File: cc-pVDZ

package info (click to toggle)
ergo 3.5-1
  • links: PTS, VCS
  • area: main
  • in suites: buster, stretch
  • size: 17,044 kB
  • ctags: 6,813
  • sloc: cpp: 91,488; ansic: 15,728; sh: 6,416; makefile: 1,287; yacc: 123; lex: 108
file content (1317 lines) | stat: -rwxr-xr-x 123,824 bytes parent folder | download | duplicates (2)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
557
558
559
560
561
562
563
564
565
566
567
568
569
570
571
572
573
574
575
576
577
578
579
580
581
582
583
584
585
586
587
588
589
590
591
592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
620
621
622
623
624
625
626
627
628
629
630
631
632
633
634
635
636
637
638
639
640
641
642
643
644
645
646
647
648
649
650
651
652
653
654
655
656
657
658
659
660
661
662
663
664
665
666
667
668
669
670
671
672
673
674
675
676
677
678
679
680
681
682
683
684
685
686
687
688
689
690
691
692
693
694
695
696
697
698
699
700
701
702
703
704
705
706
707
708
709
710
711
712
713
714
715
716
717
718
719
720
721
722
723
724
725
726
727
728
729
730
731
732
733
734
735
736
737
738
739
740
741
742
743
744
745
746
747
748
749
750
751
752
753
754
755
756
757
758
759
760
761
762
763
764
765
766
767
768
769
770
771
772
773
774
775
776
777
778
779
780
781
782
783
784
785
786
787
788
789
790
791
792
793
794
795
796
797
798
799
800
801
802
803
804
805
806
807
808
809
810
811
812
813
814
815
816
817
818
819
820
821
822
823
824
825
826
827
828
829
830
831
832
833
834
835
836
837
838
839
840
841
842
843
844
845
846
847
848
849
850
851
852
853
854
855
856
857
858
859
860
861
862
863
864
865
866
867
868
869
870
871
872
873
874
875
876
877
878
879
880
881
882
883
884
885
886
887
888
889
890
891
892
893
894
895
896
897
898
899
900
901
902
903
904
905
906
907
908
909
910
911
912
913
914
915
916
917
918
919
920
921
922
923
924
925
926
927
928
929
930
931
932
933
934
935
936
937
938
939
940
941
942
943
944
945
946
947
948
949
950
951
952
953
954
955
956
957
958
959
960
961
962
963
964
965
966
967
968
969
970
971
972
973
974
975
976
977
978
979
980
981
982
983
984
985
986
987
988
989
990
991
992
993
994
995
996
997
998
999
1000
1001
1002
1003
1004
1005
1006
1007
1008
1009
1010
1011
1012
1013
1014
1015
1016
1017
1018
1019
1020
1021
1022
1023
1024
1025
1026
1027
1028
1029
1030
1031
1032
1033
1034
1035
1036
1037
1038
1039
1040
1041
1042
1043
1044
1045
1046
1047
1048
1049
1050
1051
1052
1053
1054
1055
1056
1057
1058
1059
1060
1061
1062
1063
1064
1065
1066
1067
1068
1069
1070
1071
1072
1073
1074
1075
1076
1077
1078
1079
1080
1081
1082
1083
1084
1085
1086
1087
1088
1089
1090
1091
1092
1093
1094
1095
1096
1097
1098
1099
1100
1101
1102
1103
1104
1105
1106
1107
1108
1109
1110
1111
1112
1113
1114
1115
1116
1117
1118
1119
1120
1121
1122
1123
1124
1125
1126
1127
1128
1129
1130
1131
1132
1133
1134
1135
1136
1137
1138
1139
1140
1141
1142
1143
1144
1145
1146
1147
1148
1149
1150
1151
1152
1153
1154
1155
1156
1157
1158
1159
1160
1161
1162
1163
1164
1165
1166
1167
1168
1169
1170
1171
1172
1173
1174
1175
1176
1177
1178
1179
1180
1181
1182
1183
1184
1185
1186
1187
1188
1189
1190
1191
1192
1193
1194
1195
1196
1197
1198
1199
1200
1201
1202
1203
1204
1205
1206
1207
1208
1209
1210
1211
1212
1213
1214
1215
1216
1217
1218
1219
1220
1221
1222
1223
1224
1225
1226
1227
1228
1229
1230
1231
1232
1233
1234
1235
1236
1237
1238
1239
1240
1241
1242
1243
1244
1245
1246
1247
1248
1249
1250
1251
1252
1253
1254
1255
1256
1257
1258
1259
1260
1261
1262
1263
1264
1265
1266
1267
1268
1269
1270
1271
1272
1273
1274
1275
1276
1277
1278
1279
1280
1281
1282
1283
1284
1285
1286
1287
1288
1289
1290
1291
1292
1293
1294
1295
1296
1297
1298
1299
1300
1301
1302
1303
1304
1305
1306
1307
1308
1309
1310
1311
1312
1313
1314
1315
1316
1317
$  cc-pVDZ  EMSL  Basis Set Exchange Library   11/10/15 12:33 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 - 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).
$ Sc - Zn: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005),
$ N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 125, 074110 (2006)
$ Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
$ 




$ HYDROGEN       (4s,1p) -> [2s,1p]
$ HYDROGEN       (4s,1p) -> [2s,1p]
a 1
$ S-TYPE FUNCTIONS
    4    2    0
     13.0100000              0.0196850              0.0000000        
      1.9620000              0.1379770              0.0000000        
      0.4446000              0.4781480              0.0000000        
      0.1220000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    1    1    0
      0.7270000              1.0000000        
$ HELIUM       (4s,1p) -> [2s,1p]
$ HELIUM       (4s,1p) -> [2s,1p]
a 2
$ S-TYPE FUNCTIONS
    4    2    0
     38.3600000              0.0238090              0.0000000        
      5.7700000              0.1548910              0.0000000        
      1.2400000              0.4699870              0.0000000        
      0.2976000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    1    1    0
      1.2750000              1.0000000        
$ LITHIUM       (9s,4p,1d) -> [3s,2p,1d]
$ LITHIUM       (9s,4p,1d) -> [3s,2p,1d]
a 3
$ S-TYPE FUNCTIONS
    9    3    0
   1469.0000000              0.0007660             -0.0001200              0.0000000        
    220.5000000              0.0058920             -0.0009230              0.0000000        
     50.2600000              0.0296710             -0.0046890              0.0000000        
     14.2400000              0.1091800             -0.0176820              0.0000000        
      4.5810000              0.2827890             -0.0489020              0.0000000        
      1.5800000              0.4531230             -0.0960090              0.0000000        
      0.5640000              0.2747740             -0.1363800              0.0000000        
      0.0734500              0.0097510              0.5751020              0.0000000        
      0.0280500              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
      1.5340000              0.0227840              0.0000000        
      0.2749000              0.1391070              0.0000000        
      0.0736200              0.5003750              0.0000000        
      0.0240300              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.1239000              1.0000000        
$ BERYLLIUM       (9s,4p,1d) -> [3s,2p,1d]
$ BERYLLIUM       (9s,4p,1d) -> [3s,2p,1d]
a 4
$ S-TYPE FUNCTIONS
    9    3    0
   2940.0000000              0.0006800             -0.0001230              0.0000000        
    441.2000000              0.0052360             -0.0009660              0.0000000        
    100.5000000              0.0266060             -0.0048310              0.0000000        
     28.4300000              0.0999930             -0.0193140              0.0000000        
      9.1690000              0.2697020             -0.0532800              0.0000000        
      3.1960000              0.4514690             -0.1207230              0.0000000        
      1.1590000              0.2950740             -0.1334350              0.0000000        
      0.1811000              0.0125870              0.5307670              0.0000000        
      0.0589000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
      3.6190000              0.0291110              0.0000000        
      0.7110000              0.1693650              0.0000000        
      0.1951000              0.5134580              0.0000000        
      0.0601800              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.2380000              1.0000000        
$ BORON       (9s,4p,1d) -> [3s,2p,1d]
$ BORON       (9s,4p,1d) -> [3s,2p,1d]
a 5
$ S-TYPE FUNCTIONS
    9    3    0
   4570.0000000              0.0006960             -0.0001390              0.0000000        
    685.9000000              0.0053530             -0.0010970              0.0000000        
    156.5000000              0.0271340             -0.0054440              0.0000000        
     44.4700000              0.1013800             -0.0219160              0.0000000        
     14.4800000              0.2720550             -0.0597510              0.0000000        
      5.1310000              0.4484030             -0.1387320              0.0000000        
      1.8980000              0.2901230             -0.1314820              0.0000000        
      0.3329000              0.0143220              0.5395260              0.0000000        
      0.1043000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
      6.0010000              0.0354810              0.0000000        
      1.2410000              0.1980720              0.0000000        
      0.3364000              0.5052300              0.0000000        
      0.0953800              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.3430000              1.0000000        
$ CARBON       (9s,4p,1d) -> [3s,2p,1d]
$ CARBON       (9s,4p,1d) -> [3s,2p,1d]
a 6
$ S-TYPE FUNCTIONS
    9    3    0
   6665.0000000              0.0006920             -0.0001460              0.0000000        
   1000.0000000              0.0053290             -0.0011540              0.0000000        
    228.0000000              0.0270770             -0.0057250              0.0000000        
     64.7100000              0.1017180             -0.0233120              0.0000000        
     21.0600000              0.2747400             -0.0639550              0.0000000        
      7.4950000              0.4485640             -0.1499810              0.0000000        
      2.7970000              0.2850740             -0.1272620              0.0000000        
      0.5215000              0.0152040              0.5445290              0.0000000        
      0.1596000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
      9.4390000              0.0381090              0.0000000        
      2.0020000              0.2094800              0.0000000        
      0.5456000              0.5085570              0.0000000        
      0.1517000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.5500000              1.0000000        
$ NITROGEN       (9s,4p,1d) -> [3s,2p,1d]
$ NITROGEN       (9s,4p,1d) -> [3s,2p,1d]
a 7
$ S-TYPE FUNCTIONS
    9    3    0
   9046.0000000              0.0007000             -0.0001530              0.0000000        
   1357.0000000              0.0053890             -0.0012080              0.0000000        
    309.3000000              0.0274060             -0.0059920              0.0000000        
     87.7300000              0.1032070             -0.0245440              0.0000000        
     28.5600000              0.2787230             -0.0674590              0.0000000        
     10.2100000              0.4485400             -0.1580780              0.0000000        
      3.8380000              0.2782380             -0.1218310              0.0000000        
      0.7466000              0.0154400              0.5490030              0.0000000        
      0.2248000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
     13.5500000              0.0399190              0.0000000        
      2.9170000              0.2171690              0.0000000        
      0.7973000              0.5103190              0.0000000        
      0.2185000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.8170000              1.0000000        
$ OXYGEN       (9s,4p,1d) -> [3s,2p,1d]
$ OXYGEN       (9s,4p,1d) -> [3s,2p,1d]
a 8
$ S-TYPE FUNCTIONS
    9    3    0
  11720.0000000              0.0007100             -0.0001600              0.0000000        
   1759.0000000              0.0054700             -0.0012630              0.0000000        
    400.8000000              0.0278370             -0.0062670              0.0000000        
    113.7000000              0.1048000             -0.0257160              0.0000000        
     37.0300000              0.2830620             -0.0709240              0.0000000        
     13.2700000              0.4487190             -0.1654110              0.0000000        
      5.0250000              0.2709520             -0.1169550              0.0000000        
      1.0130000              0.0154580              0.5573680              0.0000000        
      0.3023000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
     17.7000000              0.0430180              0.0000000        
      3.8540000              0.2289130              0.0000000        
      1.0460000              0.5087280              0.0000000        
      0.2753000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      1.1850000              1.0000000        
$ FLUORINE       (9s,4p,1d) -> [3s,2p,1d]
$ FLUORINE       (9s,4p,1d) -> [3s,2p,1d]
a 9
$ S-TYPE FUNCTIONS
    9    3    0
  14710.0000000              0.0007210             -0.0001650              0.0000000        
   2207.0000000              0.0055530             -0.0013080              0.0000000        
    502.8000000              0.0282670             -0.0064950              0.0000000        
    142.6000000              0.1064440             -0.0266910              0.0000000        
     46.4700000              0.2868140             -0.0736900              0.0000000        
     16.7000000              0.4486410             -0.1707760              0.0000000        
      6.3560000              0.2647610             -0.1123270              0.0000000        
      1.3160000              0.0153330              0.5628140              0.0000000        
      0.3897000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
     22.6700000              0.0448780              0.0000000        
      4.9770000              0.2357180              0.0000000        
      1.3470000              0.5085210              0.0000000        
      0.3471000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      1.6400000              1.0000000        
$ NEON       (9s,4p,1d) -> [3s,2p,1d]
$ NEON       (9s,4p,1d) -> [3s,2p,1d]
a 10
$ S-TYPE FUNCTIONS
    9    3    0
  17880.0000000              0.0007380             -0.0001720              0.0000000        
   2683.0000000              0.0056770             -0.0013570              0.0000000        
    611.5000000              0.0288830             -0.0067370              0.0000000        
    173.5000000              0.1085400             -0.0276630              0.0000000        
     56.6400000              0.2909070             -0.0762080              0.0000000        
     20.4200000              0.4483240             -0.1752270              0.0000000        
      7.8100000              0.2580260             -0.1070380              0.0000000        
      1.6530000              0.0150630              0.5670500              0.0000000        
      0.4869000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    4    2    0
     28.3900000              0.0460870              0.0000000        
      6.2700000              0.2401810              0.0000000        
      1.6950000              0.5087440              0.0000000        
      0.4317000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      2.2020000              1.0000000        
$ SODIUM       (12s,8p,1d) -> [4s,3p,1d]
$ SODIUM       (12s,8p,1d) -> [4s,3p,1d]
a 11
$ S-TYPE FUNCTIONS
    12    4    0
