# all_value

name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Ti
data:
TITANIUM
S   21
  1 3014643.0000000             0.0000089        
  2 451432.9000000              0.0000693        
  3 102733.8000000              0.0003644        
  4  29098.1700000              0.0015364        
  5   9492.3300000              0.0055628        
  6   3426.3460000              0.0178286        
  7   1335.8960000              0.0508118        
  8    553.5026000              0.1257180        
  9    240.6925000              0.2529935        
 10    108.7293000              0.3595943        
 11     50.2645700              0.2724695        
 12     22.5800400              0.0635956        
 13     10.7143200             -0.0012245        
 14      5.0935460              0.0020117        
 15      2.2441830             -0.0009357        
 16      1.0595700              0.0004205        
 17      0.4688490             -0.0001776        
 18      0.1061430              0.0000864        
 19      0.0552620             -0.0000829        
 20      0.0254650              0.0000376        
 21      0.0101860             -0.0000090        
S   21
  1 3014643.0000000            -0.0000026        
  2 451432.9000000             -0.0000205        
  3 102733.8000000             -0.0001077        
  4  29098.1700000             -0.0004548        
  5   9492.3300000             -0.0016529        
  6   3426.3460000             -0.0053485        
  7   1335.8960000             -0.0156089        
  8    553.5026000             -0.0407222        
  9    240.6925000             -0.0918764        
 10    108.7293000             -0.1655028        
 11     50.2645700             -0.1836009        
 12     22.5800400              0.0477232        
 13     10.7143200              0.5057851        
 14      5.0935460              0.5066198        
 15      2.2441830              0.0946475        
 16      1.0595700             -0.0028028        
 17      0.4688490              0.0024413        
 18      0.1061430             -0.0007298        
 19      0.0552620              0.0006979        
 20      0.0254650             -0.0003147        
 21      0.0101860              0.0000749        
S   21
  1 3014643.0000000             0.0000009        
  2 451432.9000000              0.0000073        
  3 102733.8000000              0.0000385        
  4  29098.1700000              0.0001626        
  5   9492.3300000              0.0005909        
  6   3426.3460000              0.0019160        
  7   1335.8960000              0.0055992        
  8    553.5026000              0.0147171        
  9    240.6925000              0.0335677        
 10    108.7293000              0.0623753        
 11     50.2645700              0.0724054        
 12     22.5800400             -0.0196954        
 13     10.7143200             -0.2781485        
 14      5.0935460             -0.4477923        
 15      2.2441830              0.0757183        
 16      1.0595700              0.7218245        
 17      0.4688490              0.4330537        
 18      0.1061430              0.0219039        
 19      0.0552620             -0.0125651        
 20      0.0254650              0.0045014        
 21      0.0101860             -0.0009663        
S   21
  1 3014643.0000000            -0.0000002        
  2 451432.9000000             -0.0000018        
  3 102733.8000000             -0.0000095        
  4  29098.1700000             -0.0000401        
  5   9492.3300000             -0.0001458        
  6   3426.3460000             -0.0004727        
  7   1335.8960000             -0.0013822        
  8    553.5026000             -0.0036347        
  9    240.6925000             -0.0083071        
 10    108.7293000             -0.0154849        
 11     50.2645700             -0.0181067        
 12     22.5800400              0.0049579        
 13     10.7143200              0.0727455        
 14      5.0935460              0.1246226        
 15      2.2441830             -0.0301251        
 16      1.0595700             -0.2547207        
 17      0.4688490             -0.3112813        
 18      0.1061430              0.3964178        
 19      0.0552620              0.5823944        
 20      0.0254650              0.1989806        
 21      0.0101860              0.0046510        
S   21
  1 3014643.0000000             0.0000003        
  2 451432.9000000              0.0000026        
  3 102733.8000000              0.0000135        
  4  29098.1700000              0.0000587        
  5   9492.3300000              0.0002057        
  6   3426.3460000              0.0006977        
  7   1335.8960000              0.0019315        
  8    553.5026000              0.0054314        
  9    240.6925000              0.0114025        
 10    108.7293000              0.0239193        
 11     50.2645700              0.0224097        
 12     22.5800400              0.0024417        
 13     10.7143200             -0.1299470        
 14      5.0935460             -0.1441239        
 15      2.2441830             -0.0426621        
 16      1.0595700              0.6877107        
 17      0.4688490              0.0897037        
 18      0.1061430             -2.2007160        
 19      0.0552620              1.1681766        
 20      0.0254650              0.6824757        
 21      0.0101860              0.0967020        
S   21
  1 3014643.0000000            -0.0000007        
  2 451432.9000000             -0.0000053        
  3 102733.8000000             -0.0000263        
  4  29098.1700000             -0.0001200        
  5   9492.3300000             -0.0003962        
  6   3426.3460000             -0.0014435        
  7   1335.8960000             -0.0036579        
  8    553.5026000             -0.0114497        
  9    240.6925000             -0.0209347        
 10    108.7293000             -0.0529136        
 11     50.2645700             -0.0331418        
 12     22.5800400             -0.0357299        
 13     10.7143200              0.3473759        
 14      5.0935460              0.1962175        
 15      2.2441830              0.2160055        
 16      1.0595700             -2.5428950        
 17      0.4688490              2.5344706        
 18      0.1061430              0.6548118        
 19      0.0552620             -3.0783880        
 20      0.0254650              2.1852588        
 21      0.0101860             -0.1213722        
S   21
  1 3014643.0000000             0.0000007        
  2 451432.9000000              0.0000053        
  3 102733.8000000              0.0000292        
  4  29098.1700000              0.0001161        
  5   9492.3300000              0.0004557        
  6   3426.3460000              0.0013422        
  7   1335.8960000              0.0044136        
  8    553.5026000              0.0100605        
  9    240.6925000              0.0276626        
 10    108.7293000              0.0402696        
 11     50.2645700              0.0732413        
 12     22.5800400             -0.0567999        
 13     10.7143200             -0.1696599        
 14      5.0935460             -0.7656318        
 15      2.2441830              1.3773327        
 16      1.0595700              0.7186221        
 17      0.4688490             -2.5670770        
 18      0.1061430              5.2087230        
 19      0.0552620             -5.9829570        
 20      0.0254650              1.8991192        
 21      0.0101860              0.4757467        
S   21
  1 3014643.0000000            -0.0000008        
  2 451432.9000000             -0.0000053        
  3 102733.8000000             -0.0000328        
  4  29098.1700000             -0.0001114        
  5   9492.3300000             -0.0005304        
  6   3426.3460000             -0.0012205        
  7   1335.8960000             -0.0053556        
  8    553.5026000             -0.0083821        
  9    240.6925000             -0.0360300        
 10    108.7293000             -0.0248957        
 11     50.2645700             -0.1229543        
 12     22.5800400              0.1703617        
 13     10.7143200             -0.0254700        
 14      5.0935460              1.4237522        
 15      2.2441830             -3.6999680        
 16      1.0595700              3.4250863        
 17      0.4688490             -1.0095400        
 18      0.1061430             -2.3953330        
 19      0.0552620              5.6662256        
 20      0.0254650             -5.7117110        
 21      0.0101860              2.6957932        
P   15
  1   5181.1570000              0.0001872        
  2   1227.4610000              0.0016414        
  3    398.2712000              0.0090830        
  4    151.5867000              0.0368951        
  5     63.6963300              0.1135599        
  6     28.5473300              0.2531790        
  7     13.2612900              0.3801676        
  8      6.3103520              0.3102000        
  9      2.9518750              0.0877741        
 10      1.3653700              0.0029491        
 11      0.6114150              0.0013194        
 12      0.2525480             -0.0004215        
 13      0.1010190              0.0002198        
 14      0.0404080             -0.0001063        
 15      0.0161630              0.0000332        
P   15
  1   5181.1570000             -0.0000643        
  2   1227.4610000             -0.0005635        
  3    398.2712000             -0.0031425        
  4    151.5867000             -0.0129043        
  5     63.6963300             -0.0409507        
  6     28.5473300             -0.0946030        
  7     13.2612900             -0.1513956        
  8      6.3103520             -0.1141409        
  9      2.9518750              0.1632057        
 10      1.3653700              0.4732173        
 11      0.6114150              0.4245132        
 12      0.2525480              0.1018377        
 13      0.1010190             -0.0016787        
 14      0.0404080              0.0028392        
 15      0.0161630             -0.0007664        
P   15
  1   5181.1570000              0.0000178        
  2   1227.4610000              0.0001578        
  3    398.2712000              0.0008699        
  4    151.5867000              0.0036210        
  5     63.6963300              0.0113629        
  6     28.5473300              0.0267991        
  7     13.2612900              0.0421416        
  8      6.3103520              0.0336818        
  9      2.9518750             -0.0589850        
 10      1.3653700             -0.1512272        
 11      0.6114150             -0.2034795        
 12      0.2525480              0.1180617        
 13      0.1010190              0.6938395        
 14      0.0404080              0.3145852        
 15      0.0161630              0.0163869        
P   15
  1   5181.1570000             -0.0000246        
  2   1227.4610000             -0.0002160        
