Astatine (QZ, all electron, 23S 19P 12D 7F)
 
BASIS
        1S 11250.00
        1S 2520.000
        1S  800.000
        1S  305.000
        1S  142.000
        1S   94.200
        2S   82.100
        2S   47.250
        2S   39.600
        3S   34.000
        3S   25.400
        3S   20.450
        4S   20.200
        4S   13.850
        4S   10.750
        5S    8.550
        5S    6.350
        5S    4.850
        6S    4.350
        6S    3.250
        6S    2.350
        6S    1.750
6S    1.000
        2P 2520.000
        2P  660.000
        2P  210.000
        2P   88.150
        2P   48.600
        2P   37.450
        3P   41.600
        3P   24.000
        3P   18.950
        4P   18.850
        4P   12.650
        4P    9.600
        5P    7.700
        5P    5.550
        5P    4.100
        6P    3.450
        6P    2.400
        6P    1.650
        6P    1.120
        3D   76.400
        3D   34.650
        3D   23.100
        3D   17.400
        4D   16.650
        4D   11.250
        4D    8.150
        5D    6.600
        5D    4.650
        5D    3.250
        5D    2.350
6D     1.500
        4F   25.150
        4F   15.150
        4F    9.350
        4F    6.000
5F     4.000
5F     2.000
5F     1.000
END
 
CORE    0  0  0  0
END
 
DESCRIPTION

0/
END
 
FIT
 1S  22500.000
 1S  17119.990
 1S  13026.403
 1S   9911.639
 1S   7541.652
 1S   5738.356
 1S   4366.249
 1S   3322.228
 1S   2527.845
 1S   1923.408
 1S   1463.499
 1S   1113.559
 1S    847.294
 1S    644.697
 1S    490.542
 1S    373.248
 1S    284.000
 1S    181.916
 2S    215.286
 2S    152.551
 3S    158.263
 3S    118.313
 3S     88.448
 4S     87.246
 4S     67.509
 4S     52.237
 5S     50.263
 5S     39.859
 5S     31.608
 6S     29.996
 6S     24.234
 6S     19.579
 7S     18.427
 7S     15.109
 7S     12.388
 8S     11.600
 8S      9.626
 8S      7.988
 8S      6.629
 9S      6.187
 9S      5.187
 9S      4.348
 9S      3.645
 9S      3.056
 9S      2.561
 9S      2.147
 9S      1.800
 2P    190.600
 2P    122.052
 3P    115.082
 4P    104.672
 4P     75.129
 5P     67.272
 5P     49.845
 6P     44.308
 6P     33.631
 7P     29.798
 7P     23.053
 8P     20.403
 8P     16.033
 8P     12.599
 9P     11.151
 9P      8.878
 9P      7.068
 9P      5.627
 9P      4.480
 9P      3.567
 9P      2.840
 9P      2.261
 9P      1.800
 3D    165.100
 3D    105.884
 4D     90.348
 5D     76.432
 6D     64.518
 6D     46.600
 7D     39.362
 7D     29.079
 8D     24.611
 8D     18.520
 8D     13.936
 9D     11.826
 9D      9.037
 9D      6.906
 9D      5.278
 9D      4.033
 9D      3.082
 9D      2.355
 9D      1.800
 4F    157.150
 5F    124.594
 6F     99.138
 6F     67.646
 7F     54.101
 7F     37.908
 8F     30.487
 8F     21.830
 8F     15.632
 9F     12.642
 9F      9.218
 9F      6.721
 9F      4.901
 9F      3.574
 9F      2.606
 9F      1.900
 5G     63.750
 6G     47.280
 6G     30.145
 7G     22.590
 7G     14.861
 8G     11.247
 8G      7.590
 9G      5.797
 9G      3.997
 9G      2.756
 9G      1.900
END
 
FITCOEFFICIENTS
/
END