  31700.0000000              0.458878D-03          -0.112162D-03           0.170160D-04           0.0000000        
   4755.0000000              0.355070D-02          -0.868512D-03           0.130693D-03           0.0000000        
   1082.0000000              0.182618D-01          -0.451330D-02           0.687784D-03           0.0000000        
    306.4000000              0.716650D-01          -0.181436D-01           0.272359D-02           0.0000000        
     99.5300000              0.212346D+00          -0.580799D-01           0.895529D-02           0.0000000        
     35.4200000              0.416203D+00          -0.137653D+00           0.207832D-01           0.0000000        
     13.3000000              0.373020D+00          -0.193908D+00           0.319380D-01           0.0000000        
      4.3920000              0.625054D-01           0.858009D-01          -0.191368D-01           0.0000000        
      1.6760000             -0.624532D-02           0.604419D+00          -0.102595D+00           0.0000000        
      0.5889000              0.243374D-02           0.441719D+00          -0.198945D+00           0.0000000        
      0.0564000             -0.442381D-03           0.130547D-01           0.655952D+00           0.0000000        
      0.0230700              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    138.1000000              0.579641D-02          -0.581531D-03           0.0000000        
     32.2400000              0.415756D-01          -0.407306D-02           0.0000000        
      9.9850000              0.162873D+00          -0.167937D-01           0.0000000        
      3.4840000              0.359401D+00          -0.353268D-01           0.0000000        
      1.2310000              0.449988D+00          -0.521971D-01           0.0000000        
      0.4177000              0.227507D+00          -0.168359D-01           0.0000000        
      0.0651300              0.808247D-02           0.434613D+00           0.0000000        
      0.0205300              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.0973000              1.0000000        
$ MAGNESIUM       (12s,8p,1d) -> [4s,3p,1d]
$ MAGNESIUM       (12s,8p,1d) -> [4s,3p,1d]
a 12
$ S-TYPE FUNCTIONS
    12    4    0
  47390.0000000              0.346023D-03          -0.877839D-04           0.169628D-04           0.0000000        
   7108.0000000              0.268077D-02          -0.674725D-03           0.129865D-03           0.0000000        
   1618.0000000              0.138367D-01          -0.355603D-02           0.688831D-03           0.0000000        
    458.4000000              0.551767D-01          -0.142154D-01           0.273533D-02           0.0000000        
    149.3000000              0.169660D+00          -0.476748D-01           0.931224D-02           0.0000000        
     53.5900000              0.364703D+00          -0.114892D+00           0.223265D-01           0.0000000        
     20.7000000              0.406856D+00          -0.200676D+00           0.411195D-01           0.0000000        
      8.3840000              0.135089D+00          -0.341224D-01           0.545642D-02           0.0000000        
      2.5420000              0.490884D-02           0.570454D+00          -0.134012D+00           0.0000000        
      0.8787000              0.286460D-03           0.542309D+00          -0.256176D+00           0.0000000        
      0.1077000              0.264590D-04           0.218128D-01           0.605856D+00           0.0000000        
      0.0399900              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    179.9000000              0.538161D-02          -0.865948D-03           0.0000000        
     42.1400000              0.392418D-01          -0.615978D-02           0.0000000        
     13.1300000              0.157445D+00          -0.261519D-01           0.0000000        
      4.6280000              0.358535D+00          -0.570647D-01           0.0000000        
      1.6700000              0.457226D+00          -0.873906D-01           0.0000000        
      0.5857000              0.215918D+00          -0.122990D-01           0.0000000        
      0.1311000              0.664948D-02           0.502085D+00           0.0000000        
      0.0411200              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.1870000              1.0000000        
$ ALUMINUM       (12s,8p,1d) -> [4s,3p,1d]
$ ALUMINUM       (12s,8p,1d) -> [4s,3p,1d]
a 13
$ S-TYPE FUNCTIONS
    12    4    0
  64150.0000000              0.290250D-03          -0.758048D-04           0.175078D-04           0.0000000        
   9617.0000000              0.225064D-02          -0.581791D-03           0.134208D-03           0.0000000        
   2189.0000000              0.116459D-01          -0.308113D-02           0.712442D-03           0.0000000        
    620.5000000              0.467377D-01          -0.123112D-01           0.284330D-02           0.0000000        
    202.7000000              0.146299D+00          -0.419781D-01           0.976842D-02           0.0000000        
     73.1500000              0.330283D+00          -0.103371D+00           0.241850D-01           0.0000000        
     28.5500000              0.415861D+00          -0.196308D+00           0.474993D-01           0.0000000        
     11.7700000              0.189253D+00          -0.830002D-01           0.203621D-01           0.0000000        
      3.3000000              0.115889D-01           0.541040D+00          -0.158788D+00           0.0000000        
      1.1730000             -0.128385D-02           0.578796D+00          -0.311694D+00           0.0000000        
      0.1752000              0.425883D-03           0.288147D-01           0.620147D+00           0.0000000        
      0.0647300              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    258.8000000              0.406847D-02          -0.748053D-03           0.0000000        
     60.8900000              0.306815D-01          -0.545796D-02           0.0000000        
     19.1400000              0.129149D+00          -0.245371D-01           0.0000000        
      6.8810000              0.320831D+00          -0.582138D-01           0.0000000        
      2.5740000              0.453815D+00          -0.983756D-01           0.0000000        
      0.9572000              0.275066D+00          -0.260064D-01           0.0000000        
      0.2099000              0.190807D-01           0.464020D+00           0.0000000        
      0.0598600              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.1890000              1.0000000        
$ SILICON       (12s,8p,1d) -> [4s,3p,1d]
$ SILICON       (12s,8p,1d) -> [4s,3p,1d]
a 14
$ S-TYPE FUNCTIONS
    12    4    0
  78860.0000000              0.270443D-03          -0.723177D-04           0.185113D-04           0.0000000        
  11820.0000000              0.209717D-02          -0.555116D-03           0.142236D-03           0.0000000        
   2692.0000000              0.108506D-01          -0.293805D-02           0.752185D-03           0.0000000        
    763.4000000              0.436754D-01          -0.117687D-01           0.302279D-02           0.0000000        
    249.6000000              0.137653D+00          -0.402907D-01           0.103677D-01           0.0000000        
     90.2800000              0.316644D+00          -0.100609D+00           0.262563D-01           0.0000000        
     35.2900000              0.418581D+00          -0.196528D+00           0.523989D-01           0.0000000        
     14.5100000              0.210212D+00          -0.102382D+00           0.290959D-01           0.0000000        
      4.0530000              0.144952D-01           0.527190D+00          -0.178003D+00           0.0000000        
      1.4820000             -0.203590D-02           0.593251D+00          -0.346874D+00           0.0000000        
      0.2517000              0.624186D-03           0.332652D-01           0.623020D+00           0.0000000        
      0.0924300              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    315.9000000              0.392656D-02          -0.858302D-03           0.0000000        
     74.4200000              0.298811D-01          -0.630328D-02           0.0000000        
     23.4800000              0.127212D+00          -0.288255D-01           0.0000000        
      8.4880000              0.320943D+00          -0.694560D-01           0.0000000        
      3.2170000              0.455429D+00          -0.119493D+00           0.0000000        
      1.2290000              0.268563D+00          -0.199581D-01           0.0000000        
      0.2964000              0.188336D-01           0.510268D+00           0.0000000        
      0.0876800              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.2750000              1.0000000        
$ PHOSPHOROUS       (12s,8p,1d) -> [4s,3p,1d]
$ PHOSPHOROUS       (12s,8p,1d) -> [4s,3p,1d]
a 15
$ S-TYPE FUNCTIONS
    12    4    0
  94840.0000000              0.255509D-03          -0.696939D-04           0.191199D-04           0.0000000        
  14220.0000000              0.198193D-02          -0.535266D-03           0.147223D-03           0.0000000        
   3236.0000000              0.102760D-01          -0.283709D-02           0.777912D-03           0.0000000        
    917.1000000              0.414823D-01          -0.113983D-01           0.314546D-02           0.0000000        
    299.5000000              0.131984D+00          -0.392929D-01           0.108200D-01           0.0000000        
    108.1000000              0.308662D+00          -0.996364D-01           0.279957D-01           0.0000000        
     42.1800000              0.420647D+00          -0.197983D+00           0.563978D-01           0.0000000        
     17.2800000              0.222878D+00          -0.114860D+00           0.358190D-01           0.0000000        
      4.8580000              0.164035D-01           0.518595D+00          -0.193387D+00           0.0000000        
      1.8180000             -0.254255D-02           0.601847D+00          -0.372097D+00           0.0000000        
      0.3372000              0.748050D-03           0.368612D-01           0.624246D+00           0.0000000        
      0.1232000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    370.5000000              0.395005D-02          -0.959832D-03           0.0000000        
     87.3300000              0.302492D-01          -0.711177D-02           0.0000000        
     27.5900000              0.129554D+00          -0.327122D-01           0.0000000        
     10.0000000              0.327594D+00          -0.795784D-01           0.0000000        
      3.8250000              0.456992D+00          -0.135016D+00           0.0000000        
      1.4940000              0.253086D+00          -0.910585D-02           0.0000000        
      0.3921000              0.168798D-01           0.537802D+00           0.0000000        
      0.1186000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.3730000              1.0000000        
$ SULFUR       (12s,8p,1d) -> [4s,3p,1d]
$ SULFUR       (12s,8p,1d) -> [4s,3p,1d]
a 16
$ S-TYPE FUNCTIONS
    12    4    0
 110800.0000000              0.247635D-03          -0.687039D-04           0.199077D-04           0.0000000        
  16610.0000000              0.192026D-02          -0.527681D-03           0.153483D-03           0.0000000        
   3781.0000000              0.996192D-02          -0.279671D-02           0.809503D-03           0.0000000        
   1071.0000000              0.402975D-01          -0.112651D-01           0.328974D-02           0.0000000        
    349.8000000              0.128604D+00          -0.388834D-01           0.112967D-01           0.0000000        
    126.3000000              0.303480D+00          -0.995025D-01           0.296385D-01           0.0000000        
     49.2600000              0.421432D+00          -0.199740D+00           0.599851D-01           0.0000000        
     20.1600000              0.230781D+00          -0.123360D+00           0.413248D-01           0.0000000        
      5.7200000              0.178971D-01           0.513194D+00          -0.207474D+00           0.0000000        
      2.1820000             -0.297516D-02           0.607120D+00          -0.392889D+00           0.0000000        
      0.4327000              0.849522D-03           0.396753D-01           0.632840D+00           0.0000000        
      0.1570000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    399.7000000              0.447541D-02          -0.116251D-02           0.0000000        
     94.1900000              0.341708D-01          -0.865664D-02           0.0000000        
     29.7500000              0.144250D+00          -0.390886D-01           0.0000000        
     10.7700000              0.353928D+00          -0.934625D-01           0.0000000        
      4.1190000              0.459085D+00          -0.147994D+00           0.0000000        
      1.6250000              0.206383D+00           0.301904D-01           0.0000000        
      0.4726000              0.102141D-01           0.561573D+00           0.0000000        
      0.1407000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.4790000              1.0000000        
$ CHLORINE       (12s,8p,1d) -> [4s,3p,1d]
$ CHLORINE       (12s,8p,1d) -> [4s,3p,1d]
a 17
$ S-TYPE FUNCTIONS
    12    4    0
 127900.0000000              0.241153D-03          -0.678922D-04           0.204986D-04           0.0000000        
  19170.0000000              0.187095D-02          -0.521836D-03           0.158298D-03           0.0000000        
   4363.0000000              0.970827D-02          -0.276513D-02           0.833639D-03           0.0000000        
   1236.0000000              0.393153D-01          -0.111537D-01           0.339880D-02           0.0000000        
    403.6000000              0.125932D+00          -0.385919D-01           0.116738D-01           0.0000000        
    145.7000000              0.299341D+00          -0.994848D-01           0.309622D-01           0.0000000        
     56.8100000              0.421886D+00          -0.201392D+00           0.629533D-01           0.0000000        
     23.2300000              0.237201D+00          -0.130313D+00           0.460257D-01           0.0000000        
      6.6440000              0.191531D-01           0.509443D+00          -0.219312D+00           0.0000000        
      2.5750000             -0.334792D-02           0.610725D+00          -0.408773D+00           0.0000000        
      0.5371000              0.929883D-03           0.421549D-01           0.638465D+00           0.0000000        
      0.1938000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    417.6000000              0.525982D-02          -0.143570D-02           0.0000000        
     98.3300000              0.398332D-01          -0.107796D-01           0.0000000        
     31.0400000              0.164655D+00          -0.470075D-01           0.0000000        
     11.1900000              0.387322D+00          -0.111030D+00           0.0000000        
      4.2490000              0.457072D+00          -0.153275D+00           0.0000000        