  3    398.2712000             -0.0012036        
  4    151.5867000             -0.0049522        
  5     63.6963300             -0.0157336        
  6     28.5473300             -0.0365861        
  7     13.2612900             -0.0594490        
  8      6.3103520             -0.0467846        
  9      2.9518750              0.0794480        
 10      1.3653700              0.2762838        
 11      0.6114150              0.2714219        
 12      0.2525480             -0.7924697        
 13      0.1010190             -0.4631748        
 14      0.0404080              0.8432116        
 15      0.0161630              0.2904509        
P   15
  1   5181.1570000              0.0000372        
  2   1227.4610000              0.0003035        
  3    398.2712000              0.0018182        
  4    151.5867000              0.0069432        
  5     63.6963300              0.0239153        
  6     28.5473300              0.0502972        
  7     13.2612900              0.0959397        
  8      6.3103520              0.0578602        
  9      2.9518750             -0.0884661        
 10      1.3653700             -0.6566446        
 11      0.6114150              0.1103128        
 12      0.2525480              1.6148571        
 13      0.1010190             -1.7484960        
 14      0.0404080              0.3163034        
 15      0.0161630              0.6338804        
P   15
  1   5181.1570000             -0.0000550        
  2   1227.4610000             -0.0004423        
  3    398.2712000             -0.0026841        
  4    151.5867000             -0.0100919        
  5     63.6963300             -0.0352776        
  6     28.5473300             -0.0726365        
  7     13.2612900             -0.1449412        
  8      6.3103520             -0.1424794        
  9      2.9518750              0.3112594        
 10      1.3653700              1.4389468        
 11      0.6114150             -2.7808870        
 12      0.2525480              1.8524065        
 13      0.1010190             -0.0721023        
 14      0.0404080             -1.1494250        
 15      0.0161630              0.9777475        
P   15
  1   5181.1570000              0.0000344        
  2   1227.4610000              0.0007457        
  3    398.2712000              0.0016752        
  4    151.5867000              0.0173989        
  5     63.6963300              0.0193675        
  6     28.5473300              0.1481120        
  7     13.2612900             -0.0041436        
  8      6.3103520              0.6359246        
  9      2.9518750             -1.9129570        
 10      1.3653700              1.3110787        
 11      0.6114150              0.7177975        
 12      0.2525480             -2.2401480        
 13      0.1010190              2.9090753        
 14      0.0404080             -2.7064500        
 15      0.0161630              1.4239416        
D   10
  1    134.3565000              0.0008295        
  2     40.0418900              0.0068672        
  3     15.1297600              0.0297829        
  4      6.2769900              0.0897360        
  5      2.7814100              0.1933983        
  6      1.2536020              0.2893468        
  7      0.5574050              0.3179441        
  8      0.2397590              0.2758861        
  9      0.0952870              0.1593833        
 10      0.0381150              0.0705435        
D   10
  1    134.3565000             -0.0006682        
  2     40.0418900             -0.0054960        
  3     15.1297600             -0.0241325        
  4      6.2769900             -0.0729395        
  5      2.7814100             -0.1579535        
  6      1.2536020             -0.2164335        
  7      0.5574050             -0.1822406        
  8      0.2397590              0.1262455        
  9      0.0952870              0.4480513        
 10      0.0381150              0.4841333        
D   10
  1    134.3565000              0.0010701        
  2     40.0418900              0.0090356        
  3     15.1297600              0.0392576        
  4      6.2769900              0.1244016        
  5      2.7814100              0.2501025        
  6      1.2536020              0.2800033        
  7      0.5574050             -0.0889985        
  8      0.2397590             -0.6260252        
  9      0.0952870             -0.2487541        
 10      0.0381150              0.8157396        
D   10
  1    134.3565000             -0.0014503        
  2     40.0418900             -0.0123965        
  3     15.1297600             -0.0542237        
  4      6.2769900             -0.1780062        
  5      2.7814100             -0.3354542        
  6      1.2536020             -0.1876683        
  7      0.5574050              0.7838004        
  8      0.2397590              0.2236343        
  9      0.0952870             -1.2876010        
 10      0.0381150              0.9641309        
D   10
  1    134.3565000              0.0022858        
  2     40.0418900              0.0165219        
  3     15.1297600              0.0871351        
  4      6.2769900              0.2517754        
  5      2.7814100              0.5408700        
  6      1.2536020             -0.6428651        
  7      0.5574050             -0.8091268        
  8      0.2397590              1.8533725        
  9      0.0952870             -1.6510520        
 10      0.0381150              0.7664389        
F   6
  1      4.2464000              0.0390840        
  2      1.6831000              0.1338314        
  3      0.6671000              0.3651079        
  4      0.2644000              0.4949678        
  5      0.1048000              0.2514447        
  6      0.0415000              0.0383294        
F   6
  1      4.2464000             -0.1220177        
  2      1.6831000             -0.3671189        
  3      0.6671000             -0.4991231        
  4      0.2644000              0.2551840        
  5      0.1048000              0.5221382        
  6      0.0415000              0.1120723        
F   6
  1      4.2464000              0.2385937        
  2      1.6831000              0.5542357        
  3      0.6671000             -0.1951449        
  4      0.2644000             -0.7351700        
  5      0.1048000              0.6567922        
  6      0.0415000              0.2690218        
G   4
  1      2.4017000              0.1052200        
  2      0.9440000              0.3397169        
  3      0.3710000              0.5641176        
  4      0.1458000              0.2853114        
G   4
  1      2.4017000             -0.3879583        
  2      0.9440000             -0.5519254        
  3      0.3710000              0.1803736        
  4      0.1458000              0.6041549        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: V
data:
VANADIUM
S   21
  1 3321857.0000000             0.0000088        
  2 497435.6000000              0.0000687        
  3 113202.7000000              0.0003610        
  4  32063.3300000              0.0015221        
  5  10459.6200000              0.0055116        
  6   3775.5060000              0.0176685        
  7   1472.0400000              0.0503829        
  8    609.9331000              0.1248088        
  9    265.2634000              0.2517261        
 10    119.8607000              0.3592265        
 11     55.4489100              0.2741645        
 12     24.9837200              0.0648633        
 13     11.8805600             -0.0011662        
 14      5.6603110              0.0019828        
 15      2.4957030             -0.0009224        
 16      1.1778660              0.0004099        
 17      0.5200440             -0.0001702        
 18      0.1159650              0.0000789        
 19      0.0589380             -0.0000752        
 20      0.0269460              0.0000349        
 21      0.0107780             -0.0000085        
S   21
  1 3321857.0000000            -0.0000026        
  2 497435.6000000             -0.0000204        
  3 113202.7000000             -0.0001075        
  4  32063.3300000             -0.0004539        
  5  10459.6200000             -0.0016501        
  6   3775.5060000             -0.0053400        
  7   1472.0400000             -0.0155934        
  8    609.9331000             -0.0407234        
  9    265.2634000             -0.0920841        
 10    119.8607000             -0.1663647        
 11     55.4489100             -0.1858041        
 12     24.9837200              0.0458546        
 13     11.8805600              0.5080706        
 14      5.6603110              0.5069204        
 15      2.4957030              0.0943099        
 16      1.1778660             -0.0027022        
 17      0.5200440              0.0024007        
 18      0.1159650             -0.0006790        
 19      0.0589380              0.0006463        
 20      0.0269460             -0.0002988        
 21      0.0107780              0.0000727        
S   21
  1 3321857.0000000             0.0000010        
  2 497435.6000000              0.0000074        
  3 113202.7000000              0.0000389        
  4  32063.3300000              0.0001642        
  5  10459.6200000              0.0005967        
  6   3775.5060000              0.0019353        
  7   1472.0400000              0.0056582        
  8    609.9331000              0.0148922        
  9    265.2634000              0.0340407        
 10    119.8607000              0.0634934        
 11     55.4489100              0.0742181        
 12     24.9837200             -0.0190800        
 13     11.8805600             -0.2857174        
 14      5.6603110             -0.4524590        
 15      2.4957030              0.0900779        
 16      1.1778660              0.7250874        
 17      0.5200440              0.4230042        
 18      0.1159650              0.0204298        
 19      0.0589380             -0.0116477        
 20      0.0269460              0.0043226        
 21      0.0107780             -0.0009541        
S   21
  1 3321857.0000000            -0.0000002        
  2 497435.6000000             -0.0000017        
  3 113202.7000000             -0.0000092        
  4  32063.3300000             -0.0000387        
  5  10459.6200000             -0.0001408        
  6   3775.5060000             -0.0004567        
  7   1472.0400000             -0.0013356        
  8    609.9331000             -0.0035183        
  9    265.2634000             -0.0080547        
 10    119.8607000             -0.0150827        
 11     55.4489100             -0.0177395        
 12     24.9837200              0.0045536        
 13     11.8805600              0.0716582        
 14      5.6603110              0.1202978        
 15      2.4957030             -0.0329731        
 16      1.1778660             -0.2473306        
 17      0.5200440             -0.2854831        
