.58420000
        3764.11950000
        1561.56560000
         680.81467000
         309.24119000
         145.25736000
          69.73904800
          31.77032500
          15.39175700
           7.34152600
           3.32371600
           1.48586700
           0.42108600
           0.21150000
           0.08897400
           0.03340700
  0.00000680 -0.00000210  0.00000080 -0.00000020  0.00000000  0.00000000  0.00000000
  0.00005280 -0.00001650  0.00000640 -0.00000180  0.00000000  0.00000000  0.00000000
  0.00027740 -0.00008660  0.00003370 -0.00000930  0.00000000  0.00000000  0.00000000
  0.00117020 -0.00036530  0.00014230 -0.00003920  0.00000000  0.00000000  0.00000000
  0.00424210 -0.00133090  0.00051880 -0.00014290  0.00000000  0.00000000  0.00000000
  0.01365570 -0.00430930  0.00168020 -0.00046290  0.00000000  0.00000000  0.00000000
  0.03933990 -0.01269730  0.00496770 -0.00136870  0.00000000  0.00000000  0.00000000
  0.09992920 -0.03361600  0.01321150 -0.00364400  0.00000000  0.00000000  0.00000000
  0.21215550 -0.07894700  0.03145660 -0.00868840  0.00000000  0.00000000  0.00000000
  0.33638660 -0.15144580  0.06184460 -0.01715560  0.00000000  0.00000000  0.00000000
  0.31551250 -0.20420140  0.08795660 -0.02455140  0.00000000  0.00000000  0.00000000
  0.11813120 -0.05573670  0.02575480 -0.00735240  0.00000000  0.00000000  0.00000000
  0.00800760  0.41876070 -0.24554590  0.07200870  0.00000000  0.00000000  0.00000000
  0.00032930  0.57587620 -0.50905720  0.15762540  0.00000000  0.00000000  0.00000000
 -0.00015230  0.16968420 -0.05557490  0.01420740  0.00000000  0.00000000  0.00000000
  0.00002470  0.00606620  0.70837960 -0.28515930  0.00000000  0.00000000  0.00000000
 -0.00003660  0.00176050  0.52310270 -0.38853470  0.00000000  0.00000000  0.00000000
  0.00001450 -0.00036600  0.03481760  0.26910610  1.00000000  0.00000000  0.00000000
 -0.00000940  0.00023160 -0.01111760  0.64953370  0.00000000  0.00000000  0.00000000
  0.00000260 -0.00006610  0.00236360  0.29740470  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -432.58580 -56.30982  -8.02962  -0.68589
* P-type functions
   14    6
        7423.86140000
        1759.51660000
         570.22916000
         216.57997000
          90.73425200
          40.30879100
          18.55550200
           8.39654300
           3.76736700
           1.62970100
           0.56826300
           0.22250300
           0.08040500
           0.02679900
  0.00045990 -0.00017940  0.00003990  0.00000000  0.00000000  0.00000000
  0.00398230 -0.00156410  0.00034880  0.00000000  0.00000000  0.00000000
  0.02146380 -0.00849990  0.00189530  0.00000000  0.00000000  0.00000000
  0.08246170 -0.03363270  0.00753250  0.00000000  0.00000000  0.00000000
  0.22389020 -0.09532280  0.02143150  0.00000000  0.00000000  0.00000000
  0.39207040 -0.17936260  0.04078070  0.00000000  0.00000000  0.00000000
  0.35422380 -0.14666820  0.03252490  0.00000000  0.00000000  0.00000000
  0.10486410  0.19660160 -0.05488320  0.00000000  0.00000000  0.00000000
  0.00336640  0.53720880 -0.15119220  0.00000000  0.00000000  0.00000000
  0.00184950  0.38573610 -0.12490110  0.00000000  0.00000000  0.00000000
 -0.00044960  0.04709470  0.20891540  1.00000000  0.00000000  0.00000000
  0.00022970 -0.00540060  0.58552930  0.00000000  0.00000000  0.00000000
 -0.00007190  0.00153050  0.36446600  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -50.15375  -5.88068  -0.36946
* D-type functions
   10    4
         321.01961000
          96.24930500
          36.64496300
          15.49396500
           6.89113800
           3.05483100