      1.6240000              0.151636D+00           0.894609D-01           0.0000000        
      0.5322000              0.181615D-02           0.579444D+00           0.0000000        
      0.1620000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.6000000              1.0000000        
$ ARGON       (12s,8p,1d) -> [4s,3p,1d]
$ ARGON       (12s,8p,1d) -> [4s,3p,1d]
a 18
$ S-TYPE FUNCTIONS
    12    4    0
 145700.0000000              0.236700D-03          -0.674910D-04           0.210457D-04           0.0000000        
  21840.0000000              0.183523D-02          -0.518522D-03           0.162565D-03           0.0000000        
   4972.0000000              0.952860D-02          -0.274825D-02           0.855463D-03           0.0000000        
   1408.0000000              0.386283D-01          -0.111007D-01           0.349745D-02           0.0000000        
    459.7000000              0.124081D+00          -0.384820D-01           0.120156D-01           0.0000000        
    165.9000000              0.296471D+00          -0.997599D-01           0.321368D-01           0.0000000        
     64.6900000              0.422068D+00          -0.203088D+00           0.655279D-01           0.0000000        
     26.4400000              0.241711D+00          -0.135608D+00           0.499370D-01           0.0000000        
      7.6280000              0.200509D-01           0.507195D+00          -0.229769D+00           0.0000000        
      2.9960000             -0.361000D-02           0.612898D+00          -0.421006D+00           0.0000000        
      0.6504000              0.975607D-03           0.442968D-01           0.642331D+00           0.0000000        
      0.2337000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    8    3    0
    453.7000000              0.570555D-02          -0.160655D-02           0.0000000        
    106.8000000              0.430460D-01          -0.121714D-01           0.0000000        
     33.7300000              0.176591D+00          -0.520789D-01           0.0000000        
     12.1300000              0.406863D+00          -0.123737D+00           0.0000000        
      4.5940000              0.452549D+00          -0.151619D+00           0.0000000        
      1.6780000              0.122801D+00           0.142425D+00           0.0000000        
      0.5909000             -0.445996D-02           0.584501D+00           0.0000000        
      0.1852000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    1    1    0
      0.7380000              1.0000000        
$ CALCIUM       (14s,11p,5d) -> [5s,4p,2d]
$ CALCIUM       (14s,11p,5d) -> [5s,4p,2d]
a 20
$ S-TYPE FUNCTIONS
    14    5    0
 190000.7000000              0.00022145            -0.00006453             0.00002223             0.00000531             0.0000000        
  28481.4600000              0.00171830            -0.00049662             0.00017170             0.00004111             0.0000000        
   6482.7010000              0.00892348            -0.00262826             0.00090452             0.00021568             0.0000000        
   1835.8910000              0.03630183            -0.01066845             0.00370343             0.00088827             0.0000000        
    598.7243000              0.11762223            -0.03713509             0.01283750             0.00305813             0.0000000        
    215.8841000              0.28604352            -0.09804284             0.03475459             0.00837608             0.0000000        
     84.0124200              0.42260708            -0.20342692             0.07303491             0.01741056             0.0000000        
     34.2248800              0.25774366            -0.15244655             0.06100083             0.01515453             0.0000000        
     10.0249700              0.02391893             0.48279406            -0.24292928            -0.06207919             0.0000000        
      4.0559200             -0.00495218             0.62923839            -0.48708500            -0.12611803             0.0000000        
      1.0202610              0.00171779             0.06164842             0.56502804             0.17360694             0.0000000        
      0.4268650             -0.00089209            -0.01479971             0.65574386             0.37822943             0.0000000        
      0.0633470              0.00024510             0.00361089             0.02672894            -0.65964698             0.0000000        
      0.0263010              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   1072.0430000              0.00198166            -0.00064891             0.00013595             0.0000000        
    253.8439000              0.01612944            -0.00527907             0.00109420             0.0000000        
     81.3162600              0.07657851            -0.02581131             0.00542680             0.0000000        
     30.2418300              0.23269594            -0.08062892             0.01674718             0.0000000        
     12.1011000              0.42445210            -0.15846552             0.03389863             0.0000000        
      5.0225540              0.37326402            -0.12816816             0.02531183             0.0000000        
      1.9092200              0.07868530             0.25610103            -0.05895713             0.0000000        
      0.7713040             -0.00599927             0.58724068            -0.15876120             0.0000000        
      0.3005700              0.00264257             0.30372561            -0.08554523             0.0000000        
      0.0766490             -0.00085694             0.01416451             0.54464665             0.0000000        
      0.0277720              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    5    2    0
     10.3182000              0.03284900             0.0000000        
      2.5924200              0.14819200             0.0000000        
      0.7617000              0.31092100             0.0000000        
      0.2083800              0.45219500             0.0000000        
      0.0537000              0.0000000              1.0000000        
$ SCANDIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ SCANDIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 21
$ S-TYPE FUNCTIONS
    20    6    0
      2.715278E+06           8.147221E-06          -4.722109E-06           9.139905E-07          -2.201951E-07          -3.757238E-07           0.0000000        
      4.065984E+05           6.334788E-05          -3.671829E-05           7.108513E-06          -1.711419E-06          -2.981907E-06           0.0000000        
      9.253004E+04           3.330384E-04          -1.930883E-04           3.738126E-05          -9.008469E-06          -1.522586E-05           0.0000000        
      2.620792E+04           1.404055E-03          -8.146870E-04           1.578828E-04          -3.799997E-05          -6.684686E-05           0.0000000        
      8.549429E+03           5.081725E-03          -2.955526E-03           5.737686E-04          -1.383227E-04          -2.313129E-04           0.0000000        
      3.085975E+03           1.626926E-02          -9.520035E-03           1.859244E-03          -4.473692E-04          -7.959729E-04           0.0000000        
      1.203172E+03           4.624577E-02          -2.746858E-02           5.433182E-03          -1.310691E-03          -2.161961E-03           0.0000000        
      4.984869E+02           1.137223E-01          -6.991528E-02           1.425387E-02          -3.429860E-03          -6.206459E-03           0.0000000        
      2.167360E+02           2.257636E-01          -1.499251E-01           3.246144E-02          -7.847579E-03          -1.261905E-02           0.0000000        
      9.787476E+01           3.106700E-01          -2.459153E-01           6.003454E-02          -1.447189E-02          -2.739459E-02           0.0000000        
      4.520433E+01           2.191906E-01          -2.401293E-01           6.916105E-02          -1.690669E-02          -2.336516E-02           0.0000000        
      2.021187E+01           7.215879E-02           3.567987E-02          -2.113084E-02           5.396115E-03          -5.734627E-03           0.0000000        
      9.574751E+00           1.187030E-01           4.915023E-01          -2.666832E-01           6.671062E-02           1.536025E-01           0.0000000        
      4.540346E+00           1.220532E-01           4.911381E-01          -4.367591E-01           1.178356E-01           1.447100E-01           0.0000000        
      1.995687E+00           2.136795E-02           9.120633E-02           6.498243E-02          -2.738134E-02           9.359699E-02           0.0000000        
      9.422150E-01          -5.357246E-04          -5.356723E-03           7.009599E-01          -2.260149E-01          -8.687730E-01           0.0000000        
      4.178450E-01           2.435774E-04           8.812836E-04           4.515562E-01          -3.073539E-01           2.114597E-02           0.0000000        
      9.576100E-02          -8.796617E-05          -7.605536E-04           3.011910E-02           2.544054E-01           2.275498E+00           0.0000000        
      5.135100E-02           7.878246E-05           6.340116E-04          -1.329480E-02           5.981590E-01          -1.190770E+00           0.0000000        
      2.387800E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.059219E+04           4.500000E-05          -1.500000E-05          -4.000000E-06           4.000000E-06           0.0000000        
      2.507533E+03           4.010000E-04          -1.310000E-04          -3.200000E-05           3.900000E-05           0.0000000        
      8.144571E+02           2.302000E-03          -7.570000E-04          -1.850000E-04           2.210000E-04           0.0000000        
      3.115195E+02           1.003700E-02          -3.318000E-03          -8.080000E-04           9.840000E-04           0.0000000        
      1.319617E+02           3.495400E-02          -1.170600E-02          -2.870000E-03           3.423000E-03           0.0000000        
      5.998718E+01           9.790900E-02          -3.360400E-02          -8.207000E-03           9.993000E-03           0.0000000        
      2.866250E+01           2.106800E-01          -7.487900E-02          -1.847300E-02           2.191600E-02           0.0000000        
      1.410851E+01           3.300930E-01          -1.225480E-01          -3.010100E-02           3.700800E-02           0.0000000        
      7.103706E+00           3.310270E-01          -1.302760E-01          -3.294300E-02           3.779400E-02           0.0000000        
      3.609200E+00           1.579600E-01           1.459600E-02           7.958000E-03          -4.379000E-03           0.0000000        
      1.776070E+00           2.209900E-02           3.091840E-01           8.799300E-02          -1.101640E-01           0.0000000        
      8.547600E-01          -1.605000E-03           4.629980E-01           1.523770E-01          -1.610170E-01           0.0000000        
      4.022390E-01          -1.326000E-03           3.049570E-01           9.717000E-02          -1.824820E-01           0.0000000        
      1.546650E-01          -2.800000E-04           5.087800E-02          -2.569380E-01           3.886110E-01           0.0000000        
      6.494500E-02           3.400000E-05          -4.493000E-03          -5.878150E-01           6.911000E-01           0.0000000        
      2.635900E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      5.051380E+01           4.266000E-03          -4.389000E-03           0.0000000        
      1.474050E+01           2.770800E-02          -2.836300E-02           0.0000000        
      5.195000E+00           1.000010E-01          -1.051370E-01           0.0000000        
      2.028460E+00           2.315810E-01          -2.348540E-01           0.0000000        
      8.040860E-01           3.460330E-01          -3.246090E-01           0.0000000        
      3.076890E-01           3.733740E-01          -6.428900E-02           0.0000000        
      1.113920E-01           2.642880E-01           6.017490E-01           0.0000000        
      3.735200E-02           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      7.126000E-01           3.617450E-01     
      1.636000E-01           8.218680E-01     
$ TITANIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ TITANIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 22
$ S-TYPE FUNCTIONS
    20    6    0
      3.014643E+06           8.060782E-06          -4.630486E-06           9.230559E-07          -2.180323E-07          -3.975126E-07           0.0000000        
      4.514329E+05           6.267518E-05          -3.600451E-05           7.178974E-06          -1.694860E-06          -3.161080E-06           0.0000000        
      1.027338E+05           3.295006E-04          -1.893420E-04           3.775134E-05          -8.919208E-06          -1.609375E-05           0.0000000        
      2.909817E+04           1.389203E-03          -7.988781E-04           1.594532E-04          -3.763633E-05          -7.092947E-05           0.0000000        
      9.492330E+03           5.028469E-03          -2.898698E-03           5.795150E-04          -1.369575E-04          -2.442710E-04           0.0000000        
      3.426346E+03           1.610419E-02          -9.339701E-03           1.878414E-03          -4.432894E-04          -8.457892E-04           0.0000000        
      1.335896E+03           4.581232E-02          -2.697464E-02           5.492747E-03          -1.298868E-03          -2.282208E-03           0.0000000        
      5.535026E+02           1.128613E-01          -6.878913E-02           1.443297E-02          -3.406752E-03          -6.619873E-03           0.0000000        
      2.406925E+02           2.248193E-01          -1.481037E-01           3.296408E-02          -7.810829E-03          -1.335024E-02           0.0000000        
      1.087293E+02           3.114571E-01          -2.445253E-01           6.125493E-02          -1.449245E-02          -2.955830E-02           0.0000000        
      5.026457E+01           2.224995E-01          -2.419916E-01           7.134113E-02          -1.708136E-02          -2.477039E-02           0.0000000        
      2.258004E+01           7.293128E-02           3.183790E-02          -1.973150E-02           4.897666E-03          -8.414624E-03           0.0000000        
      1.071432E+01           1.160683E-01           4.932686E-01          -2.741869E-01           6.753108E-02           1.693855E-01           0.0000000        
      5.093546E+00           1.194774E-01           4.939655E-01          -4.440977E-01           1.173318E-01           1.500787E-01           0.0000000        
      2.244183E+00           2.097868E-02           9.196313E-02           7.776084E-02          -2.985025E-02           9.787777E-02           0.0000000        
      1.059570E+00          -5.091715E-04          -5.316992E-03           7.068444E-01          -2.277634E-01          -9.653608E-01           0.0000000        