 18      0.1159650              0.3533115        
 19      0.0589380              0.5907965        
 20      0.0269460              0.2222752        
 21      0.0107780              0.0040419        
S   21
  1 3321857.0000000             0.0000004        
  2 497435.6000000              0.0000033        
  3 113202.7000000              0.0000166        
  4  32063.3300000              0.0000731        
  5  10459.6200000              0.0002521        
  6   3775.5060000              0.0008723        
  7   1472.0400000              0.0023584        
  8    609.9331000              0.0068381        
  9    265.2634000              0.0138569        
 10    119.8607000              0.0306954        
 11     55.4489100              0.0261509        
 12     24.9837200              0.0087449        
 13     11.8805600             -0.1768010        
 14      5.6603110             -0.1591614        
 15      2.4957030             -0.0836276        
 16      1.1778660              1.0114782        
 17      0.5200440             -0.2280242        
 18      0.1159650             -2.2695010        
 19      0.0589380              1.6065987        
 20      0.0269460              0.3016373        
 21      0.0107780              0.1303343        
S   21
  1 3321857.0000000            -0.0000007        
  2 497435.6000000             -0.0000054        
  3 113202.7000000             -0.0000272        
  4  32063.3300000             -0.0001222        
  5  10459.6200000             -0.0004100        
  6   3775.5060000             -0.0014655        
  7   1472.0400000             -0.0038066        
  8    609.9331000             -0.0115934        
  9    265.2634000             -0.0220919        
 10    119.8607000             -0.0533435        
 11     55.4489100             -0.0382363        
 12     24.9837200             -0.0290722        
 13     11.8805600              0.3455982        
 14      5.6603110              0.2579282        
 15      2.4957030              0.0217532        
 16      1.1778660             -2.4028060        
 17      0.5200440              2.7076750        
 18      0.1159650             -0.2510840        
 19      0.0589380             -2.0254350        
 20      0.0269460              1.7930871        
 21      0.0107780             -0.0337238        
S   21
  1 3321857.0000000             0.0000007        
  2 497435.6000000              0.0000052        
  3 113202.7000000              0.0000291        
  4  32063.3300000              0.0001132        
  5  10459.6200000              0.0004553        
  6   3775.5060000              0.0013015        
  7   1472.0400000              0.0044392        
  8    609.9331000              0.0096860        
  9    265.2634000              0.0282013        
 10    119.8607000              0.0380197        
 11     55.4489100              0.0785707        
 12     24.9837200             -0.0683235        
 13     11.8805600             -0.1473641        
 14      5.6603110             -0.8290211        
 15      2.4957030              1.6312245        
 16      1.1778660              0.2319292        
 17      0.5200440             -2.1521470        
 18      0.1159650              4.8952066        
 19      0.0589380             -5.9635710        
 20      0.0269460              2.1703029        
 21      0.0107780              0.3787137        
S   21
  1 3321857.0000000            -0.0000010        
  2 497435.6000000             -0.0000068        
  3 113202.7000000             -0.0000415        
  4  32063.3300000             -0.0001445        
  5  10459.6200000             -0.0006669        
  6   3775.5060000             -0.0016013        
  7   1472.0400000             -0.0066923        
  8    609.9331000             -0.0112466        
  9    265.2634000             -0.0447482        
 10    119.8607000             -0.0365416        
 11     55.4489100             -0.1494322        
 12     24.9837200              0.1911058        
 13     11.8805600              0.0690568        
 14      5.6603110              1.6920091        
 15      2.4957030             -4.9696740        
 16      1.1778660              5.2939638        
 17      0.5200440             -2.3972030        
 18      0.1159650             -0.6675687        
 19      0.0589380              3.3872267        
 20      0.0269460             -4.3018660        
 21      0.0107780              2.2468474        
P   15
  1   5777.3770000              0.0001836        
  2   1368.6740000              0.0016111        
  3    444.1233000              0.0089331        
  4    169.0991000              0.0364077        
  5     71.1019100              0.1125593        
  6     31.9031100              0.2523889        
  7     14.8510900              0.3804875        
  8      7.0852270              0.3104782        
  9      3.3244220              0.0880803        
 10      1.5411640              0.0032000        
 11      0.6905200              0.0013680        
 12      0.2854240             -0.0003878        
 13      0.1141700              0.0002144        
 14      0.0456680             -0.0001028        
 15      0.0182670              0.0000321        
P   15
  1   5777.3770000             -0.0000641        
  2   1368.6740000             -0.0005626        
  3    444.1233000             -0.0031441        
  4    169.0991000             -0.0129556        
  5     71.1019100             -0.0413180        
  6     31.9031100             -0.0961060        
  7     14.8510900             -0.1545839        
  8      7.0852270             -0.1148758        
  9      3.3244220              0.1682576        
 10      1.5411640              0.4752220        
 11      0.6905200              0.4199565        
 12      0.2854240              0.1007152        
 13      0.1141700             -0.0016510        
 14      0.0456680              0.0027748        
 15      0.0182670             -0.0007462        
P   15
  1   5777.3770000              0.0000179        
  2   1368.6740000              0.0001583        
  3    444.1233000              0.0008760        
  4    169.0991000              0.0036529        
  5     71.1019100              0.0115437        
  6     31.9031100              0.0273536        
  7     14.8510900              0.0434320        
  8      7.0852270              0.0338294        
  9      3.3244220             -0.0611490        
 10      1.5411640             -0.1559635        
 11      0.6905200             -0.1942334        
 12      0.2854240              0.1212851        
 13      0.1141700              0.6800287        
 14      0.0456680              0.3252677        
 15      0.0182670              0.0164042        
P   15
  1   5777.3770000             -0.0000293        
  2   1368.6740000             -0.0002555        
  3    444.1233000             -0.0014369        
  4    169.0991000             -0.0058937        
  5     71.1019100             -0.0189794        
  6     31.9031100             -0.0440556        
  7     14.8510900             -0.0731849        
  8      7.0852270             -0.0542949        
  9      3.3244220              0.1039268        
 10      1.5411640              0.3508020        
 11      0.6905200              0.2145592        
 12      0.2854240             -0.9117910        
 13      0.1141700             -0.2994418        
 14      0.0456680              0.7938386        
 15      0.0182670              0.2405348        
P   15
  1   5777.3770000              0.0000376        
  2   1368.6740000              0.0003106        
  3    444.1233000              0.0018430        
  4    169.0991000              0.0071563        
  5     71.1019100              0.0244701        
  6     31.9031100              0.0528094        
  7     14.8510900              0.0989191        
  8      7.0852270              0.0620169        
  9      3.3244220             -0.1279437        
 10      1.5411640             -0.6480029        
 11      0.6905200              0.2664143        
 12      0.2854240              1.3780078        
 13      0.1141700             -1.6682250        
 14      0.0456680              0.3203251        
 15      0.0182670              0.6871914        
P   15
  1   5777.3770000             -0.0000574        
  2   1368.6740000             -0.0004796        
  3    444.1233000             -0.0028100        
  4    169.0991000             -0.0110448        
  5     71.1019100             -0.0372458        
  6     31.9031100             -0.0816956        
  7     14.8510900             -0.1530986        
  8      7.0852270             -0.1586369        
  9      3.3244220              0.4488084        
 10      1.5411640              1.2367060        
 11      0.6905200             -2.6900400        
 12      0.2854240              1.9075451        
 13      0.1141700             -0.1590524        
 14      0.0456680             -1.0926900        
 15      0.0182670              0.9569094        
P   15
  1   5777.3770000              0.0000472        
  2   1368.6740000              0.0007979        
  3    444.1233000              0.0023232        
  4    169.0991000              0.0187410        
  5     71.1019100              0.0291005        
  6     31.9031100              0.1583017        
  7     14.8510900              0.0546206        
  8      7.0852270              0.5486993        
  9      3.3244220             -2.0748220        
 10      1.5411640              1.8004150        
 11      0.6905200              0.1830578        
 12      0.2854240             -1.8887140        
 13      0.1141700              2.7107390        
 14      0.0456680             -2.5836200        
 15      0.0182670              1.3604979        
D   10
  1    155.8527000              0.0008240        
  2     46.4977100              0.0069079        
  3     17.6299900              0.0304612        
  4      7.3546720              0.0923449        
  5      3.2740510              0.1985696        
  6      1.4824820              0.2942780        
  7      0.6613510              0.3178236        
  8      0.2848260              0.2736146        
  9      0.1128990              0.1545784        
 10      0.0451600              0.0513788        
D   10
  1    155.8527000             -0.0007370        
  2     46.4977100             -0.0061568        
  3     17.6299900             -0.0274669        
  4      7.3546720             -0.0841448        
  5      3.2740510             -0.1807083        
  6      1.4824820             -0.2359404        
  7      0.6613510             -0.1545483        
  8      0.2848260              0.1934816        
  9      0.1128990              0.4609951        
 10      0.0451600              0.4154791        
D   10
  1    155.8527000              0.0011148        
  2     46.4977100              0.0094982        
  3     17.6299900              0.0421737        