           1.31424100
           0.51343000
           0.18770000
           0.07000000
  0.00168400  0.00000000  0.00000000  0.00000000
  0.01415860  0.00000000  0.00000000  0.00000000
  0.06282590  0.00000000  0.00000000  0.00000000
  0.17849930  0.00000000  0.00000000  0.00000000
  0.32094520  0.00000000  0.00000000  0.00000000
  0.37735150  0.00000000  0.00000000  0.00000000
  0.27502310  0.00000000  0.00000000  0.00000000
  0.08288340  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -2.11262
* F-type functions
    2    2
           0.41580000
           0.16900000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Se.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
SELENIUM     (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         34.   3
* S-type functions
   21    7
     9563600.00000000
     1432100.00000000
      325910.00000000
       92312.00000000
       30116.00000000
       10872.00000000
        4240.10000000
        1758.40000000
         766.59000000
         348.43000000
         164.03000000
          79.14200000
          35.52400000
          17.30500000
           8.37840000
           3.74050000
           1.68900000
           0.50927000
           0.25520000
           0.10651000
           0.03920100
  0.00000630 -0.00000200  0.00000080 -0.00000020  0.00000000  0.00000000  0.00000000
  0.00004890 -0.00001530  0.00000600 -0.00000180  0.00000000  0.00000000  0.00000000
  0.00025740 -0.00008060  0.00003170 -0.00000930  0.00000000  0.00000000  0.00000000
  0.00108610 -0.00034000  0.00013370 -0.00003910  0.00000000  0.00000000  0.00000000
  0.00393990 -0.00123970  0.00048830 -0.00014280  0.00000000  0.00000000  0.00000000
  0.01270410 -0.00401770  0.00158210 -0.00046270  0.00000000  0.00000000  0.00000000
  0.03671560 -0.01186720  0.00469190 -0.00137220  0.00000000  0.00000000  0.00000000
  0.09386720 -0.03153400  0.01250980 -0.00366280  0.00000000  0.00000000  0.00000000
  0.20176770 -0.07464390  0.03003810 -0.00880610  0.00000000  0.00000000  0.00000000
  0.32805400 -0.14521790  0.05972710 -0.01758670  0.00000000  0.00000000  0.00000000
  0.32383340 -0.20384410  0.08846960 -0.02620740  0.00000000  0.00000000  0.00000000
  0.13523370 -0.07887110  0.03639200 -0.01099640  0.00000000  0.00000000  0.00000000
  0.01170750  0.38458250 -0.22353290  0.06956970  0.00000000  0.00000000  0.00000000
 -0.00034360  0.58652700 -0.51224620  0.16839470  0.00000000  0.00000000  0.00000000
  0.00016650  0.19735910 -0.10842240  0.03461600  0.00000000  0.00000000  0.00000000
 -0.00011880  0.01001020  0.69363720 -0.29787020  0.00000000  0.00000000  0.00000000
  0.00002040  0.00131600  0.55587110 -0.43225690  0.00000000  0.00000000  0.00000000
 -0.00001170 -0.00021010  0.04098060  0.26316110  1.00000000  0.00000000  0.00000000
  0.00000830  0.00011090 -0.01138320  0.67572170  0.00000000  0.00000000  0.00000000
 -0.00000190 -0.00003800  0.00242560  0.29564950  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -460.86751 -60.66916  -8.93244  -0.83750
* P-type functions
   14    6
        8004.30000000
        1896.90000000
         614.71000000
         233.50000000
          97.85600000
          43.51400000
          20.06300000
           9.11270000
           4.10630000
           1.79490000
           0.62432000
           0.24615000
           0.08891700
           0.03025100
  0.00045050 -0.00017830  0.00004300  0.00000000  0.00000000  0.00000000
  0.00390490 -0.00155540  0.00037700  0.00000000  0.00000000  0.00000000
  0.02109010 -0.00847270  0.00204650  0.00000000  0.00000000  0.00000000