      4.688490E-01           2.217859E-04           8.085624E-04           4.413892E-01          -2.928115E-01           1.489721E-01           0.0000000        
      1.061430E-01          -7.636896E-05          -6.918459E-04           2.799769E-02           2.665300E-01           2.191179E+00           0.0000000        
      5.526200E-02           7.719539E-05           6.086512E-04          -1.210790E-02           5.912406E-01          -1.243325E+00           0.0000000        
      2.546500E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.191203E+04           4.400000E-05          -1.500000E-05           4.000000E-06           4.000000E-06           0.0000000        
      2.819947E+03           3.910000E-04          -1.310000E-04           3.100000E-05           3.900000E-05           0.0000000        
      9.159479E+02           2.248000E-03          -7.550000E-04           1.820000E-04           2.230000E-04           0.0000000        
      3.503842E+02           9.823000E-03          -3.319000E-03           7.950000E-04           9.920000E-04           0.0000000        
      1.484825E+02           3.433800E-02          -1.175000E-02           2.833000E-03           3.476000E-03           0.0000000        
      6.753944E+01           9.666600E-02          -3.392200E-02           8.154000E-03           1.017200E-02           0.0000000        
      3.230332E+01           2.094170E-01          -7.616400E-02           1.847200E-02           2.257600E-02           0.0000000        
      1.592786E+01           3.301890E-01          -1.257020E-01           3.040000E-02           3.823800E-02           0.0000000        
      8.038035E+00           3.319360E-01          -1.330980E-01           3.304700E-02           3.933700E-02           0.0000000        
      4.093916E+00           1.584880E-01           1.740600E-02          -8.251000E-03          -6.106000E-03           0.0000000        
      2.022390E+00           2.231000E-02           3.151650E-01          -8.855400E-02          -1.129620E-01           0.0000000        
      9.761020E-01          -1.566000E-03           4.618140E-01          -1.496120E-01          -1.681140E-01           0.0000000        
      4.595950E-01          -1.324000E-03           2.998560E-01          -9.422700E-02          -1.659320E-01           0.0000000        
      1.771520E-01          -2.710000E-04           5.000000E-02           2.508460E-01           3.914030E-01           0.0000000        
      7.351700E-02           3.200000E-05          -4.230000E-03           5.866430E-01           6.818400E-01           0.0000000        
      2.940100E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      6.401300E+01           3.887000E-03          -3.970000E-03           0.0000000        
      1.881790E+01           2.639900E-02          -2.687300E-02           0.0000000        
      6.728700E+00           9.751100E-02          -1.022750E-01           0.0000000        
      2.664130E+00           2.328480E-01          -2.377280E-01           0.0000000        
      1.078680E+00           3.531520E-01          -3.121140E-01           0.0000000        
      4.232090E-01           3.721860E-01          -4.237800E-02           0.0000000        
      1.559990E-01           2.476720E-01           5.886580E-01           0.0000000        
      5.188400E-02           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      1.227400E+00           3.581580E-01     
      2.788000E-01           8.257940E-01     
$ VANADIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ VANADIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 23
$ S-TYPE FUNCTIONS
    20    6    0
      3.321857E+06           8.039999E-06          -4.503003E-06           9.320648E-07          -2.158944E-07          -4.093416E-07           0.0000000        
      4.974356E+05           6.251402E-05          -3.501295E-05           7.249306E-06          -1.678519E-06          -3.258956E-06           0.0000000        
      1.132027E+05           3.286553E-04          -1.841339E-04           3.811967E-05          -8.831213E-06          -1.656390E-05           0.0000000        
      3.206333E+04           1.385697E-03          -7.769216E-04           1.610238E-04          -3.727769E-05          -7.316689E-05           0.0000000        
      1.045962E+04           5.016217E-03          -2.819505E-03           5.852210E-04          -1.356099E-04          -2.512784E-04           0.0000000        
      3.775506E+03           1.606931E-02          -9.087486E-03           1.897502E-03          -4.392351E-04          -8.732657E-04           0.0000000        
      1.472040E+03           4.574242E-02          -2.627134E-02           5.550909E-03          -1.286948E-03          -2.347654E-03           0.0000000        
      6.099331E+02           1.128544E-01          -6.712726E-02           1.460584E-02          -3.382149E-03          -6.853150E-03           0.0000000        
      2.652634E+02           2.254344E-01          -1.451130E-01           3.342974E-02          -7.765646E-03          -1.376420E-02           0.0000000        
      1.198607E+02           3.140461E-01          -2.412483E-01           6.235722E-02          -1.447985E-02          -3.084679E-02           0.0000000        
      5.544891E+01           2.267819E-01          -2.416314E-01           7.312435E-02          -1.715502E-02          -2.562208E-02           0.0000000        
      2.498372E+01           7.334069E-02           3.067362E-02          -1.911472E-02           4.610101E-03          -1.005123E-02           0.0000000        
      1.188056E+01           1.102474E-01           4.970415E-01          -2.817249E-01           6.827831E-02           1.795330E-01           0.0000000        
      5.660311E+00           1.131358E-01           4.958875E-01          -4.488151E-01           1.161368E-01           1.522400E-01           0.0000000        
      2.495703E+00           1.971295E-02           9.181868E-02           9.202696E-02          -3.277049E-02           9.483887E-02           0.0000000        
      1.177866E+00          -4.719088E-04          -5.392514E-03           7.110117E-01          -2.280000E-01          -1.014876E+00           0.0000000        
      5.200440E-01           1.861606E-04           7.102380E-04           4.309274E-01          -2.793991E-01           2.308810E-01           0.0000000        
      1.159650E-01          -6.208598E-05          -6.363128E-04           2.604589E-02           2.771165E-01           2.113321E+00           0.0000000        
      5.893800E-02           7.295314E-05           5.979932E-04          -1.101049E-02           5.852999E-01          -1.253048E+00           0.0000000        
      2.694600E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.327320E+04           4.300000E-05          -1.500000E-05           4.000000E-06           4.000000E-06           0.0000000        
      3.142126E+03           3.840000E-04          -1.310000E-04           3.200000E-05           3.900000E-05           0.0000000        
      1.020588E+03           2.210000E-03          -7.550000E-04           1.830000E-04           2.230000E-04           0.0000000        
      3.904407E+02           9.678000E-03          -3.325000E-03           8.020000E-04           9.960000E-04           0.0000000        
      1.655043E+02           3.393600E-02          -1.181100E-02           2.862000E-03           3.498000E-03           0.0000000        
      7.532006E+01           9.591700E-02          -3.425600E-02           8.287000E-03           1.029600E-02           0.0000000        
      3.605503E+01           2.088530E-01          -7.736300E-02           1.887000E-02           2.296200E-02           0.0000000        
      1.780436E+01           3.306600E-01          -1.284560E-01           3.130700E-02           3.920800E-02           0.0000000        
      9.002929E+00           3.323120E-01          -1.350780E-01           3.366000E-02           3.994300E-02           0.0000000        
      4.594544E+00           1.581880E-01           2.083800E-02          -9.479000E-03          -7.121000E-03           0.0000000        
      2.276760E+00           2.225200E-02           3.204990E-01          -9.231300E-02          -1.162250E-01           0.0000000        
      1.101178E+00          -1.565000E-03           4.602600E-01          -1.489890E-01          -1.694960E-01           0.0000000        
      5.186380E-01          -1.353000E-03           2.953460E-01          -8.364400E-02          -1.553740E-01           0.0000000        
      2.005650E-01          -2.650000E-04           4.904600E-02           2.493390E-01           3.950220E-01           0.0000000        
      8.129100E-02           2.900000E-05          -3.824000E-03           5.805150E-01           6.789080E-01           0.0000000        
      3.179500E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      7.761150E+01           3.595000E-03          -3.818000E-03           0.0000000        
      2.291590E+01           2.521000E-02          -2.671700E-02           0.0000000        
      8.279540E+00           9.478600E-02          -1.036900E-01           0.0000000        
      3.309930E+00           2.303630E-01          -2.476890E-01           0.0000000        
      1.358630E+00           3.528940E-01          -3.115230E-01           0.0000000        
      5.413500E-01           3.704140E-01          -2.282700E-02           0.0000000        
      2.023560E-01           2.457180E-01           5.697260E-01           0.0000000        
      6.756800E-02           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      1.748800E+00           3.900680E-01     
      4.057000E-01           8.008410E-01     
$ CHROMIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ CHROMIUM       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 24
$ S-TYPE FUNCTIONS
    20    6    0
      6.177194E+06           4.128667E-06          -2.301772E-06           4.862957E-07          -1.102451E-07           2.179893E-07           0.0000000        
      9.249295E+05           3.210767E-05          -1.789536E-05           3.776645E-06          -8.530233E-07           1.612940E-06           0.0000000        
      2.104865E+05           1.688416E-04          -9.416174E-05           1.990664E-05          -4.520358E-06           9.111842E-06           0.0000000        
      5.962005E+04           7.128520E-04          -3.975074E-04           8.389164E-05          -1.891612E-05           3.500645E-05           0.0000000        
      1.945076E+04           2.589325E-03          -1.447025E-03           3.065706E-04          -6.974344E-05           1.435315E-04           0.0000000        
      7.022056E+03           8.377350E-03          -4.694622E-03           9.944107E-04          -2.237867E-04           4.035896E-04           0.0000000        
      2.738763E+03           2.441725E-02          -1.382387E-02           2.961959E-03          -6.754503E-04           1.425177E-03           0.0000000        
      1.135814E+03           6.365135E-02          -3.674643E-02           7.969473E-03          -1.789346E-03           3.114009E-03           0.0000000        
      4.950923E+02           1.427618E-01          -8.647185E-02           1.955017E-02          -4.477858E-03           9.814449E-03           0.0000000        
      2.247487E+02           2.541275E-01          -1.696735E-01           4.085035E-02          -9.140144E-03           1.474698E-02           0.0000000        
      1.053836E+02           3.009512E-01          -2.507089E-01           6.929003E-02          -1.610562E-02           3.911512E-02           0.0000000        
      5.019359E+01           1.766513E-01          -1.961156E-01           6.146984E-02          -1.334870E-02           9.170888E-03           0.0000000        
      2.224957E+01           6.936709E-02           1.457244E-01          -6.981302E-02           1.426027E-02           1.559878E-02           0.0000000        
      1.098265E+01           1.179579E-01           5.466706E-01          -3.517597E-01           8.931690E-02          -2.816844E-01           0.0000000        
      5.383665E+00           8.916187E-02           3.979434E-01          -3.828629E-01           8.885279E-02          -6.895261E-03           0.0000000        
      2.343685E+00           1.103630E-02           5.277007E-02           2.676401E-01          -6.368776E-02          -1.769781E-01           0.0000000        
      1.105202E+00          -3.546048E-04          -4.374537E-03           7.175950E-01          -2.783262E-01           1.443061E+00           0.0000000        
      4.878480E-01           1.057311E-04           3.204035E-04           3.020814E-01          -1.830071E-01          -1.029318E+00           0.0000000        
      8.959900E-02           1.114640E-05          -5.142077E-05           7.749514E-03           6.790937E-01          -1.307667E+00           0.0000000        
      3.342300E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.445420E+04           4.400000E-05          -1.500000E-05           4.000000E-06           4.000000E-06           0.0000000        
      3.421676E+03           3.890000E-04          -1.350000E-04           3.200000E-05           4.000000E-05           0.0000000        
      1.111387E+03           2.241000E-03          -7.770000E-04           1.850000E-04           2.290000E-04           0.0000000        
      4.251918E+02           9.821000E-03          -3.427000E-03           8.100000E-04           1.019000E-03           0.0000000        
      1.802623E+02           3.447100E-02          -1.218900E-02           2.906000E-03           3.602000E-03           0.0000000        
      8.206117E+01           9.746000E-02          -3.538800E-02           8.391000E-03           1.055000E-02           0.0000000        
      3.929726E+01           2.119850E-01          -7.991500E-02           1.919300E-02           2.370200E-02           0.0000000        
      1.941959E+01           3.339900E-01          -1.323350E-01           3.156400E-02           3.998800E-02           0.0000000        
      9.828899E+00           3.301370E-01          -1.354010E-01           3.341700E-02           4.043700E-02           0.0000000        
      5.016810E+00           1.522270E-01           3.200800E-02          -1.290700E-02          -1.207400E-02           0.0000000        
      2.487091E+00           2.042500E-02           3.338490E-01          -9.365900E-02          -1.189390E-01           0.0000000        
      1.198780E+00          -1.360000E-03           4.617730E-01          -1.499770E-01          -1.781000E-01           0.0000000        
      5.586950E-01          -1.195000E-03           2.812900E-01          -6.723400E-02          -1.238650E-01           0.0000000        
      2.089240E-01          -1.970000E-04           4.184300E-02           2.707590E-01           4.297220E-01           0.0000000        
      8.460800E-02           2.300000E-05          -4.002000E-03           5.758070E-01           6.507860E-01           0.0000000        