  4      7.3546720              0.1348554        
  5      3.2740510              0.2748253        
  6      1.4824820              0.2709970        
  7      0.6613510             -0.1780122        
  8      0.2848260             -0.6524956        
  9      0.1128990             -0.0368649        
 10      0.0451600              0.7338086        
D   10
  1    155.8527000             -0.0016061        
  2     46.4977100             -0.0138562        
  3     17.6299900             -0.0622978        
  4      7.3546720             -0.2093158        
  5      3.2740510             -0.3859719        
  6      1.4824820             -0.0411623        
  7      0.6613510              0.9002036        
  8      0.2848260             -0.1729446        
  9      0.1128990             -1.0012050        
 10      0.0451600              0.9039410        
D   10
  1    155.8527000              0.0023587        
  2     46.4977100              0.0183836        
  3     17.6299900              0.0940223        
  4      7.3546720              0.3078765        
  5      3.2740510              0.4964665        
  6      1.4824820             -0.9372764        
  7      0.6613510             -0.2635308        
  8      0.2848260              1.5113702        
  9      0.1128990             -1.6483540        
 10      0.0451600              0.8627922        
F   6
  1      5.9066000              0.0410317        
  2      2.3412000              0.1605007        
  3      0.9279000              0.3918668        
  4      0.3678000              0.4681741        
  5      0.1458000              0.2329227        
  6      0.0578000              0.0387876        
F   6
  1      5.9066000             -0.1107858        
  2      2.3412000             -0.3830492        
  3      0.9279000             -0.4698632        
  4      0.3678000              0.2920987        
  5      0.1458000              0.5179218        
  6      0.0578000              0.1150943        
F   6
  1      5.9066000              0.2409833        
  2      2.3412000              0.5791615        
  3      0.9279000             -0.2682171        
  4      0.3678000             -0.6823265        
  5      0.1458000              0.6413831        
  6      0.0578000              0.2628693        
G   4
  1      3.3406000              0.0933634        
  2      1.3130000              0.3108378        
  3      0.5161000              0.4744850        
  4      0.2028000              0.2390582        
G   4
  1      3.3406000             -0.3410268        
  2      1.3130000             -0.5179423        
  3      0.5161000              0.1916713        
  4      0.2028000              0.5527966        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Cr
data:
CHROMIUM
S   21
  1 6177194.0000000             0.0000045        
  2 924929.5000000              0.0000352        
  3 210486.5000000              0.0001852        
  4  59620.0500000              0.0007817        
  5  19450.7600000              0.0028400        
  6   7022.0560000              0.0091912        
  7   2738.7630000              0.0268196        
  8   1135.8140000              0.0700666        
  9    495.0923000              0.1580229        
 10    224.7487000              0.2846801        
 11    105.3836000              0.3478419        
 12     50.1935900              0.2146960        
 13     22.2495700              0.0363913        
 14     10.9826500             -0.0023390        
 15      5.3836650              0.0015758        
 16      2.3436850             -0.0007032        
 17      1.1052020              0.0002840        
 18      0.4878480             -0.0001028        
 19      0.0895990              0.0000244        
 20      0.0334230             -0.0000169        
 21      0.0133690              0.0000060        
S   21
  1 6177194.0000000            -0.0000014        
  2 924929.5000000             -0.0000106        
  3 210486.5000000             -0.0000555        
  4  59620.0500000             -0.0002344        
  5  19450.7600000             -0.0008546        
  6   7022.0560000             -0.0027776        
  7   2738.7630000             -0.0082331        
  8   1135.8140000             -0.0221543        
  9    495.0923000             -0.0536442        
 10    224.7487000             -0.1108446        
 11    105.3836000             -0.1798118        
 12     50.1935900             -0.1532613        
 13     22.2495700              0.1570461        
 14     10.9826500              0.5579835        
 15      5.3836650              0.4064273        
 16      2.3436850              0.0548529        
 17      1.1052020             -0.0018377        
 18      0.4878480              0.0014536        
 19      0.0895990             -0.0000765        
 20      0.0334230              0.0002354        
 21      0.0133690             -0.0000462        
S   21
  1 6177194.0000000             0.0000005        
  2 924929.5000000              0.0000038        
  3 210486.5000000              0.0000201        
  4  59620.0500000              0.0000848        
  5  19450.7600000              0.0003098        
  6   7022.0560000              0.0010050        
  7   2738.7630000              0.0029926        
  8   1135.8140000              0.0080528        
  9    495.0923000              0.0197404        
 10    224.7487000              0.0412384        
 11    105.3836000              0.0698236        
 12     50.1935900              0.0619417        
 13     22.2495700             -0.0702821        
 14     10.9826500             -0.3520653        
 15      5.3836650             -0.3830360        
 16      2.3436850              0.2666097        
 17      1.1052020              0.7072440        
 18      0.4878480              0.3133199        
 19      0.0895990              0.0078553        
 20      0.0334230             -0.0036272        
 21      0.0133690              0.0010793        
S   21
  1 6177194.0000000            -0.0000001        
  2 924929.5000000             -0.0000009        
  3 210486.5000000             -0.0000048        
  4  59620.0500000             -0.0000200        
  5  19450.7600000             -0.0000739        
  6   7022.0560000             -0.0002366        
  7   2738.7630000             -0.0007161        
  8   1135.8140000             -0.0018906        
  9    495.0923000             -0.0047509        
 10    224.7487000             -0.0096465        
 11    105.3836000             -0.0171280        
 12     50.1935900             -0.0139696        
 13     22.2495700              0.0146851        
 14     10.9826500              0.0957589        
 15      5.3836650              0.0929153        
 16      2.3436850             -0.0669435        
 17      1.1052020             -0.3057681        
 18      0.4878480             -0.1700677        
 19      0.0895990              0.7452787        
 20      0.0334230              0.3968427        
 21      0.0133690              0.0052854        
S   21
  1 6177194.0000000             0.0000002        
  2 924929.5000000              0.0000016        
  3 210486.5000000              0.0000092        
  4  59620.0500000              0.0000357        
  5  19450.7600000              0.0001447        
  6   7022.0560000              0.0004123        
  7   2738.7630000              0.0014331        
  8   1135.8140000              0.0031937        
  9    495.0923000              0.0098357        
 10    224.7487000              0.0152610        
 11    105.3836000              0.0388736        
 12     50.1935900              0.0110289        
 13     22.2495700              0.0111926        
 14     10.9826500             -0.2755075        
 15      5.3836650             -0.0244757        
 16      2.3436850             -0.1402895        
 17      1.1052020              1.3913639        
 18      0.4878480             -0.9758837        
 19      0.0895990             -1.4188350        
 20      0.0334230              1.7184583        
 21      0.0133690             -0.1521812        
S   21
  1 6177194.0000000            -0.0000004        
  2 924929.5000000             -0.0000027        
  3 210486.5000000             -0.0000147        
  4  59620.0500000             -0.0000585        
  5  19450.7600000             -0.0002294        
  6   7022.0560000             -0.0006823        
  7   2738.7630000             -0.0022555        
  8   1135.8140000             -0.0053539        
  9    495.0923000             -0.0153230        
 10    224.7487000             -0.0263623        
 11    105.3836000             -0.0591042        
 12     50.1935900             -0.0275075        
 13     22.2495700              0.0060714        
 14     10.9826500              0.4188579        
 15      5.3836650              0.1835805        
 16      2.3436850             -0.3467947        
 17      1.1052020             -1.9822110        
 18      0.4878480              2.8306916        
 19      0.0895990             -1.9394060        
 20      0.0334230              0.8905060        
 21      0.0133690              0.3355072        
S   21
  1 6177194.0000000             0.0000006        
  2 924929.5000000              0.0000050        
  3 210486.5000000              0.0000220        
  4  59620.0500000              0.0001154        
  5  19450.7600000              0.0003176        
  6   7022.0560000              0.0014452        
  7   2738.7630000              0.0028196        
  8   1135.8140000              0.0124319        
  9    495.0923000              0.0161504        
 10    224.7487000              0.0729922        
 11    105.3836000              0.0328159        
 12     50.1935900              0.2042142        
 13     22.2495700             -0.4066511        
 14     10.9826500             -0.0059639        
 15      5.3836650             -1.9348500        
 16      2.3436850              6.1393726        
 17      1.1052020             -6.5854110        
 18      0.4878480              2.8140449        
 19      0.0895990             -0.0375438        
 20      0.0334230             -1.1109460        
 21      0.0133690              1.0523679        
S   21
  1 6177194.0000000            -0.0000012        
  2 924929.5000000             -0.0000057        
  3 210486.5000000             -0.0000568        
  4  59620.0500000             -0.0000907        
  5  19450.7600000             -0.0010163        
  6   7022.0560000             -0.0005727        
  7   2738.7630000             -0.0115391        
  8   1135.8140000              0.0008235        
  9    495.0923000             -0.0944889        
 10    224.7487000              0.0584811        
 11    105.3836000             -0.5273241        
 12     50.1935900              0.6649044        
 13     22.2495700             -1.9525110        
 14     10.9826500              7.6291413        
