Copper (II, 2p frozen)
 
BASIS
1S  22.25
2S  10.40
2P  12.25

3S   4.05
3S   6.45
3P   3.55
3P   6.00
3D   1.28
3D   3.10
3D   6.90
4S   1.00
4S   1.90
4P   1.37
END
 
CORE    2  1  0  0
1S  34.8000
1S  27.0000
2S  11.3500
2S   6.6000
3S   6.7000
3S   4.0500
4S   0.8600
4S   1.4000
4S   2.4000
2P  16.0500
2P  10.4500
3P   6.0000
3P   3.5000
END
 
DESCRIPTION
    .32719495826575639708E+00   .67160552365945680453E+00
    .50130506692236058430E-01  -.93712530478825287195E-01
    .69994820503186144789E-01  -.14651884502090619516E-01
    .11936617251035593849E-02  -.31034577342938175944E-02
    .50925973127004938931E-02
    .90169200906398488948E-01  -.48342182793878019087E+00
    .10792879550353280393E+01   .48373742422133825247E-01
   -.48312078627883649207E-01   .18301479218742228161E-01
   -.20130410123787383612E-02   .51011860052754638348E-02
   -.78608815077525207027E-02
    .37066114226633273265E+00   .65363014570697741679E+00
    .40532148053367177479E-02  -.17765113873764698093E-02

0/
END
 
FIT
 1S  44.50
 2S  41.65
 3S  36.04
 4S  30.46
 4S  20.41
 5S  17.12
 5S  11.92
 6S   9.99
 6S   7.16
 6S   5.13
 7S   4.30
 7S   3.16
 7S   2.32
 7S   1.70
 2P  34.50
 3P  21.61
 4P  13.83
 5P   9.05
 6P   6.05
 6P   3.48
 7P   2.37
 3D  29.15
 4D  17.99
 5D  11.40
 6D   7.39
 6D   4.14
 7D   2.74
 4F  19.15
 5F  10.35
 5F   4.72
 6F   2.65
 5G  12.00
 5G   5.93
 5G   2.93
END
 
FITCOEFFICIENTS
   .213102581302042523E+03  -.280769742123459946E+04   .993165084499551085E+04
   .507888331763263617E+06  -.270122311911671168E+05  -.100925870199376339E+06
   .367968554554439252E+05   .549322506312167479E+04   .551167239133089083E+03
  -.122244944693502844E+01   .201477383800942622E+01  -.141229057464251125E-01
   .359314200472316946E-02  -.447943595458557330E-04   .000000000000000000E+00
/
END