      3.325800E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      8.857680E+01           3.621000E-03          -4.122000E-03           0.0000000        
      2.620450E+01           2.576600E-02          -2.930700E-02           0.0000000        
      9.517470E+00           9.755600E-02          -1.150620E-01           0.0000000        
      3.822480E+00           2.363120E-01          -2.730680E-01           0.0000000        
      1.575120E+00           3.582860E-01          -3.144230E-01           0.0000000        
      6.289280E-01           3.685430E-01           4.209700E-02           0.0000000        
      2.344240E-01           2.354940E-01           5.914030E-01           0.0000000        
      7.681500E-02           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      2.221100E+00           4.235450E-01     
      5.231000E-01           7.741140E-01     
$ MANGANESE       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ MANGANESE       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 25
$ S-TYPE FUNCTIONS
    20    6    0
      3.960805E+06           8.242127E-06          -3.936095E-06           9.462709E-07          -2.095391E-07          -4.121231E-07           0.0000000        
      5.931155E+05           6.408587E-05          -3.060481E-05           7.360584E-06          -1.629439E-06          -3.282099E-06           0.0000000        
      1.349768E+05           3.369253E-04          -1.609626E-04           3.869935E-05          -8.570592E-06          -1.667433E-05           0.0000000        
      3.823067E+04           1.420648E-03          -6.792348E-04           1.635110E-04          -3.619272E-05          -7.369999E-05           0.0000000        
      1.247154E+04           5.143683E-03          -2.466182E-03           5.941775E-04          -1.316146E-04          -2.529495E-04           0.0000000        
      4.501743E+03           1.648569E-02          -7.957629E-03           1.927737E-03          -4.266810E-04          -8.801425E-04           0.0000000        
      1.755212E+03           4.698560E-02          -2.307248E-02           5.641731E-03          -1.250270E-03          -2.365482E-03           0.0000000        
      7.273039E+02           1.162437E-01          -5.932956E-02           1.487848E-02          -3.294665E-03          -6.926354E-03           0.0000000        
      3.163678E+02           2.335277E-01          -1.299451E-01           3.414783E-02          -7.581860E-03          -1.393851E-02           0.0000000        
      1.430098E+02           3.292837E-01          -2.212352E-01           6.405794E-02          -1.422864E-02          -3.143840E-02           0.0000000        
      6.621805E+01           2.440304E-01          -2.292550E-01           7.557659E-02          -1.693796E-02          -2.625749E-02           0.0000000        
      2.991896E+01           7.219806E-02           3.580733E-02          -1.946070E-02           4.454298E-03          -1.048313E-02           0.0000000        
      1.430318E+01           7.687806E-02           5.107602E-01          -2.957874E-01           6.867042E-02           1.856472E-01           0.0000000        
      6.839451E+00           7.852235E-02           5.008307E-01          -4.521170E-01           1.113335E-01           1.524839E-01           0.0000000        
      3.012374E+00           1.294109E-02           9.011830E-02           1.224531E-01          -3.900820E-02           7.411368E-02           0.0000000        
      1.418808E+00          -3.784873E-04          -6.909909E-03           7.169756E-01          -2.215755E-01          -1.018097E+00           0.0000000        
      6.236240E-01          -2.503203E-05          -1.912925E-04           4.092712E-01          -2.544359E-01           2.980372E-01           0.0000000        
      1.340980E-01          -2.421517E-05          -6.032312E-04           2.221969E-02           2.865866E-01           1.971989E+00           0.0000000        
      6.554800E-02           3.462071E-05           5.621608E-04          -9.011202E-03           5.755741E-01          -1.179253E+00           0.0000000        
      2.958400E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.620586E+04           4.200000E-05          -1.500000E-05           3.000000E-06           4.000000E-06           0.0000000        
      3.836274E+03           3.730000E-04          -1.290000E-04           3.000000E-05           4.000000E-05           0.0000000        
      1.246048E+03           2.149000E-03          -7.480000E-04           1.720000E-04           2.260000E-04           0.0000000        
      4.767535E+02           9.445000E-03          -3.308000E-03           7.620000E-04           1.013000E-03           0.0000000        
      2.021895E+02           3.329700E-02          -1.181100E-02           2.726000E-03           3.575000E-03           0.0000000        
      9.209487E+01           9.475900E-02          -3.453300E-02           7.976000E-03           1.061200E-02           0.0000000        
      4.414720E+01           2.081440E-01          -7.878500E-02           1.828700E-02           2.390200E-02           0.0000000        
      2.185468E+01           3.318050E-01          -1.321830E-01           3.077600E-02           4.127900E-02           0.0000000        
      1.108596E+01           3.331750E-01          -1.371950E-01           3.237300E-02           4.147500E-02           0.0000000        
      5.674108E+00           1.576010E-01           2.707500E-02          -9.978000E-03          -9.458000E-03           0.0000000        
      2.823170E+00           2.144500E-02           3.288910E-01          -9.052900E-02          -1.236950E-01           0.0000000        
      1.368621E+00          -2.558000E-03           4.572800E-01          -1.380040E-01          -1.743920E-01           0.0000000        
      6.444310E-01          -2.027000E-03           2.889080E-01          -7.796500E-02          -1.291700E-01           0.0000000        
      2.483820E-01          -3.600000E-04           4.743300E-02           2.295600E-01           4.003480E-01           0.0000000        
      9.725500E-02           3.400000E-05          -3.522000E-03           5.761220E-01           6.696460E-01           0.0000000        
      3.663300E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      1.006630E+02           3.579000E-03          -3.454000E-03           0.0000000        
      2.983360E+01           2.582700E-02          -2.492500E-02           0.0000000        
      1.088940E+01           9.855900E-02          -9.763500E-02           0.0000000        
      4.393580E+00           2.383270E-01          -2.366920E-01           0.0000000        
      1.817820E+00           3.587070E-01          -2.923500E-01           0.0000000        
      7.278270E-01           3.650920E-01          -4.973000E-03           0.0000000        
      2.712950E-01           2.337380E-01           5.065880E-01           0.0000000        
      8.830900E-02           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      2.703200E+00           4.267760E-01     
      6.438000E-01           7.697990E-01     
$ IRON       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ IRON       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 26
$ S-TYPE FUNCTIONS
    20    6    0
      4.316265E+06           8.048803E-06          -4.155954E-06           9.532178E-07          -2.063008E-07          -4.009367E-07           0.0000000        
      6.463424E+05           6.258306E-05          -3.231401E-05           7.414605E-06          -1.604169E-06          -3.189255E-06           0.0000000        
      1.470897E+05           3.290239E-04          -1.699525E-04           3.898393E-05          -8.438437E-06          -1.623079E-05           0.0000000        
      4.166152E+04           1.387355E-03          -7.171369E-04           1.647152E-04          -3.563151E-05          -7.157920E-05           0.0000000        
      1.359077E+04           5.023256E-03          -2.603625E-03           5.985980E-04          -1.295998E-04          -2.463958E-04           0.0000000        
      4.905750E+03           1.610140E-02          -8.399109E-03           1.942390E-03          -4.201534E-04          -8.544907E-04           0.0000000        
      1.912746E+03           4.590034E-02          -2.434109E-02           5.687237E-03          -1.231954E-03          -2.307593E-03           0.0000000        
      7.926043E+02           1.136154E-01          -6.251948E-02           1.501329E-02          -3.248922E-03          -6.728292E-03           0.0000000        
      3.448065E+02           2.283869E-01          -1.365929E-01           3.452455E-02          -7.493717E-03          -1.366165E-02           0.0000000        
      1.558999E+02           3.221159E-01          -2.312707E-01           6.495820E-02          -1.410102E-02          -3.062240E-02           0.0000000        
      7.223091E+01           2.383661E-01          -2.383734E-01           7.716194E-02          -1.691600E-02          -2.631137E-02           0.0000000        
      3.272506E+01           7.404667E-02           3.123837E-02          -1.873411E-02           4.218996E-03          -9.760183E-03           0.0000000        
      1.566762E+01           9.214197E-02           5.086818E-01          -3.009185E-01           6.833810E-02           1.801906E-01           0.0000000        
      7.503483E+00           9.339790E-02           4.987695E-01          -4.554661E-01           1.098201E-01           1.529634E-01           0.0000000        
      3.312223E+00           1.573965E-02           9.033552E-02           1.286463E-01          -4.009005E-02           5.505413E-02           0.0000000        
      1.558471E+00          -4.186682E-04          -6.005337E-03           7.183316E-01          -2.174739E-01          -9.551364E-01           0.0000000        
      6.839140E-01           5.376318E-05           2.312454E-04           4.051743E-01          -2.465135E-01           2.586813E-01           0.0000000        
      1.467570E-01          -3.816654E-05          -5.643680E-04           2.168227E-02           2.731435E-01           1.834049E+00           0.0000000        
      7.058300E-02           4.319603E-05           4.992260E-04          -8.343566E-03           5.748321E-01          -9.333240E-01           0.0000000        
      3.144900E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.774569E+04           4.100000E-05          -1.500000E-05           3.000000E-06           5.000000E-06           0.0000000        
      4.200721E+03           3.690000E-04          -1.300000E-04           2.900000E-05           4.200000E-05           0.0000000        
      1.364429E+03           2.129000E-03          -7.510000E-04           1.650000E-04           2.410000E-04           0.0000000        
      5.220806E+02           9.369000E-03          -3.329000E-03           7.340000E-04           1.085000E-03           0.0000000        
      2.214595E+02           3.309700E-02          -1.191200E-02           2.626000E-03           3.831000E-03           0.0000000        
      1.009096E+02           9.443100E-02          -3.493300E-02           7.725000E-03           1.142300E-02           0.0000000        
      4.840115E+01           2.080770E-01          -7.998900E-02           1.773300E-02           2.579200E-02           0.0000000        
      2.398536E+01           3.323330E-01          -1.346360E-01           3.005500E-02           4.481800E-02           0.0000000        
      1.218250E+01           3.329870E-01          -1.385980E-01           3.109400E-02           4.459800E-02           0.0000000        
      6.242298E+00           1.568430E-01           3.027800E-02          -1.004800E-02          -1.117700E-02           0.0000000        
      3.110944E+00           2.154900E-02           3.332160E-01          -8.830600E-02          -1.381340E-01           0.0000000        
      1.509958E+00          -2.095000E-03           4.561530E-01          -1.298240E-01          -1.882850E-01           0.0000000        
      7.108450E-01          -1.739000E-03           2.850510E-01          -7.693700E-02          -1.073990E-01           0.0000000        
      2.731900E-01          -3.000000E-04           4.614400E-02           2.126610E-01           4.448630E-01           0.0000000        
      1.042330E-01           2.900000E-05          -3.249000E-03           5.730610E-01           6.402390E-01           0.0000000        
      3.829100E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      1.133440E+02           3.530000E-03          -3.890000E-03           0.0000000        
      3.364140E+01           2.578400E-02          -2.844200E-02           0.0000000        
      1.233100E+01           9.911900E-02          -1.124290E-01           0.0000000        
      4.994780E+00           2.390730E-01          -2.742570E-01           0.0000000        
      2.072800E+00           3.571990E-01          -3.155460E-01           0.0000000        
      8.307530E-01           3.621880E-01           5.710900E-02           0.0000000        
      3.091780E-01           2.364610E-01           5.636040E-01           0.0000000        
      1.001300E-01           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      3.224300E+00           4.222490E-01     
      7.758000E-01           7.714680E-01     
$ COBALT       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ COBALT       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 27
$ S-TYPE FUNCTIONS
    20    6    0
      4.675675E+06           7.979026E-06          -4.200240E-06           9.592692E-07          -2.028840E-07          -3.863053E-07           0.0000000        
      7.001615E+05           6.204071E-05          -3.265831E-05           7.461851E-06          -1.577580E-06          -3.068788E-06           0.0000000        
      1.593373E+05           3.261735E-04          -1.717644E-04           3.923137E-05          -8.298813E-06          -1.564826E-05           0.0000000        
      4.513046E+04           1.375360E-03          -7.247853E-04           1.657706E-04          -3.504154E-05          -6.883588E-05           0.0000000        
      1.472238E+04           4.979997E-03          -2.631462E-03           6.024335E-04          -1.274655E-04          -2.377367E-04           0.0000000        
      5.314222E+03           1.596434E-02          -8.489272E-03           1.955217E-03          -4.132695E-04          -8.213173E-04           0.0000000        
      2.072018E+03           4.552086E-02          -2.460619E-02           5.726326E-03          -1.212261E-03          -2.229630E-03           0.0000000        
      8.586188E+02           1.127385E-01          -6.322059E-02           1.512984E-02          -3.199318E-03          -6.467841E-03           0.0000000        
      3.735497E+02           2.268262E-01          -1.381957E-01           3.483973E-02          -7.390972E-03          -1.325463E-02           0.0000000        
      1.689229E+02           3.203074E-01          -2.340680E-01           6.570351E-02          -1.393649E-02          -2.946686E-02           0.0000000        