 15      5.3836650            -11.9015400        
 16      2.3436850             10.9201510        
 17      1.1052020             -6.8143980        
 18      0.4878480              2.2547552        
 19      0.0895990             -0.4055322        
 20      0.0334230              0.0913183        
 21      0.0133690              0.0712628        
P   15
  1   6268.9210000              0.0001874        
  2   1485.1180000              0.0016443        
  3    481.9146000              0.0091208        
  4    183.5142000              0.0371965        
  5     77.1900500              0.1149261        
  6     34.6517800              0.2569294        
  7     16.1484600              0.3833594        
  8      7.7109390              0.3047354        
  9      3.6071540              0.0824344        
 10      1.6673620              0.0027362        
 11      0.7390880              0.0014572        
 12      0.3013260             -0.0003291        
 13      0.1205300              0.0002283        
 14      0.0482120             -0.0001021        
 15      0.0192850              0.0000322        
P   15
  1   6268.9210000             -0.0000656        
  2   1485.1180000             -0.0005756        
  3    481.9146000             -0.0032204        
  4    183.5142000             -0.0132776        
  5     77.1900500             -0.0423771        
  6     34.6517800             -0.0983383        
  7     16.1484600             -0.1569767        
  8      7.7109390             -0.1086111        
  9      3.6071540              0.1848507        
 10      1.6673620              0.4759648        
 11      0.7390880              0.4067230        
 12      0.3013260              0.1021274        
 13      0.1205300             -0.0015565        
 14      0.0482120              0.0027535        
 15      0.0192850             -0.0007733        
P   15
  1   6268.9210000              0.0000211        
  2   1485.1180000              0.0001861        
  3    481.9146000              0.0010381        
  4    183.5142000              0.0043020        
  5     77.1900500              0.0137115        
  6     34.6517800              0.0321288        
  7     16.1484600              0.0514440        
  8      7.7109390              0.0359673        
  9      3.6071540             -0.0764223        
 10      1.6673620             -0.1942220        
 11      0.7390880             -0.1856082        
 12      0.3013260              0.2010582        
 13      0.1205300              0.6865246        
 14      0.0482120              0.2606775        
 15      0.0192850              0.0017175        
P   15
  1   6268.9210000             -0.0000428        
  2   1485.1180000             -0.0003679        
  3    481.9146000             -0.0021020        
  4    183.5142000             -0.0085030        
  5     77.1900500             -0.0278731        
  6     34.6517800             -0.0633242        
  7     16.1484600             -0.1082859        
  8      7.7109390             -0.0706248        
  9      3.6071540              0.1767090        
 10      1.6673620              0.5708496        
 11      0.7390880             -0.0357080        
 12      0.3013260             -1.2560130        
 13      0.1205300              0.4045846        
 14      0.0482120              0.5870991        
 15      0.0192850              0.0068897        
P   15
  1   6268.9210000              0.0000490        
  2   1485.1180000              0.0004152        
  3    481.9146000              0.0024043        
  4    183.5142000              0.0096004        
  5     77.1900500              0.0319684        
  6     34.6517800              0.0714264        
  7     16.1484600              0.1291633        
  8      7.7109390              0.1006006        
  9      3.6071540             -0.3421204        
 10      1.6673620             -0.8354989        
 11      0.7390880              1.4164378        
 12      0.3013260             -0.0497432        
 13      0.1205300             -1.3359980        
 14      0.0482120              0.9781556        
 15      0.0192850              0.2577832        
P   15
  1   6268.9210000             -0.0000511        
  2   1485.1180000             -0.0005176        
  3    481.9146000             -0.0025087        
  4    183.5142000             -0.0120257        
  5     77.1900500             -0.0329019        
  6     34.6517800             -0.0934099        
  7     16.1484600             -0.1241411        
  8      7.7109390             -0.2137930        
  9      3.6071540              0.8366523        
 10      1.6673620              0.3460058        
 11      0.7390880             -2.1248310        
 12      0.3013260              2.4811644        
 13      0.1205300             -1.4834690        
 14      0.0482120             -0.1046105        
 15      0.0192850              0.8288056        
P   15
  1   6268.9210000              0.0000653        
  2   1485.1180000              0.0008809        
  3    481.9146000              0.0032574        
  4    183.5142000              0.0207472        
  5     77.1900500              0.0425665        
  6     34.6517800              0.1715203        
  7     16.1484600              0.1445712        
  8      7.7109390              0.3909267        
  9      3.6071540             -2.4203680        
 10      1.6673620              3.0695118        
 11      0.7390880             -1.5957140        
 12      0.3013260             -0.2690832        
 13      0.1205300              1.5882811        
 14      0.0482120             -2.0707520        
 15      0.0192850              1.2990116        
D   10
  1    150.8341000              0.00118076       
  2     44.9972300              0.00966118       
  3     16.9608800              0.04140729       
  4      7.0401540              0.12131664       
  5      3.1038780              0.24095388       
  6      1.3758960              0.32484954       
  7      0.5922820              0.32060330       
  8      0.2421380              0.23605297       
  9      0.0912840              0.09618844       
 10      0.0365140              0.24331100       
D   10
  1    150.8341000             -0.0007317        
  2     44.9972300             -0.0059386        
  3     16.9608800             -0.0258810        
  4      7.0401540             -0.0761518        
  5      3.1038780             -0.1505949        
  6      1.3758960             -0.1687159        
  7      0.5922820             -0.0719464        
  8      0.2421380              0.1991270        
  9      0.0912840              0.30980514       
 10      0.0365140              0.61183718       
D   10
  1    150.8341000              0.00147093       
  2     44.9972300              0.01221628       
  3     16.9608800              0.05281196       
  4      7.0401540              0.16199100       
  5      3.1038780              0.29357778       
  6      1.3758960              0.23847460       
  7      0.5922820             -0.23308910       
  8      0.2421380             -0.56415040       
  9      0.0912840             -0.18723120       
 10      0.0365140              0.71568988       
D   10
  1    150.8341000             -0.0019819        
  2     44.9972300             -0.0163386        
  3     16.9608800             -0.0729836        
  4      7.0401540             -0.2303703        
  5      3.1038780             -0.3680624        
  6      1.3758960              0.09367552       
  7      0.5922820              0.77748431       
  8      0.2421380             -0.1650367        
  9      0.0912840             -0.9983717        
 10      0.0365140              0.83634879       
D   10
  1    150.8341000              0.00293042       
  2     44.9972300              0.02400180       
  3     16.9608800              0.11269289       
  4      7.0401540              0.37251217       
  5      3.1038780              0.35632893       
  6      1.3758960             -0.9766277        
  7      0.5922820              0.00841508       
  8      0.2421380              1.2010561        
  9      0.0912840             -1.4641630        
 10      0.0365140              0.77260007       
F   6
  1      7.7139000              0.0390498        
  2      3.0575000              0.1680515        
  3      1.2119000              0.4050147        
  4      0.4803000              0.4507865        
  5      0.1904000              0.2276147        
  6      0.0755000              0.0535853        
F   6
  1      7.7139000             -0.0921689        
  2      3.0575000             -0.3609068        
  3      1.2119000             -0.4559056        
  4      0.4803000              0.2474949        
  5      0.1904000              0.5182729        
  6      0.0755000              0.1928989        
F   6
  1      7.7139000              0.2047374        
  2      3.0575000              0.5745754        
  3      1.2119000             -0.1714447        
  4      0.4803000             -0.6972531        
  5      0.1904000              0.4574673        
  6      0.0755000              0.4196485        
G   4
  1      4.3627000              0.0989929        
  2      1.7148000              0.3775771        
  3      0.6740000              0.5231325        
  4      0.2649000              0.2998733        
G   4
  1      4.3627000              0.2562285        
  2      1.7148000              0.4334279        
  3      0.6740000             -0.1214369        
  4      0.2649000             -0.4941415        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Mn
data:
MANGANESE
S   21
  1 3960805.0000000             0.0000087        
  2 593115.5000000              0.0000680        
  3 134976.8000000              0.0003574        
  4  38230.6700000              0.0015071        
  5  12471.5400000              0.0054576        
  6   4501.7430000              0.0174997        
  7   1755.2120000              0.0499351        
  8    727.3039000              0.1238807        
  9    316.3678000              0.2504969        
 10    143.0098000              0.3589592        
 11     66.2180500              0.2759017        
 12     29.9189600              0.0659604        
 13     14.3031800             -0.0012372        
 14      6.8394510              0.0019563        
 15      3.0123740             -0.0009071        
 16      1.4188080              0.0003975        
 17      0.6236240             -0.0001593        
 18      0.1340980              0.0000683        
 19      0.0655480             -0.0000647        
 20      0.0295840              0.0000313        
 21      0.0118340             -0.0000079        
S   21
  1 3960805.0000000            -0.0000026        
  2 593115.5000000             -0.0000205        
  3 134976.8000000             -0.0001078        
  4  38230.6700000             -0.0004553        
  5  12471.5400000             -0.0016552        
