Iodine (V, 4p frozen)
 
BASIS
1S   34.200
2S   23.550
3S   10.450
4S    7.400
2P   24.100
3P   11.700
4P    6.600
3D   13.400

5S    3.800
5S    2.500
5S    1.690
5P    3.100
5P    1.900
5P    1.190
4D    6.800
4D    4.350
4D    2.850
5D    1.900
4F    2.000
END
 
CORE    4  3  1  0
        1S  381.000
        1S   95.600
        1S   53.900
        2S   61.350
        2S   23.200
        3S   12.250
        3S    8.500
        4S    8.550
        4S    5.450
        5S    3.800
        5S    2.500
        5S    1.690
        2P   35.200
        2P   22.300
        3P   13.200
        3P    9.900
        4P    7.000
        4P    4.600
        5P    3.100
        5P    1.900
        5P    1.190
        3D   21.700
        3D   13.150
        3D    9.000
        4D    6.800
        4D    4.350
        4D    2.850
END
 
DESCRIPTION
    .10862135295578343244E-01   .85420997577325796790E-01
    .93239950831159845723E+00  -.14099026477701184779E-01
    .12075224848296462008E-02  -.35800969913538645099E-02
    .71159299618631663767E-02  -.50161845596488723042E-02
    .99223953749937249605E-03  -.43432608295143604587E-03
    .24523173121627410507E-03  -.83754677556093992609E-04
   -.31132462954132698700E-02  -.92929074286319413023E-01
   -.15930251735800676771E+00  -.20436905574662314611E+00
    .11175593410388247051E+01   .84937127867954539256E-02
   -.18980394858493194327E-01   .15769992243801850273E-01
   -.44842530772231390182E-02   .22941099974477172085E-02
   -.13826453168756993456E-02   .48713574343775176666E-03
    .96042233393882608244E-03   .88593282892899027914E-01
   -.34368571253722640657E-01   .19003316106647064054E+00
   -.67489815400273456270E+00   .93333821935462712993E+00
    .49797662574692408421E+00  -.34248344198452224107E+00
    .82999544109666936742E-01  -.40782742440008963591E-01
    .24382215451568201720E-01  -.85948482296648084228E-02
   -.40581973569302817045E-03  -.45849327846305548695E-01
    .26537836079577131754E-01  -.98297991983352914214E-01
    .33172916912479666340E+00  -.26455998534314539850E+00
   -.12590568388993286231E+01   .15034625470415432513E+01
    .53949466023456937869E+00   .26388749855696849722E-01
   -.16512314328048324774E-01   .65364023932163624331E-02

    .22668191390731179391E+00   .79427265286898729446E+00
    .41664650207575834248E-02  -.52160991093478225461E-02
    .40933211922137158895E-02  -.27819738354046439840E-02
    .13206731635743533537E-02  -.72745078053979591974E-03
    .26468806156624652371E-03
   -.77711751541994805725E-01  -.45306919224120378864E+00
    .72951391275932142566E+00   .43185602570714304305E+00
   -.11703267115547037053E-01   .68794188622714521480E-02
   -.30679892375494442237E-02   .16722580318600484880E-02
   -.60878998080583128852E-03
    .29947477573155190100E-01   .21682627973776655295E+00
   -.38913037577608833306E+00  -.30397519183980797886E+00
    .82528759970235665566E+00   .40412214455173595118E+00
    .17360924180495709325E-02  -.10197789587495997236E-02
    .56901068958714292375E-03

    .12207218677097519954E+00   .58177811545417124073E+00
    .35437577761902711027E+00  -.22126459730724963408E-02
    .94004702662284190477E-03  -.17594810756792157377E-03

0/
END
 
FIT
 1S  68.40
 1S  42.34
 2S  48.46
 2S  33.44
 3S  33.84
 3S  24.74
 4S  23.89
 4S  18.13
 5S  17.12
 5S  13.34
 6S  12.44
 6S   9.89
 7S   9.16
 7S   7.40
 8S   6.83
 8S   5.59
 8S   4.57
 9S   4.21
 9S   3.48
 9S   2.88
 9S   2.38
 2P  58.30
 3P  48.94
 4P  40.30
 5P  33.03
 5P  22.50
 6P  18.45
 6P  12.96
 7P  10.66
 7P   7.67
 8P   6.33
 8P   4.65
 9P   3.86
 9P   2.88
 3D  48.20
 4D  36.89
 5D  28.33
 6D  21.89
 6D  14.53
 7D  11.31
 7D   7.72
 8D   6.05
 8D   4.23
 9D   3.34
 9D   2.38
 4F  37.50
 5F  25.80
 6F  18.04
 7F  12.80
 7F   7.99
 8F   5.75
 8F   3.69
 5G  26.80
 6G  15.65
 7G   9.40
 8G   5.78
 8G   3.19
END
 
FITCOEFFICIENTS
   .194704288064311811E+03  -.140253036574022900E+03  -.548897638157213987E+04
   .676618105264418045E+04  -.115912674418167517E+05  -.428079315019286150E+05
   .336994076351135038E+06   .316277744863363041E+05  -.204200563599264045E+06
  -.503946219866789943E+04   .331733925398047359E+05   .725085152712185482E+04
   .438895594502035749E+03   .373800174374411085E+03  -.321111863100633954E+02
   .207058457362879089E+02   .167972725565984282E+01   .218164909270802454E+00
   .192262820490722436E-01   .429876808434655254E-03   .134038057600195047E-04
/
END