      7.829639E+01           2.374021E-01          -2.415002E-01           7.831503E-02          -1.678575E-02          -2.599066E-02           0.0000000        
      3.552123E+01           7.477686E-02           3.035312E-02          -1.877037E-02           4.149856E-03          -8.499807E-03           0.0000000        
      1.704144E+01           9.581872E-02           5.101341E-01          -3.062663E-01           6.797646E-02           1.727316E-01           0.0000000        
      8.173000E+00           9.649911E-02           4.974939E-01          -4.566429E-01           1.075807E-01           1.512189E-01           0.0000000        
      3.610318E+00           1.623362E-02           8.970746E-02           1.378169E-01          -4.166022E-02           3.554509E-02           0.0000000        
      1.697047E+00          -4.535497E-04          -5.941034E-03           7.193676E-01          -2.128044E-01          -8.829353E-01           0.0000000        
      7.435320E-01           5.113519E-05           2.175362E-04           3.992579E-01          -2.381360E-01           2.143530E-01           0.0000000        
      1.583440E-01          -4.174508E-05          -5.480155E-04           2.079933E-02           2.650788E-01           1.711865E+00           0.0000000        
      7.503600E-02           4.027577E-05           4.525804E-04          -7.820663E-03           5.722774E-01          -7.140037E-01           0.0000000        
      3.309100E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      1.926778E+04           4.100000E-05          -1.500000E-05          -3.000000E-06           5.000000E-06           0.0000000        
      4.560986E+03           3.690000E-04          -1.310000E-04          -2.900000E-05           4.500000E-05           0.0000000        
      1.481436E+03           2.128000E-03          -7.580000E-04          -1.670000E-04           2.550000E-04           0.0000000        
      5.668671E+02           9.372000E-03          -3.363000E-03          -7.420000E-04           1.144000E-03           0.0000000        
      2.404910E+02           3.315500E-02          -1.205400E-02          -2.662000E-03           4.061000E-03           0.0000000        
      1.096105E+02           9.475200E-02          -3.542400E-02          -7.841000E-03           1.209500E-02           0.0000000        
      5.259491E+01           2.090930E-01          -8.128700E-02          -1.805100E-02           2.747600E-02           0.0000000        
      2.608361E+01           3.337220E-01          -1.369080E-01          -3.058000E-02           4.755700E-02           0.0000000        
      1.326143E+01           3.322080E-01          -1.390190E-01          -3.131200E-02           4.730200E-02           0.0000000        
      6.799778E+00           1.546130E-01           3.546800E-02           1.131100E-02          -1.441800E-02           0.0000000        
      3.393414E+00           2.090200E-02           3.384980E-01           8.999000E-02          -1.500620E-01           0.0000000        
      1.648766E+00          -2.024000E-03           4.544330E-01           1.307330E-01          -1.990920E-01           0.0000000        
      7.762820E-01          -1.697000E-03           2.797930E-01           7.180800E-02          -7.978300E-02           0.0000000        
      2.980030E-01          -2.800000E-04           4.477600E-02          -2.216580E-01           4.590350E-01           0.0000000        
      1.136180E-01           2.600000E-05          -3.151000E-03          -5.710250E-01           6.174950E-01           0.0000000        
      4.162400E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      1.262640E+02           3.510000E-03          -4.067000E-03           0.0000000        
      3.752260E+01           2.588400E-02          -3.005300E-02           0.0000000        
      1.380210E+01           1.000580E-01          -1.196200E-01           0.0000000        
      5.609270E+00           2.405470E-01          -2.915130E-01           0.0000000        
      2.333690E+00           3.568430E-01          -3.180480E-01           0.0000000        
      9.364150E-01           3.595790E-01           9.169800E-02           0.0000000        
      3.482370E-01           2.366290E-01           5.608230E-01           0.0000000        
      1.123530E-01           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      3.772400E+00           4.239660E-01     
      9.170000E-01           7.684290E-01     
$ NICKEL       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ NICKEL       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 28
$ S-TYPE FUNCTIONS
    20    6    0
      5.045991E+06           8.208996E-06          -3.657849E-06           9.594149E-07          -2.013753E-07          -3.924245E-07           0.0000000        
      7.556142E+05           6.382884E-05          -2.844094E-05           7.462614E-06          -1.565832E-06          -3.113909E-06           0.0000000        
      1.719568E+05           3.355800E-04          -1.495928E-04           3.923843E-05          -8.237182E-06          -1.590447E-05           0.0000000        
      4.870479E+04           1.415075E-03          -6.313009E-04           1.657868E-04          -3.478105E-05          -6.981394E-05           0.0000000        
      1.588841E+04           5.124444E-03          -2.293052E-03           6.025905E-04          -1.265265E-04          -2.417848E-04           0.0000000        
      5.735123E+03           1.643256E-02          -7.405123E-03           1.955662E-03          -4.102589E-04          -8.326195E-04           0.0000000        
      2.236137E+03           4.689398E-02          -2.152032E-02           5.730391E-03          -1.203834E-03          -2.270294E-03           0.0000000        
      9.266468E+02           1.163534E-01          -5.560974E-02           1.514756E-02          -3.179062E-03          -6.557427E-03           0.0000000        
      4.031743E+02           2.350511E-01          -1.230176E-01           3.493499E-02          -7.353828E-03          -1.354288E-02           0.0000000        
      1.823476E+02           3.350184E-01          -2.130104E-01           6.598072E-02          -1.389022E-02          -2.989768E-02           0.0000000        
      8.454885E+01           2.534779E-01          -2.265837E-01           7.893083E-02          -1.677875E-02          -2.693106E-02           0.0000000        
      3.839634E+01           7.300901E-02           3.546796E-02          -1.906249E-02           4.163378E-03          -7.827693E-03           0.0000000        
      1.845859E+01           6.184244E-02           5.181697E-01          -3.095921E-01           6.814703E-02           1.741667E-01           0.0000000        
      8.863548E+00           6.302956E-02           5.025630E-01          -4.558610E-01           1.061029E-01           1.595468E-01           0.0000000        
      3.916227E+00           1.008063E-02           8.955674E-02           1.482931E-01          -4.339980E-02           1.995550E-02           0.0000000        
      1.838870E+00          -2.244528E-04          -7.031311E-03           7.134039E-01          -2.094950E-01          -8.897000E-01           0.0000000        
      8.043620E-01          -5.932767E-05          -4.339167E-04           3.976063E-01          -2.310271E-01           2.486892E-01           0.0000000        
      1.697970E-01          -1.158562E-05          -5.831711E-04           2.295523E-02           2.590532E-01           1.613012E+00           0.0000000        
      7.930600E-02           8.115109E-06           4.228788E-04          -9.151758E-03           5.691426E-01          -5.990277E-01           0.0000000        
      3.467700E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      2.102792E+04           4.100000E-05          -1.500000E-05           3.000000E-06           6.000000E-06           0.0000000        
      4.977560E+03           3.630000E-04          -1.290000E-04           2.600000E-05           5.300000E-05           0.0000000        
      1.616740E+03           2.097000E-03          -7.490000E-04           1.520000E-04           3.050000E-04           0.0000000        
      6.186718E+02           9.250000E-03          -3.328000E-03           6.780000E-04           1.364000E-03           0.0000000        
      2.625183E+02           3.279600E-02          -1.194700E-02           2.427000E-03           4.876000E-03           0.0000000        
      1.196907E+02           9.400400E-02          -3.524200E-02           7.201000E-03           1.450300E-02           0.0000000        
      5.746585E+01           2.082800E-01          -8.120400E-02           1.657800E-02           3.329600E-02           0.0000000        
      2.852829E+01           3.336540E-01          -1.374930E-01           2.839200E-02           5.748200E-02           0.0000000        
      1.452148E+01           3.329040E-01          -1.392260E-01           2.859900E-02           5.870200E-02           0.0000000        
      7.453850E+00           1.553720E-01           3.601600E-02          -1.013200E-02          -1.990400E-02           0.0000000        
      3.723553E+00           2.085900E-02           3.391280E-01          -8.291200E-02          -1.946950E-01           0.0000000        
      1.809813E+00          -2.440000E-03           4.504720E-01          -1.159980E-01          -2.396130E-01           0.0000000        
      8.513360E-01          -1.998000E-03           2.817830E-01          -7.279500E-02          -2.232000E-03           0.0000000        
      3.248140E-01          -3.380000E-04           4.789800E-02           1.956400E-01           5.214350E-01           0.0000000        
      1.195220E-01           3.500000E-05          -2.987000E-03           5.670990E-01           5.455400E-01           0.0000000        
      4.236600E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      1.402527E+02           3.376000E-03          -3.495000E-03           0.0000000        
      4.172610E+01           2.514100E-02          -2.601500E-02           0.0000000        
      1.539810E+01           9.774600E-02          -1.038760E-01           0.0000000        
      6.277100E+00           2.347090E-01          -2.520700E-01           0.0000000        
      2.618500E+00           3.469450E-01          -2.945800E-01           0.0000000        
      1.052600E+00           3.510680E-01           1.152000E-03           0.0000000        
      3.916000E-01           2.502550E-01           4.385890E-01           0.0000000        
      1.262000E-01           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      4.345500E+00           4.174290E-01     
      1.068000E+00           7.714830E-01     
$ COPPER       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ COPPER       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 29
$ S-TYPE FUNCTIONS
    20    6    0
      5.430321E+06           7.801026E-06          -4.404706E-06           9.704682E-07          -1.959354E-07          -3.532229E-07           0.0000000        
      8.131665E+05           6.065666E-05          -3.424801E-05           7.549245E-06          -1.523472E-06          -2.798812E-06           0.0000000        
      1.850544E+05           3.188964E-04          -1.801238E-04           3.968892E-05          -8.014808E-06          -1.432517E-05           0.0000000        
      5.241466E+04           1.344687E-03          -7.600455E-04           1.677200E-04          -3.383992E-05          -6.270946E-05           0.0000000        
      1.709868E+04           4.869050E-03          -2.759348E-03           6.095101E-04          -1.231191E-04          -2.179490E-04           0.0000000        
      6.171994E+03           1.561013E-02          -8.900970E-03           1.978846E-03          -3.992085E-04          -7.474316E-04           0.0000000        
      2.406481E+03           4.452077E-02          -2.579378E-02           5.798049E-03          -1.171900E-03          -2.049271E-03           0.0000000        
      9.972584E+02           1.103111E-01          -6.623861E-02           1.534158E-02          -3.096141E-03          -5.885203E-03           0.0000000        
      4.339289E+02           2.220342E-01          -1.445927E-01           3.540484E-02          -7.171993E-03          -1.226885E-02           0.0000000        
      1.962869E+02           3.133739E-01          -2.440110E-01           6.702098E-02          -1.356621E-02          -2.683147E-02           0.0000000        
      9.104280E+01           2.315121E-01          -2.504837E-01           8.026945E-02          -1.643989E-02          -2.479261E-02           0.0000000        
      4.138425E+01           7.640920E-02           2.852577E-02          -1.927231E-02           4.107628E-03          -5.984746E-03           0.0000000        
      1.993278E+01           1.103818E-01           5.115874E-01          -3.160129E-01           6.693964E-02           1.557124E-01           0.0000000        
      9.581891E+00           1.094372E-01           4.928061E-01          -4.573162E-01           1.028221E-01           1.436683E-01           0.0000000        
      4.234516E+00           1.836311E-02           8.788437E-02           1.550841E-01          -4.422945E-02           8.374103E-03           0.0000000        
      1.985814E+00          -6.043084E-04          -5.820281E-03           7.202872E-01          -2.031191E-01          -7.460711E-01           0.0000000        
      8.670830E-01           5.092245E-05           2.013508E-04           3.885122E-01          -2.230022E-01           1.244367E-01           0.0000000        
      1.813390E-01          -5.540730E-05          -5.182553E-04           1.924326E-02           2.517975E-01           1.510110E+00           0.0000000        
      8.365700E-02           3.969482E-05           3.731503E-04          -7.103807E-03           5.650091E-01          -3.477122E-01           0.0000000        
      3.626700E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      2.276057E+04           4.000000E-05          -1.500000E-05           3.000000E-06           5.000000E-06           0.0000000        
      5.387679E+03           3.610000E-04          -1.310000E-04           2.500000E-05           4.900000E-05           0.0000000        
      1.749945E+03           2.083000E-03          -7.550000E-04           1.470000E-04           2.780000E-04           0.0000000        
      6.696653E+02           9.197000E-03          -3.359000E-03           6.560000E-04           1.253000E-03           0.0000000        
      2.841948E+02           3.266000E-02          -1.208100E-02           2.351000E-03           4.447000E-03           0.0000000        
      1.296077E+02           9.379500E-02          -3.570300E-02           7.004000E-03           1.337000E-02           0.0000000        
      6.225415E+01           2.082740E-01          -8.250200E-02           1.613100E-02           3.046900E-02           0.0000000        
      3.092964E+01           3.339930E-01          -1.398900E-01           2.777000E-02           5.344700E-02           0.0000000        