  0.08129200 -0.03362450  0.00818990  0.00000000  0.00000000  0.00000000
  0.22178410 -0.09582670  0.02333560  0.00000000  0.00000000  0.00000000
  0.39072700 -0.18139070  0.04498130  0.00000000  0.00000000  0.00000000
  0.35597140 -0.15031520  0.03574750  0.00000000  0.00000000  0.00000000
  0.10732720  0.19482630 -0.05868660  0.00000000  0.00000000  0.00000000
  0.00369850  0.54155540 -0.17095730  0.00000000  0.00000000  0.00000000
  0.00180320  0.38372990 -0.12935830  0.00000000  0.00000000  0.00000000
 -0.00045010  0.04442320  0.26470630  1.00000000  0.00000000  0.00000000
  0.00022080 -0.00501320  0.57780690  0.00000000  0.00000000  0.00000000
 -0.00007220  0.00168790  0.32755080  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -54.26928  -6.66187  -0.40299
* D-type functions
   10    4
         361.85000000
         108.55000000
          41.43300000
          17.57900000
           7.86270000
           3.51800000
           1.53480000
           0.60813000
           0.22200000
           0.08370000
  0.00156550  0.00000000  0.00000000  0.00000000
  0.01332620  0.00000000  0.00000000  0.00000000
  0.06015270  0.00000000  0.00000000  0.00000000
  0.17402930  0.00000000  0.00000000  0.00000000
  0.31956900  0.00000000  0.00000000  0.00000000
  0.38120290  0.00000000  0.00000000  0.00000000
  0.27460860  0.00000000  0.00000000  0.00000000
  0.07825510  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -2.64972
* F-type functions
    2    2
           0.46200000
           0.18800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Br.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
BROMINE      (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         35.   3
* S-type functions
   21    7
    10639000.00000000
     1593400.00000000
      362610.00000000
      102700.00000000
       33501.00000000
       12093.00000000
        4715.90000000
        1955.60000000
         852.61000000
         387.67000000
         182.68000000
          88.24500000
          39.26300000
          19.23400000
           9.40570000
           4.16010000
           1.89950000
           0.60472000
           0.30114000
           0.12515000
           0.04559300
  0.00000590 -0.00000190  0.00000070 -0.00000020  0.00000000  0.00000000  0.00000000
  0.00004610 -0.00001450  0.00000570 -0.00000180  0.00000000  0.00000000  0.00000000
  0.00024220 -0.00007610  0.00003030 -0.00000930  0.00000000  0.00000000  0.00000000
  0.00102260 -0.00032100  0.00012750 -0.00003910  0.00000000  0.00000000  0.00000000
  0.00371130 -0.00117090  0.00046590 -0.00014280  0.00000000  0.00000000  0.00000000
  0.01197850 -0.00379680  0.00150960 -0.00046280  0.00000000  0.00000000  0.00000000
  0.03469270 -0.01123070  0.00448520 -0.00137500  0.00000000  0.00000000  0.00000000
  0.08912390 -0.02992770  0.01198350 -0.00367840  0.00000000  0.00000000  0.00000000
  0.19345570 -0.07127060  0.02895710 -0.00889810  0.00000000  0.00000000  0.00000000
  0.32090190 -0.14031360  0.05815660 -0.01795290  0.00000000  0.00000000  0.00000000
  0.32992330 -0.20307630  0.08881330 -0.02757320  0.00000000  0.00000000  0.00000000
  0.14941210 -0.09609850  0.04452440 -0.01409530  0.00000000  0.00000000  0.00000000
  0.01499380  0.35580860 -0.20603870  0.06725610  0.00000000  0.00000000  0.00000000
 -0.00091650  0.59217920 -0.51270170  0.17669280  0.00000000  0.00000000  0.00000000
  0.00043800  0.22159770 -0.15093490  0.05288610  0.00000000  0.00000000  0.00000000
 -0.00023980  0.01376480  0.67892030 -0.30759550  0.00000000  0.00000000  0.00000000