  6   4501.7430000             -0.0053576        
  7   1755.2120000             -0.0156566        
  8    727.3039000             -0.0409510        
  9    316.3678000             -0.0928723        
 10    143.0098000             -0.1684245        
 11     66.2180500             -0.1891878        
 12     29.9189600              0.0461651        
 13     14.3031800              0.5147184        
 14      6.8394510              0.5041849        
 15      3.0123740              0.0918606        
 16      1.4188080             -0.0025870        
 17      0.6236240              0.0023080        
 18      0.1340980             -0.0005992        
 19      0.0655480              0.0005684        
 20      0.0295840             -0.0002737        
 21      0.0118340              0.0000689        
S   21
  1 3960805.0000000             0.0000010        
  2 593115.5000000              0.0000075        
  3 134976.8000000              0.0000396        
  4  38230.6700000              0.0001675        
  5  12471.5400000              0.0006084        
  6   4501.7430000              0.0019744        
  7   1755.2120000              0.0057753        
  8    727.3039000              0.0152335        
  9    316.3678000              0.0349202        
 10    143.0098000              0.0654877        
 11     66.2180500              0.0770240        
 12     29.9189600             -0.0195455        
 13     14.3031800             -0.3005826        
 14      6.8394510             -0.4562535        
 15      3.0123740              0.1202727        
 16      1.4188080              0.7281293        
 17      0.6236240              0.4032453        
 18      0.1340980              0.0177961        
 19      0.0655480             -0.0101819        
 20      0.0295840              0.0040037        
 21      0.0118340             -0.0009240        
S   21
  1 3960805.0000000            -0.0000002        
  2 593115.5000000             -0.0000018        
  3 134976.8000000             -0.0000094        
  4  38230.6700000             -0.0000398        
  5  12471.5400000             -0.0001445        
  6   4501.7430000             -0.0004699        
  7   1755.2120000             -0.0013712        
  8    727.3039000             -0.0036322        
  9    316.3678000             -0.0083049        
 10    143.0098000             -0.0157294        
 11     66.2180500             -0.0184252        
 12     29.9189600              0.0043673        
 13     14.3031800              0.0769605        
 14      6.8394510              0.1210388        
 15      3.0123740             -0.0396616        
 16      1.4188080             -0.2631384        
 17      0.6236240             -0.2629456        
 18      0.1340980              0.4329907        
 19      0.0655480              0.5464339        
 20      0.0295840              0.1906748        
 21      0.0118340             -0.0002215        
S   21
  1 3960805.0000000             0.0000004        
  2 593115.5000000              0.0000028        
  3 134976.8000000              0.0000142        
  4  38230.6700000              0.0000622        
  5  12471.5400000              0.0002166        
  6   4501.7430000              0.0007407        
  7   1755.2120000              0.0020337        
  8    727.3039000              0.0058033        
  9    316.3678000              0.0120735        
 10    143.0098000              0.0260455        
 11     66.2180500              0.0238516        
 12     29.9189600              0.0048529        
 13     14.3031800             -0.1473013        
 14      6.8394510             -0.1459495        
 15      3.0123740             -0.0354716        
 16      1.4188080              0.7785170        
 17      0.6236240             -0.0807084        
 18      0.1340980             -2.0465300        
 19      0.0655480              1.2305396        
 20      0.0295840              0.5446708        
 21      0.0118340              0.0886842        
S   21
  1 3960805.0000000            -0.0000007        
  2 593115.5000000             -0.0000058        
  3 134976.8000000             -0.0000288        
  4  38230.6700000             -0.0001299        
  5  12471.5400000             -0.0004351        
  6   4501.7430000             -0.0015590        
  7   1755.2120000             -0.0040421        
  8    727.3039000             -0.0123698        
  9    316.3678000             -0.0235615        
 10    143.0098000             -0.0574136        
 11     66.2180500             -0.0411084        
 12     29.9189600             -0.0323033        
 13     14.3031800              0.3776811        
 14      6.8394510              0.2609431        
 15      3.0123740             -0.0050120        
 16      1.4188080             -2.4326520        
 17      0.6236240              2.7044847        
 18      0.1340980             -0.1886359        
 19      0.0655480             -1.9844750        
 20      0.0295840              1.8106923        
 21      0.0118340             -0.1521510        
S   21
  1 3960805.0000000             0.0000009        
  2 593115.5000000              0.0000063        
  3 134976.8000000              0.0000362        
  4  38230.6700000              0.0001344        
  5  12471.5400000              0.0005735        
  6   4501.7430000              0.0015221        
  7   1755.2120000              0.0056710        
  8    727.3039000              0.0110890        
  9    316.3678000              0.0370310        
 10    143.0098000              0.0408104        
 11     66.2180500              0.1135902        
 12     29.9189600             -0.1239324        
 13     14.3031800             -0.1093955        
 14      6.8394510             -1.2249610        
 15      3.0123740              2.7650131        
 16      1.4188080             -1.1481330        
 17      0.6236240             -1.3280140        
 18      0.1340980              4.4658121        
 19      0.0655480             -6.1545830        
 20      0.0295840              3.0596419        
 21      0.0118340             -0.1784082        
S   21
  1 3960805.0000000            -0.0000010        
  2 593115.5000000             -0.0000074        
  3 134976.8000000             -0.0000425        
  4  38230.6700000             -0.0001583        
  5  12471.5400000             -0.0006729        
  6   4501.7430000             -0.0017995        
  7   1755.2120000             -0.0066425        
  8    727.3039000             -0.0132033        
  9    316.3678000             -0.0434664        
 10    143.0098000             -0.0500572        
 11     66.2180500             -0.1339672        
 12     29.9189600              0.1360609        
 13     14.3031800              0.2718930        
 14      6.8394510              1.4745861        
 15      3.0123740             -5.2458310        
 16      1.4188080              6.3171533        
 17      0.6236240             -3.5660270        
 18      0.1340980              1.5693211        
 19      0.0655480              0.0507678        
 20      0.0295840             -2.1748540        
 21      0.0118340              1.7203416        
P   15
  1   7048.2710000              0.0001784        
  2   1669.6780000              0.0015668        
  3    541.8571000              0.0087154        
  4    206.4295000              0.0357161        
  5     86.8933400              0.1112153        
  6     39.0630900              0.2516051        
  7     18.2472500              0.3812308        
  8      8.7412890              0.3102902        
  9      4.1193320              0.0881207        
 10      1.9148040              0.0035990        
 11      0.8578930              0.0014521        
 12      0.3549500             -0.0003342        
 13      0.1419800              0.0002060        
 14      0.0567920             -0.0000973        
 15      0.0227170              0.0000303        
P   15
  1   7048.2710000             -0.0000639        
  2   1669.6780000             -0.0005610        
  3    541.8571000             -0.0031465        
  4    206.4295000             -0.0130398        
  5     86.8933400             -0.0419216        
  6     39.0630900             -0.0985734        
  7     18.2472500             -0.1596252        
  8      8.7412890             -0.1150729        
  9      4.1193320              0.1770515        
 10      1.9148040              0.4773779        
 11      0.8578930              0.4126450        
 12      0.3549500              0.0994866        
 13      0.1419800             -0.0015978        
 14      0.0567920              0.0026783        
 15      0.0227170             -0.0007155        
P   15
  1   7048.2710000              0.0000176        
  2   1669.6780000              0.0001560        
  3    541.8571000              0.0008697        
  4    206.4295000              0.0036328        
  5     86.8933400              0.0116242        
  6     39.0630900              0.0277021        
  7     18.2472500              0.0447071        
  8      8.7412890              0.0330480        
  9      4.1193320             -0.0626066        
 10      1.9148040             -0.1610873        
 11      0.8578930             -0.1769052        
 12      0.3549500              0.1209127        
 13      0.1419800              0.6442919        
 14      0.0567920              0.3582730        
 15      0.0227170              0.0197249        
P   15
  1   7048.2710000             -0.0000352        
  2   1669.6780000             -0.0003059        
  3    541.8571000             -0.0017361        
  4    206.4295000             -0.0071221        
  5     86.8933400             -0.0232595        
  6     39.0630900             -0.0541806        
  7     18.2472500             -0.0919950        
  8      8.7412890             -0.0671771        
  9      4.1193320              0.1377723        
 10      1.9148040              0.4688822        
 11      0.8578930              0.1020817        
 12      0.3549500             -1.0459610        
 13      0.1419800             -0.0694511        
 14      0.0567920              0.6881997        
 15      0.0227170              0.1821433        
P   15
  1   7048.2710000              0.0000383        
  2   1669.6780000              0.0003235        
  3    541.8571000              0.0018862        
  4    206.4295000              0.0075297        
  5     86.8933400              0.0253564        
  6     39.0630900              0.0569488        
  7     18.2472500              0.1035302        
  8      8.7412890              0.0787265        
  9      4.1193320             -0.1922694        
 10      1.9148040             -0.6913723        
 11      0.8578930              0.6148777        
 12      0.3549500              0.9207736        
 13      0.1419800             -1.5153770        
 14      0.0567920              0.3682492        
 15      0.0227170              0.7016079        