      1.575827E+01           3.324930E-01          -1.407290E-01           2.756700E-02           5.263900E-02           0.0000000        
      8.094211E+00           1.547280E-01           3.876600E-02          -1.011500E-02          -1.688100E-02           0.0000000        
      4.046921E+00           2.127100E-02           3.426950E-01          -8.100900E-02          -1.794480E-01           0.0000000        
      1.967869E+00          -1.690000E-03           4.523100E-01          -1.104090E-01          -2.095880E-01           0.0000000        
      9.252950E-01          -1.516000E-03           2.770540E-01          -7.173200E-02          -3.963300E-02           0.0000000        
      3.529920E-01          -2.420000E-04           4.388500E-02           1.879300E-01           5.021300E-01           0.0000000        
      1.273070E-01           2.300000E-05          -2.802000E-03           5.646290E-01           5.811110E-01           0.0000000        
      4.435600E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      1.738970E+02           2.700000E-03          -3.363000E-03           0.0000000        
      5.188690E+01           2.090900E-02          -2.607900E-02           0.0000000        
      1.934190E+01           8.440800E-02          -1.082310E-01           0.0000000        
      7.975720E+00           2.139990E-01          -2.822170E-01           0.0000000        
      3.398230E+00           3.359800E-01          -3.471900E-01           0.0000000        
      1.409320E+00           3.573010E-01           2.671100E-02           0.0000000        
      5.488580E-01           2.645780E-01           4.920470E-01           0.0000000        
      1.901990E-01           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      5.028600E+00           4.242800E-01     
      1.259400E+00           7.630250E-01     
$ ZINC       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
$ ZINC       (20s,16p,8d,2f) -> [6s,5p,3d,1f]
a 30
$ S-TYPE FUNCTIONS
    20    6    0
      5.820021E+06           8.549241E-06          -2.640069E-06           9.967103E-07           1.995818E-07          -5.435910E-07           0.0000000        
      8.715234E+05           6.647410E-05          -2.052720E-05           7.754163E-06           1.552973E-06          -4.336894E-06           0.0000000        
      1.983350E+05           3.494962E-04          -1.079859E-04           4.076019E-05           8.161259E-06          -2.197572E-05           0.0000000        
      5.617631E+04           1.473832E-03          -4.558577E-04           1.722811E-04           3.450747E-05          -9.747392E-05           0.0000000        
      1.832582E+04           5.338330E-03          -1.657758E-03           6.259370E-04           1.253275E-04          -3.331615E-04           0.0000000        
      6.614955E+03           1.712708E-02          -5.368492E-03           2.032855E-03           4.072990E-04          -1.166192E-03           0.0000000        
      2.579199E+03           4.894085E-02          -1.571249E-02           5.954646E-03           1.192734E-03          -3.119308E-03           0.0000000        
      1.068849E+03           1.217934E-01          -4.122558E-02           1.576640E-02           3.163140E-03          -9.239504E-03           0.0000000        
      4.651045E+02           2.476589E-01          -9.406459E-02           3.637638E-02           7.303942E-03          -1.855471E-02           0.0000000        
      2.104130E+02           3.582431E-01          -1.719954E-01           6.892343E-02           1.391279E-02          -4.281189E-02           0.0000000        
      9.761629E+01           2.798174E-01          -1.958523E-01           8.238093E-02           1.670620E-02          -3.571095E-02           0.0000000        
      4.438020E+01           6.857491E-02           4.532907E-02          -2.011360E-02          -4.035586E-03          -1.638350E-02           0.0000000        
      2.142308E+01          -1.311092E-03           5.244442E-01          -3.252526E-01          -6.968861E-02           2.644664E-01           0.0000000        
      1.030891E+01           1.914001E-03           5.006142E-01          -4.602899E-01          -1.030105E-01           2.086588E-01           0.0000000        
      4.553645E+00          -8.759220E-04           8.945527E-02           1.635546E-01           4.471442E-02          -1.774382E-02           0.0000000        
      2.132821E+00           3.740096E-04          -2.146262E-03           7.297118E-01           2.150027E-01          -1.353873E+00           0.0000000        
      9.296970E-01          -1.401399E-04           2.112113E-03           3.769751E-01           2.220163E-01           8.182926E-01           0.0000000        
      1.921470E-01           4.757132E-05          -4.133980E-04           1.433224E-02          -3.114776E-01           1.695036E+00           0.0000000        
      8.759500E-02          -3.642711E-05           3.209752E-04          -6.671210E-03          -5.693429E-01          -1.388656E+00           0.0000000        
      3.770200E-02           0.0000000              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    16    5    0
      2.441198E+04           4.100000E-05          -1.500000E-05           3.000000E-06           5.000000E-06           0.0000000        
      5.778518E+03           3.610000E-04          -1.350000E-04           2.500000E-05           4.200000E-05           0.0000000        
      1.876862E+03           2.088000E-03          -7.820000E-04           1.440000E-04           2.380000E-04           0.0000000        
      7.182361E+02           9.221000E-03          -3.478000E-03           6.450000E-04           1.088000E-03           0.0000000        
      3.048327E+02           3.277300E-02          -1.252000E-02           2.311000E-03           3.821000E-03           0.0000000        
      1.390453E+02           9.417900E-02          -3.701600E-02           6.898000E-03           1.164400E-02           0.0000000        
      6.680417E+01           2.091320E-01          -8.555900E-02           1.588200E-02           2.616700E-02           0.0000000        
      3.320699E+01           3.345690E-01          -1.447180E-01           2.735000E-02           4.675000E-02           0.0000000        
      1.692816E+01           3.303590E-01          -1.434420E-01           2.662100E-02           4.330900E-02           0.0000000        
      8.696229E+00           1.523470E-01           4.359500E-02          -1.085800E-02          -1.342900E-02           0.0000000        
      4.350510E+00           2.298400E-02           3.488880E-01          -7.985300E-02          -1.538970E-01           0.0000000        
      2.116523E+00           1.607000E-03           4.538650E-01          -1.061270E-01          -1.674130E-01           0.0000000        
      9.953870E-01           4.680000E-04           2.685940E-01          -6.888300E-02          -8.499500E-02           0.0000000        
      3.781120E-01           6.600000E-05           3.886800E-02           1.843850E-01           4.508130E-01           0.0000000        
      1.345790E-01          -2.000000E-06          -2.492000E-03           5.617880E-01           6.408690E-01           0.0000000        
      4.628200E-02           0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    8    3    0
      2.056177E+02           2.342000E-03           3.279000E-03           0.0000000        
      6.144981E+01           1.860600E-02           2.617600E-02           0.0000000        
      2.305689E+01           7.710200E-02           1.113670E-01           0.0000000        
      9.577739E+00           2.020260E-01           3.045810E-01           0.0000000        
      4.133734E+00           3.294540E-01           3.862990E-01           0.0000000        
      1.747518E+00           3.609760E-01          -5.837500E-02           0.0000000        
      6.995600E-01           2.716570E-01          -5.388760E-01           0.0000000        
      2.516080E-01           0.0000000              0.0000000              1.0000000        
$ F-TYPE FUNCTIONS
    2    1    0
      5.734400E+00           4.311320E-01     
      1.461500E+00           7.546420E-01     
$ GALLIUM       (14s,11p,6d) -> [5s,4p,2d]
$ GALLIUM       (14s,11p,6d) -> [5s,4p,2d]
a 31
$ S-TYPE FUNCTIONS
    14    5    0
 485130.0000000              0.0002068             -0.0000643              0.0000245             -0.0000057              0.0000000        
  72719.0000000              0.0016047             -0.0004954              0.0001895             -0.0000440              0.0000000        
  16552.0000000              0.0083402             -0.0026208              0.0009964             -0.0002305              0.0000000        
   4687.8000000              0.0340248             -0.0106839              0.0041082             -0.0009544              0.0000000        
   1529.1000000              0.1111699             -0.0374123              0.0142938             -0.0033055              0.0000000        
    551.8100000              0.2753930             -0.1009636              0.0398034             -0.0092888              0.0000000        
    215.1800000              0.4212628             -0.2145141              0.0855940             -0.0198644              0.0000000        
     88.1740000              0.2738906             -0.1752297              0.0796305             -0.0190888              0.0000000        
     27.1540000              0.0283720              0.4831599             -0.2939107              0.0732356              0.0000000        
     11.5030000             -0.0062931              0.6323677             -0.5263914              0.1341526              0.0000000        
      3.3018000              0.0020606              0.0684942              0.5864249             -0.1831929              0.0000000        
      1.3314000             -0.0009269             -0.0118712              0.6726347             -0.3571308              0.0000000        
      0.1931600              0.0002273              0.0026652              0.0276123              0.6246013              0.0000000        
      0.0708950              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   3248.6000000              0.0015260             -0.0005803              0.0000950              0.0000000        
    769.9700000              0.0127486             -0.0048647              0.0007832              0.0000000        
    248.2000000              0.0633742             -0.0248394              0.0040855              0.0000000        
     93.3640000              0.2065775             -0.0841759              0.0135987              0.0000000        
     38.2510000              0.4092963             -0.1800885              0.0302695              0.0000000        
     16.4220000              0.3919183             -0.1585555              0.0241790              0.0000000        
      6.7918000              0.1029441              0.2355376             -0.0423777              0.0000000        
      2.8336000             -0.0007203              0.5820587             -0.1265661              0.0000000        
      1.1062000              0.0020950              0.3366619             -0.0499444              0.0000000        
      0.2225000             -0.0003290              0.0171912              0.4494199              0.0000000        
      0.0617720              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
     65.3370000              0.0273825              0.0000000        
     18.4970000              0.1510805              0.0000000        
      6.3150000              0.3749217              0.0000000        
      2.1635000              0.4750799              0.0000000        
      0.6667500              0.2982750              0.0000000        
      0.1884000              0.0000000              1.0000000        
$ GERMANIUM       (14s,11p,6d) -> [5s,4p,2d]
$ GERMANIUM       (14s,11p,6d) -> [5s,4p,2d]
a 32
$ S-TYPE FUNCTIONS
    14    5    0
 521800.0000000              0.0002045             -0.0000638              0.0000246             -0.0000063              0.0000000        
  78214.0000000              0.0015868             -0.0004916              0.0001900             -0.0000486              0.0000000        
  17803.0000000              0.0082480             -0.0026002              0.0009993             -0.0002553              0.0000000        
   5041.9000000              0.0336649             -0.0106080              0.0041200             -0.0010560              0.0000000        
   1644.5000000              0.1101249             -0.0371602              0.0143557             -0.0036674              0.0000000        
    593.4300000              0.2735607             -0.1005790              0.0400375             -0.0103053              0.0000000        
    231.3600000              0.4210670             -0.2143977              0.0865794             -0.0222200              0.0000000        
     94.7620000              0.2766791             -0.1782617              0.0815861             -0.0215275              0.0000000        
     29.2740000              0.0292180              0.4777404             -0.2934770              0.0806752              0.0000000        
     12.4500000             -0.0065903              0.6355983             -0.5367983              0.1524958              0.0000000        
      3.6463000              0.0022430              0.0722174              0.5637985             -0.1980528              0.0000000        
      1.5025000             -0.0010382             -0.0127265              0.6947182             -0.4073954              0.0000000        
      0.2450300              0.0002695              0.0029608              0.0315730              0.6477288              0.0000000        
      0.0915940              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   3568.1000000              0.0014591             -0.0005630              0.0001115              0.0000000        
    845.7200000              0.0122176             -0.0047354              0.0009212              0.0000000        
    272.7400000              0.0610490             -0.0242643              0.0048273              0.0000000        
    102.6800000              0.2008039             -0.0830900              0.0162272              0.0000000        
     42.1480000              0.4038942             -0.1800247              0.0366354              0.0000000        
     18.1490000              0.3970027             -0.1663295              0.0307867              0.0000000        
      7.5934000              0.1105481              0.2193717             -0.0480643              0.0000000        
      3.1964000              0.0000768              0.5820239             -0.1559804              0.0000000        
      1.2743000              0.0021263              0.3477720             -0.0632370              0.0000000        
      0.2825800             -0.0003744              0.0192455              0.5040819              0.0000000        
      0.0840900              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
     74.7620000              0.0257684              0.0000000        