  0.00007360  0.00083950  0.58176970 -0.47006580  0.00000000  0.00000000  0.00000000
 -0.00003670 -0.00004510  0.04675550  0.25587610  1.00000000  0.00000000  0.00000000
  0.00002390 -0.00000850 -0.01118250  0.69803410  0.00000000  0.00000000  0.00000000
 -0.00000560 -0.00001240  0.00244020  0.29672560  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -490.05997 -65.20008  -9.87188  -0.99263
* P-type functions
   14    6
        8676.50000000
        2055.90000000
         666.23000000
         253.10000000
         106.12000000
          47.24200000
          21.82500000
           9.96840000
           4.51710000
           1.99820000
           0.70988000
           0.28145000
           0.10204000
           0.03514200
  0.00043570 -0.00017480  0.00004510  0.00000000  0.00000000  0.00000000
  0.00378150 -0.00152630  0.00039640  0.00000000  0.00000000  0.00000000
  0.02047820 -0.00833990  0.00215550  0.00000000  0.00000000  0.00000000
  0.07928340 -0.03322030  0.00867200  0.00000000  0.00000000  0.00000000
  0.21784730 -0.09541800  0.02486800  0.00000000  0.00000000  0.00000000
  0.38785850 -0.18240260  0.04854720  0.00000000  0.00000000  0.00000000
  0.35943500 -0.15583080  0.03961560  0.00000000  0.00000000  0.00000000
  0.11219950  0.18678990 -0.06057490  0.00000000  0.00000000  0.00000000
  0.00438740  0.54277330 -0.18716990  0.00000000  0.00000000  0.00000000
  0.00178090  0.38733090 -0.13777570  0.00000000  0.00000000  0.00000000
 -0.00045760  0.04530690  0.29280210  1.00000000  0.00000000  0.00000000
  0.00021220 -0.00437840  0.57608960  0.00000000  0.00000000  0.00000000
 -0.00007340  0.00181110  0.30786170  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -58.55431  -7.47821  -0.45703
* D-type functions
   10    4
         403.83000000
         121.17000000
          46.34500000
          19.72100000
           8.86240000
           3.99620000
           1.76360000
           0.70619000
           0.26390000
           0.10470000
  0.00147320  0.00000000  0.00000000  0.00000000
  0.01267250  0.00000000  0.00000000  0.00000000
  0.05804510  0.00000000  0.00000000  0.00000000
  0.17051030  0.00000000  0.00000000  0.00000000
  0.31859580  0.00000000  0.00000000  0.00000000
  0.38450230  0.00000000  0.00000000  0.00000000
  0.27377370  0.00000000  0.00000000  0.00000000
  0.07439670  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -3.22020
* F-type functions
    2    2
           0.55150000
           0.25800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
/Kr.aug-cc-pVTZ.Woon.21s14p10d2f.7s6p4d2f..
Ref: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
KRYPTON      (20s,13p,9d,1f) -> [6s,5p,3d,1f], Diffuse (1s,1p,1d,1f)
Options
OrbitalEnergies
EndOptions
         36.   3
* S-type functions
   21    7
    11718113.00000000
     1754604.40000000
      399281.32000000
      113084.57000000
       36885.92500000
       13312.20900000
        5189.98830000
        2151.65970000
         938.03251000
         426.55732000
         201.06660000
          97.09760500
          42.99872400
          21.17707500
          10.42675200
           4.58500800
           2.11760300
           0.70705700
           0.34922500
           0.14482100
           0.05198500
  0.00000560 -0.00000180  0.00000070 -0.00000020  0.00000000  0.00000000  0.00000000
  0.00004380 -0.00001380  0.00000550 -0.00000180  0.00000000  0.00000000  0.00000000
  0.00023050 -0.00007260  0.00002920 -0.00000930  0.00000000  0.00000000  0.00000000
  0.00097330 -0.00030630  0.00012280 -0.00003910  0.00000000  0.00000000  0.00000000
  0.00353370 -0.00111770  0.00044910 -0.00014300  0.00000000  0.00000000  0.00000000