P   15
  1   7048.2710000             -0.0000547        
  2   1669.6780000             -0.0005149        
  3    541.8571000             -0.0026997        
  4    206.4295000             -0.0120236        
  5     86.8933400             -0.0360764        
  6     39.0630900             -0.0933107        
  7     18.2472500             -0.1416660        
  8      8.7412890             -0.2086819        
  9      4.1193320              0.6710510        
 10      1.9148040              0.8461802        
 11      0.8578930             -2.4352280        
 12      0.3549500              1.9381038        
 13      0.1419800             -0.2709080        
 14      0.0567920             -1.0654360        
 15      0.0227170              0.9985921        
P   15
  1   7048.2710000              0.0000540        
  2   1669.6780000              0.0008003        
  3    541.8571000              0.0026830        
  4    206.4295000              0.0189338        
  5     86.8933400              0.0348568        
  6     39.0630900              0.1597768        
  7     18.2472500              0.1021350        
  8      8.7412890              0.5043990        
  9      4.1193320             -2.2679050        
 10      1.9148040              2.3112011        
 11      0.8578930             -0.3941252        
 12      0.3549500             -1.4844400        
 13      0.1419800              2.4865239        
 14      0.0567920             -2.4481300        
 15      0.0227170              1.2827484        
D   10
  1    199.8357000              0.0008689        
  2     59.7217600              0.0074055        
  3     22.7477200              0.0334354        
  4      9.5650030              0.1022231        
  5      4.2854990              0.2176382        
  6      1.9509750              0.3138865        
  7      0.8727960              0.3226514        
  8      0.3756210              0.2489774        
  9      0.1480090              0.1155548        
 10      0.0592040              0.0397805        
D   10
  1    199.8357000             -0.0006141        
  2     59.7217600             -0.0051723        
  3     22.7477200             -0.0237547        
  4      9.5650030             -0.0726328        
  5      4.2854990             -0.1584041        
  6      1.9509750             -0.2022489        
  7      0.8727960             -0.1223759        
  8      0.3756210              0.1954530        
  9      0.1480090              0.3978832        
 10      0.0592040              0.5143697        
D   10
  1    199.8357000              0.0012453        
  2     59.7217600              0.0108402        
  3     22.7477200              0.0491838        
  4      9.5650030              0.1600817        
  5      4.2854990              0.3201419        
  6      1.9509750              0.2665074        
  7      0.8727960             -0.2815251        
  8      0.3756210             -0.5757098        
  9      0.1480090             -0.0703426        
 10      0.0592040              0.6737332        
D   10
  1    199.8357000             -0.0014435        
  2     59.7217600             -0.0124306        
  3     22.7477200             -0.0580733        
  4      9.5650030             -0.1953527        
  5      4.2854990             -0.3745566        
  6      1.9509750              0.0487524        
  7      0.8727960              0.7802224        
  8      0.3756210             -0.1124107        
  9      0.1480090             -1.1042480        
 10      0.0592040              0.9709894        
D   10
  1    199.8357000              0.0022258        
  2     59.7217600              0.0189888        
  3     22.7477200              0.0923256        
  4      9.5650030              0.3320502        
  5      4.2854990              0.5002171        
  6      1.9509750             -1.0197630        
  7      0.8727960             -0.1646050        
  8      0.3756210              1.4349364        
  9      0.1480090             -1.5662240        
 10      0.0592040              0.7879875        
F   6
  1      9.5413000              0.0349852        
  2      3.7818000              0.1597661        
  3      1.4990000              0.3964869        
  4      0.5941000              0.4551561        
  5      0.2355000              0.2397760        
  6      0.0933000              0.0566387        
F   6
  1      9.5413000             -0.0802442        
  2      3.7818000             -0.3483093        
  3      1.4990000             -0.4783902        
  4      0.5941000              0.2256018        
  5      0.2355000              0.5299708        
  6      0.0933000              0.1921441        
F   6
  1      9.5413000              0.1657279        
  2      3.7818000              0.5743776        
  3      1.4990000             -0.1019929        
  4      0.5941000             -0.7524029        
  5      0.2355000              0.4528616        
  6      0.0933000              0.4355518        
G   4
  1      5.3963000              0.0817002        
  2      2.1210000              0.3454071        
  3      0.8337000              0.5293068        
  4      0.3277000              0.3401254        
G   4
  1      5.3963000             -0.3031187        
  2      2.1210000             -0.6066715        
  3      0.8337000              0.1118580        
  4      0.3277000              0.6521647        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Fe
data:
IRON
S   21
  1 4316265.0000000             0.0000087        
  2 646342.4000000              0.0000676        
  3 147089.7000000              0.0003551        
  4  41661.5200000              0.0014976        
  5  13590.7700000              0.0054237        
  6   4905.7500000              0.0173950        
  7   1912.7460000              0.0496629        
  8    792.6043000              0.1233557        
  9    344.8065000              0.2500229        
 10    155.8999000              0.3599037        
 11     72.2309100              0.2789928        
 12     32.7250600              0.0668486        
 13     15.6676200             -0.0053045        
 14      7.5034830             -0.0021942        
 15      3.3122230             -0.0015672        
 16      1.5584710              0.0007006        
 17      0.6839140             -0.0000133        
 18      0.1467570              0.0000758        
 19      0.0705830             -0.0000682        
 20      0.0314490              0.0000329        
 21      0.0125800             -0.0000084        
S   21
  1 4316265.0000000            -0.0000026        
  2 646342.4000000             -0.0000202        
  3 147089.7000000             -0.0001065        
  4  41661.5200000             -0.0004495        
  5  13590.7700000             -0.0016347        
  6   4905.7500000             -0.0052934        
  7   1912.7460000             -0.0154862        
  8    792.6043000             -0.0405985        
  9    344.8065000             -0.0925040        
 10    155.8999000             -0.1690500        
 11     72.2309100             -0.1922840        
 12     32.7250600              0.0453208        
 13     15.6676200              0.5291912        
 14      7.5034830              0.5261370        
 15      3.3122230              0.0863404        
 16      1.5584710             -0.0366666        
 17      0.6839140             -0.0164420        
 18      0.1467570             -0.0013802        
 19      0.0705830              0.0009867        
 20      0.0314490             -0.0004385        
 21      0.0125800              0.0001090        
S   21
  1 4316265.0000000             0.0000009        
  2 646342.4000000              0.0000066        
  3 147089.7000000              0.0000347        
  4  41661.5200000              0.0001467        
  5  13590.7700000              0.0005329        
  6   4905.7500000              0.0017304        
  7   1912.7460000              0.0050648        
  8    792.6043000              0.0133892        
  9    344.8065000              0.0308025        
 10    155.8999000              0.0582183        
 11     72.2309100              0.0693866        
 12     32.7250600             -0.0166827        
 13     15.6676200             -0.2807190        
 14      7.5034830             -0.4350295        
 15      3.3122230              0.1310265        
 16      1.5584710              0.7287152        
 17      0.6839140              0.3985276        
 18      0.1467570              0.0173397        
 19      0.0705830             -0.0096616        
 20      0.0314490              0.0038520        
 21      0.0125800             -0.0009097        
S   21
  1 4316265.0000000            -0.0000002        
  2 646342.4000000             -0.0000018        
  3 147089.7000000             -0.0000094        
  4  41661.5200000             -0.0000397        
  5  13590.7700000             -0.0001438        
  6   4905.7500000             -0.0004680        
  7   1912.7460000             -0.0013658        
  8    792.6043000             -0.0036226        
  9    344.8065000             -0.0082964        
 10    155.8999000             -0.0157706        
 11     72.2309100             -0.0185872        
 12     32.7250600              0.0041036        
 13     15.6676200              0.0775940        
 14      7.5034830              0.1205449        
 15      3.3122230             -0.0409131        
 16      1.5584710             -0.2624671        
 17      0.6839140             -0.2576817        
 18      0.1467570              0.4333976        
 19      0.0705830              0.5466256        
 20      0.0314490              0.1874711        
 21      0.0125800              0.0027048        
S   21
  1 4316265.0000000             0.0000004        
  2 646342.4000000              0.0000027        
  3 147089.7000000              0.0000140        
  4  41661.5200000              0.0000611        
  5  13590.7700000              0.0002133        
  6   4905.7500000              0.0007277        
  7   1912.7460000              0.0020047        
  8    792.6043000              0.0057061        
  9    344.8065000              0.0119517        
 10    155.8999000              0.0256976        
 11     72.2309100              0.0240385        
 12     32.7250600              0.0046102        
 13     15.6676200             -0.1450720        
 14      7.5034830             -0.1470185        
 15      3.3122230             -0.0228404        
 16      1.5584710              0.7495812        
 17      0.6839140             -0.0772963        
 18      0.1467570             -1.9280090        
 19      0.0705830              1.0656945        
 20      0.0314490              0.6085632        
 21      0.0125800              0.0919606        
S   21
  1 4316265.0000000            -0.0000007        
  2 646342.4000000             -0.0000057        
  3 147089.7000000             -0.0000287        