     21.3020000              0.1454421              0.0000000        
      7.3436000              0.3713721              0.0000000        
      2.5651000              0.4800002              0.0000000        
      0.8197000              0.2896800              0.0000000        
      0.2470000              0.0000000              1.0000000        
$ ARSENIC       (14s,11p,6d) -> [5s,4p,2d]
$ ARSENIC       (14s,11p,6d) -> [5s,4p,2d]
a 33
$ S-TYPE FUNCTIONS
    14    5    0
 559583.7900000              0.0002024             -0.0000634              0.0000246             -0.0000068              0.0000000        
  83879.3300000              0.0015709             -0.0004883              0.0001907             -0.0000525              0.0000000        
  19092.6680000              0.0081662             -0.0025821              0.0010031             -0.0002756              0.0000000        
   5407.3925000              0.0333399             -0.0105402              0.0041353             -0.0011389              0.0000000        
   1763.7559000              0.1091726             -0.0369325              0.0144259             -0.0039646              0.0000000        
    636.4567200              0.2718853             -0.1002355              0.0402962             -0.0111423              0.0000000        
    248.0884300              0.4208509             -0.2142948              0.0875670             -0.0241991              0.0000000        
    101.5785100              0.2792257             -0.1810526              0.0835178             -0.0236339              0.0000000        
     31.4755130              0.0300301              0.4725410             -0.2932935              0.0866317              0.0000000        
     13.4372820             -0.0068804              0.6386194             -0.5470520              0.1685839              0.0000000        
      4.0086900              0.0024240              0.0758107              0.5438738             -0.2091425              0.0000000        
      1.6849290             -0.0011491             -0.0135278              0.7143591             -0.4500918              0.0000000        
      0.3000190              0.0003095              0.0031970              0.0353443              0.6603978              0.0000000        
      0.1135870              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   3886.3564000              0.0014097             -0.0005519              0.0001236              0.0000000        
    921.2020100              0.0118277             -0.0046550              0.0010240              0.0000000        
    297.1931900              0.0593280             -0.0239176              0.0053805              0.0000000        
    111.9750800              0.1965115             -0.0825627              0.0182443              0.0000000        
     46.0346210              0.3997891             -0.1806791              0.0415979              0.0000000        
     19.8741940              0.4004653             -0.1724848              0.0362998              0.0000000        
      8.3860880              0.1164196              0.2086700             -0.0523569              0.0000000        
      3.5587280              0.0006918              0.5823622             -0.1791667              0.0000000        
      1.4472820              0.0021633              0.3537465             -0.0740477              0.0000000        
      0.3477790             -0.0004150              0.0206439              0.5358094              0.0000000        
      0.1076990              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
     84.4242340              0.0245288              0.0000000        
     24.1815890              0.1411340              0.0000000        
      8.4017770              0.3687579              0.0000000        
      2.9805020              0.4840626              0.0000000        
      0.9790030              0.2824434              0.0000000        
      0.3098000              0.0000000              1.0000000        
$ SELENIUM       (14s,11p,6d) -> [5s,4p,2d]
$ SELENIUM       (14s,11p,6d) -> [5s,4p,2d]
a 34
$ S-TYPE FUNCTIONS
    14    5    0
 598990.0000000              0.0002004             -0.0000629              0.0000247             -0.0000072              0.0000000        
  89783.0000000              0.0015554             -0.0004850              0.0001913             -0.0000559              0.0000000        
  20435.0000000              0.0080872             -0.0025644              0.0010068             -0.0002938              0.0000000        
   5786.9000000              0.0330344             -0.0104761              0.0041514             -0.0012136              0.0000000        
   1887.3000000              0.1082924             -0.0367223              0.0144991             -0.0042340              0.0000000        
    680.9700000              0.2703361             -0.0999225              0.0405658             -0.0119035              0.0000000        
    265.3900000              0.4206236             -0.2141973              0.0885364             -0.0260206              0.0000000        
    108.6300000              0.2815922             -0.1836593              0.0854212             -0.0256148              0.0000000        
     33.7600000              0.0308110              0.4675454             -0.2932581              0.0919427              0.0000000        
     14.4650000             -0.0071617              0.6414740             -0.5570727              0.1838700              0.0000000        
      4.3890000              0.0026022              0.0792569              0.5261436             -0.2188461              0.0000000        
      1.8783000             -0.0012583             -0.0142697              0.7320371             -0.4896524              0.0000000        
      0.3585900              0.0003465              0.0033792              0.0388246              0.6775818              0.0000000        
      0.1364900              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   4135.6000000              0.0014127             -0.0005610              0.0001366              0.0000000        
    980.3400000              0.0118588             -0.0047340              0.0011308              0.0000000        
    316.3500000              0.0595153             -0.0243504              0.0059581              0.0000000        
    119.2500000              0.1972201             -0.0841071              0.0201866              0.0000000        
     49.0680000              0.4007439             -0.1841384              0.0461939              0.0000000        
     21.2120000              0.3994740             -0.1735004              0.0394050              0.0000000        
      8.9462000              0.1153364              0.2167263             -0.0592846              0.0000000        
      3.8236000              0.0002219              0.5850099             -0.2014663              0.0000000        
      1.5883000              0.0022838              0.3416816             -0.0687821              0.0000000        
      0.4096900             -0.0004756              0.0199125              0.5595944              0.0000000        
      0.1245900              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
     94.4720000              0.0234982              0.0000000        
     27.1800000              0.1375183              0.0000000        
      9.5068000              0.3664824              0.0000000        
      3.4168000              0.4874717              0.0000000        
      1.1479000              0.2765769              0.0000000        
      0.3682000              0.0000000              1.0000000        
$ BROMINE       (14s,11p,6d) -> [5s,4p,2d]
$ BROMINE       (14s,11p,6d) -> [5s,4p,2d]
a 35
$ S-TYPE FUNCTIONS
    14    5    0
 640100.0000000              0.0001984             -0.0000625              0.0000248             -0.0000076              0.0000000        
  95938.0000000              0.0015400             -0.0004816              0.0001919             -0.0000588              0.0000000        
  21833.0000000              0.0080096             -0.0025466              0.0010100             -0.0003092              0.0000000        
   6181.9000000              0.0327341             -0.0104112              0.0041659             -0.0012766              0.0000000        
   2015.7000000              0.1074480             -0.0365179              0.0145683             -0.0044634              0.0000000        
    727.1000000              0.2688946             -0.0996295              0.0408345             -0.0125575              0.0000000        
    283.2800000              0.4204411             -0.2141310              0.0894859             -0.0276145              0.0000000        
    115.9100000              0.2838041             -0.1860911              0.0872786             -0.0273945              0.0000000        
     36.1240000              0.0315455              0.4628261             -0.2933644              0.0964094              0.0000000        
     15.5320000             -0.0074268              0.6441141             -0.5667109              0.1976871              0.0000000        
      4.7857000              0.0027728              0.0825502              0.5105658             -0.2266693              0.0000000        
      2.0817000             -0.0013635             -0.0149694              0.7477214             -0.5241165              0.0000000        
      0.4202800              0.0003812              0.0035288              0.0421512              0.6889865              0.0000000        
      0.1606900              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   4340.8000000              0.0014448             -0.0005819              0.0001518              0.0000000        
   1028.9000000              0.0121288             -0.0049065              0.0012563              0.0000000        
    332.0200000              0.0608077             -0.0252514              0.0066224              0.0000000        
    125.1600000              0.2009358             -0.0869445              0.0223816              0.0000000        
     51.5110000              0.4047419             -0.1893422              0.0509717              0.0000000        
     22.2810000              0.3957151             -0.1710882              0.0414009              0.0000000        
      9.3417000              0.1102213              0.2368755             -0.0703970              0.0000000        
      4.0132000             -0.0009090              0.5898400             -0.2232540              0.0000000        
      1.7002000              0.0024832              0.3171944             -0.0564179              0.0000000        
      0.4719400             -0.0005744              0.0179833              0.5808079              0.0000000        
      0.1442100              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
    104.8300000              0.0226583              0.0000000        
     30.2720000              0.1345895              0.0000000        
     10.6490000              0.3647181              0.0000000        
      3.8696000              0.4904196              0.0000000        
      1.3239000              0.2713885              0.0000000        
      0.4098000              0.0000000              1.0000000        
$ KRYPTON       (14s,11p,6d) -> [5s,4p,2d]
$ KRYPTON       (14s,11p,6d) -> [5s,4p,2d]
a 36
$ S-TYPE FUNCTIONS
    14    5    0
 681358.8200000              0.0001969             -0.0000622              0.0000249             -0.0000079              0.0000000        
 102126.4800000              0.0015286             -0.0004794              0.0001928             -0.0000614              0.0000000        
  23243.7100000              0.0079500             -0.0025341              0.0010149             -0.0003230              0.0000000        
   6582.0073000              0.0324938             -0.0103636              0.0041857             -0.0013330              0.0000000        
   2146.4286000              0.1067240             -0.0363516              0.0146459             -0.0046672              0.0000000        
    774.3378200              0.2675701             -0.0993737              0.0411070             -0.0131352              0.0000000        
    301.6702000              0.4201851             -0.2140610              0.0903955             -0.0290342              0.0000000        
    123.4118400              0.2858015             -0.1883192              0.0890623             -0.0290173              0.0000000        
     38.5675510              0.0322461              0.4583816             -0.2935718              0.1002664              0.0000000        
     16.6373790             -0.0076828              0.6465664             -0.5759698              0.2103818              0.0000000        
      5.1987950              0.0029393              0.0856579              0.4968578             -0.2332471              0.0000000        
      2.2948140             -0.0014662             -0.0156123              0.7616895             -0.5546497              0.0000000        
      0.4852110              0.0004144              0.0036490              0.0453267              0.6969522              0.0000000        
      0.1862700              0.0000000              0.0000000              0.0000000              0.0000000              1.0000000        
$ P-TYPE FUNCTIONS
    11    4    0
   4474.2699000              0.0015195             -0.0006208              0.0001701              0.0000000        
   1060.5790000              0.0127424             -0.0052212              0.0014064              0.0000000        
    342.2081200              0.0636465             -0.0268463              0.0073963              0.0000000        
    128.9984200              0.2085635             -0.0915823              0.0248254              0.0000000        
     53.0872220              0.4122423             -0.1968164              0.0557155              0.0000000        
     22.9594250              0.3878103             -0.1634750              0.0412132              0.0000000        
      9.5073000              0.1003820              0.2738204             -0.0876057              0.0000000        
      4.0830550             -0.0025078              0.5981592             -0.2440586              0.0000000        
      1.7504460              0.0027139              0.2750453             -0.0295007              0.0000000        
      0.5291900             -0.0006977              0.0127706              0.6012295              0.0000000        
      0.1643690              0.0000000              0.0000000              0.0000000              1.0000000        
$ D-TYPE FUNCTIONS
    6    2    0
    115.5253200              0.0219557              0.0000000        
     33.4652460              0.1321620              0.0000000        
     11.8304590              0.3633484              0.0000000        
      4.3397710              0.4929582              0.0000000        
      1.5075240              0.2667560              0.0000000        
      0.5030000              0.0000000              1.0000000