  0.01141670 -0.00362700  0.00145570 -0.00046390  0.00000000  0.00000000  0.00000000
  0.03313250 -0.01074320  0.00433190 -0.00138010  0.00000000  0.00000000  0.00000000
  0.08544640 -0.02869920  0.01159650 -0.00370010  0.00000000  0.00000000  0.00000000
  0.18691240 -0.06866790  0.02815850 -0.00899210  0.00000000  0.00000000  0.00000000
  0.31497610 -0.13651550  0.05703390 -0.01830210  0.00000000  0.00000000  0.00000000
  0.33433340 -0.20224580  0.08913560 -0.02875590  0.00000000  0.00000000  0.00000000
  0.16088100 -0.10905690  0.05084210 -0.01673240  0.00000000  0.00000000  0.00000000
  0.01784350  0.33187680 -0.19210300  0.06524100  0.00000000  0.00000000  0.00000000
 -0.00137930  0.59482500 -0.51210400  0.18344220  0.00000000  0.00000000  0.00000000
  0.00065720  0.24248250 -0.18570070  0.06921830  0.00000000  0.00000000  0.00000000
 -0.00033880  0.01722410  0.66541190 -0.31560340  0.00000000  0.00000000  0.00000000
  0.00012110  0.00036850  0.60239250 -0.50315010  0.00000000  0.00000000  0.00000000
 -0.00005890  0.00011040  0.05217070  0.24900720  1.00000000  0.00000000  0.00000000
  0.00003660 -0.00011530 -0.01064530  0.71715710  0.00000000  0.00000000  0.00000000
 -0.00000860  0.00000900  0.00242260  0.29874560  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 4
 -520.16529 -69.90320 -10.84949  -1.15288
* P-type functions
   14    6
        9366.30900000
        2219.55430000
         719.45288000
         273.46446000
         114.75225000
          51.15556900
          23.68267600
          10.87548400
           4.95513100
           2.21726700
           0.80641000
           0.32215400
           0.11761900
           0.04003300
  0.00042310 -0.00017200  0.00004660  0.00000000  0.00000000  0.00000000
  0.00367430 -0.00150250  0.00041000  0.00000000  0.00000000  0.00000000
  0.01993120 -0.00822690  0.00223280  0.00000000  0.00000000  0.00000000
  0.07742220 -0.03285660  0.00901440  0.00000000  0.00000000  0.00000000
  0.21403860 -0.09501350  0.02601150  0.00000000  0.00000000  0.00000000
  0.38485560 -0.18331060  0.05133400  0.00000000  0.00000000  0.00000000
  0.36263400 -0.16121610  0.04309290  0.00000000  0.00000000  0.00000000
  0.11708180  0.17876440 -0.06150400  0.00000000  0.00000000  0.00000000
  0.00512100  0.54378850 -0.20034240  0.00000000  0.00000000  0.00000000
  0.00175390  0.39133870 -0.14573640  0.00000000  0.00000000  0.00000000
 -0.00045730  0.04625700  0.31121610  1.00000000  0.00000000  0.00000000
  0.00021990 -0.00478000  0.57645810  0.00000000  0.00000000  0.00000000
 -0.00006680  0.00139230  0.29393910  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
 3
 -63.00992  -8.33152  -0.52412
* D-type functions
   10    4
         446.16133000
         133.96477000
          51.34590700
          21.91690600
           9.89372500
           4.49252700
           2.00229300
           0.80840900
           0.30060000
           0.12570000
  0.00140440  0.00000000  0.00000000  0.00000000
  0.01217150  0.00000000  0.00000000  0.00000000
  0.05639190  0.00000000  0.00000000  0.00000000
  0.16764300  0.00000000  0.00000000  0.00000000
  0.31773680  0.00000000  0.00000000  0.00000000
  0.38726470  0.00000000  0.00000000  0.00000000
  0.27280060  0.00000000  0.00000000  0.00000000
  0.07120840  1.00000000  0.00000000  0.00000000
  0.00000000  0.00000000  1.00000000  0.00000000
  0.00000000  0.00000000  0.00000000  1.00000000
 1
 -3.82526
* F-type functions
    2    2
           0.66220000
           0.32800000
  1.00000000  0.00000000
  0.00000000  1.00000000
 0