  4  41661.5200000             -0.0001281        
  5  13590.7700000             -0.0004333        
  6   4905.7500000             -0.0015352        
  7   1912.7460000             -0.0040396        
  8    792.6043000             -0.0121633        
  9    344.8065000             -0.0237436        
 10    155.8999000             -0.0563141        
 11     72.2309100             -0.0434858        
 12     32.7250600             -0.0274669        
 13     15.6676200              0.3585423        
 14      7.5034830              0.2972373        
 15      3.3122230             -0.0556067        
 16      1.5584710             -2.3578630        
 17      0.6839140              2.6221971        
 18      0.1467570             -0.0969618        
 19      0.0705830             -1.9910490        
 20      0.0314490              1.7209050        
 21      0.0125800             -0.1005195        
S   21
  1 4316265.0000000             0.0000008        
  2 646342.4000000              0.0000059        
  3 147089.7000000              0.0000339        
  4  41661.5200000              0.0001263        
  5  13590.7700000              0.0005368        
  6   4905.7500000              0.0014320        
  7   1912.7460000              0.0053052        
  8    792.6043000              0.0104625        
  9    344.8065000              0.0346655        
 10    155.8999000              0.0388131        
 11     72.2309100              0.1064066        
 12     32.7250600             -0.1142585        
 13     15.6676200             -0.0805555        
 14      7.5034830             -1.2213390        
 15      3.3122230              2.6254050        
 16      1.5584710             -0.9638793        
 17      0.6839140             -1.3981920        
 18      0.1467570              4.1494727        
 19      0.0705830             -5.4097490        
 20      0.0314490              2.3564495        
 21      0.0125800              0.1273023        
S   21
  1 4316265.0000000            -0.0000010        
  2 646342.4000000             -0.0000070        
  3 147089.7000000             -0.0000407        
  4  41661.5200000             -0.0001507        
  5  13590.7700000             -0.0006437        
  6   4905.7500000             -0.0017117        
  7   1912.7460000             -0.0063667        
  8    792.6043000             -0.0125269        
  9    344.8065000             -0.0417984        
 10    155.8999000             -0.0470446        
 11     72.2309100             -0.1300846        
 12     32.7250600              0.1353657        
 13     15.6676200              0.1662885        
 14      7.5034830              1.7057170        
 15      3.3122230             -5.3976890        
 16      1.5584710              6.1815820        
 17      0.6839140             -3.2615050        
 18      0.1467570              0.9003280        
 19      0.0705830              0.9972315        
 20      0.0314490             -2.7522480        
 21      0.0125800              1.8620910        
P   15
  1   7721.4890000              0.0001794        
  2   1829.1260000              0.0015765        
  3    593.6280000              0.0087821        
  4    226.2054000              0.0360777        
  5     95.2614500              0.1127293        
  6     42.8592000              0.2560928        
  7     20.0497100              0.3890943        
  8      9.6208850              0.3151303        
  9      4.5413710              0.0789275        
 10      2.1135000             -0.0195952        
 11      0.9472010             -0.0183793        
 12      0.3912430             -0.0050537        
 13      0.1564970              0.0002794        
 14      0.0625990             -0.0002231        
 15      0.0250400              0.0000638        
P   15
  1   7721.4890000             -0.0000553        
  2   1829.1260000             -0.0004858        
  3    593.6280000             -0.0027322        
  4    226.2054000             -0.0113692        
  5     95.2614500             -0.0368480        
  6     42.8592000             -0.0875078        
  7     20.0497100             -0.1433072        
  8      9.6208850             -0.0997609        
  9      4.5413710              0.1857857        
 10      2.1135000              0.4790901        
 11      0.9472010              0.4081510        
 12      0.3912430              0.0975033        
 13      0.1564970             -0.0015518        
 14      0.0625990              0.0026314        
 15      0.0250400             -0.0007026        
P   15
  1   7721.4890000              0.0000183        
  2   1829.1260000              0.0001614        
  3    593.6280000              0.0009023        
  4    226.2054000              0.0037727        
  5     95.2614500              0.0121351        
  6     42.8592000              0.0289886        
  7     20.0497100              0.0470814        
  8      9.6208850              0.0339563        
  9      4.5413710             -0.0672107        
 10      2.1135000             -0.1728765        
 11      0.9472010             -0.1662075        
 12      0.3912430              0.1458974        
 13      0.1564970              0.6117855        
 14      0.0625990              0.3592589        
 15      0.0250400              0.0407356        
P   15
  1   7721.4890000             -0.0000346        
  2   1829.1260000             -0.0003021        
  3    593.6280000             -0.0017071        
  4    226.2054000             -0.0070639        
  5     95.2614500             -0.0230082        
  6     42.8592000             -0.0542434        
  7     20.0497100             -0.0911168        
  8      9.6208850             -0.0677305        
  9      4.5413710              0.1481274        
 10      2.1135000              0.4603701        
 11      0.9472010              0.0391571        
 12      0.3912430             -0.9133288        
 13      0.1564970             -0.1569658        
 14      0.0625990              0.6400545        
 15      0.0250400              0.2835988        
P   15
  1   7721.4890000              0.0000399        
  2   1829.1260000              0.0003485        
  3    593.6280000              0.0019716        
  4    226.2054000              0.0081541        
  5     95.2614500              0.0266173        
  6     42.8592000              0.0626264        
  7     20.0497100              0.1066534        
  8      9.6208850              0.0933933        
  9      4.5413710             -0.2355891        
 10      2.1135000             -0.6834363        
 11      0.9472010              0.6311456        
 12      0.3912430              0.8969611        
 13      0.1564970             -1.3820600        
 14      0.0625990              0.1694495        
 15      0.0250400              0.7656206        
P   15
  1   7721.4890000             -0.0000545        
  2   1829.1260000             -0.0005660        
  3    593.6280000             -0.0026979        
  4    226.2054000             -0.0133077        
  5     95.2614500             -0.0360385        
  6     42.8592000             -0.1060966        
  7     20.0497100             -0.1308655        
  8      9.6208850             -0.2728610        
  9      4.5413710              0.8747656        
 10      2.1135000              0.5876422        
 11      0.9472010             -2.2942400        
 12      0.3912430              1.9283610        
 13      0.1564970             -0.2812893        
 14      0.0625990             -1.0387080        
 15      0.0250400              0.9387999        
P   15
  1   7721.4890000              0.0000625        
  2   1829.1260000              0.0008057        
  3    593.6280000              0.0030986        
  4    226.2054000              0.0191580        
  5     95.2614500              0.0413087        
  6     42.8592000              0.1600455        
  7     20.0497100              0.1456994        
  8      9.6208850              0.4621261        
  9      4.5413710             -2.4652800        
 10      2.1135000              2.8614131        
 11      0.9472010             -1.0604460        
 12      0.3912430             -0.9677636        
 13      0.1564970              2.1615229        
 14      0.0625990             -2.2537740        
 15      0.0250400              1.1863003        
D   10
  1    217.3688000              0.0009086        
  2     64.9997600              0.0077570        
  3     24.7731400              0.0350961        
  4     10.4361400              0.1069064        
  5      4.6796530              0.2235478        
  6      2.1256220              0.3148228        
  7      0.9452420              0.3170631        
  8      0.4026850              0.2453397        
  9      0.1566510              0.1198018        
 10      0.0626600              0.0424837        
D   10
  1    217.3688000             -0.0007237        
  2     64.9997600             -0.0061290        
  3     24.7731400             -0.0281316        
  4     10.4361400             -0.0862305        
  5      4.6796530             -0.1837914        
  6      2.1256220             -0.2230041        
  7      0.9452420             -0.0994840        
  8      0.4026850              0.2425046        
  9      0.1566510              0.4217596        
 10      0.0626600              0.4358057        
D   10
  1    217.3688000              0.0012589        
  2     64.9997600              0.0109211        
  3     24.7731400              0.0498014        
  4     10.4361400              0.1607749        
  5      4.6796530              0.3234614        
  6      2.1256220              0.2423199        
  7      0.9452420             -0.3448707        
  8      0.4026850             -0.5496404        
  9      0.1566510              0.0368009        
 10      0.0626600              0.6510953        
D   10
  1    217.3688000             -0.0016193        
  2     64.9997600             -0.0139403        
  3     24.7731400             -0.0654238        
  4     10.4361400             -0.2210534        
  5      4.6796530             -0.4183677        
  6      2.1256220              0.1848733        
  7      0.9452420              0.7868811        
  8      0.4026850             -0.3431158        
  9      0.1566510             -0.8704182        
 10      0.0626600              0.9015476        
D   10
  1    217.3688000              0.0020963        
  2     64.9997600              0.0198110        
  3     24.7731400              0.0876769        
  4     10.4361400              0.3534228        
  5      4.6796530              0.4656633        
  6      2.1256220             -1.1841850        
  7      0.9452420              0.2228792        
  8      0.4026850              1.1216886        
  9      0.1566510             -1.5111510        
 10      0.0626600              0.8488927        
F   6
  1     11.2749000              0.0325876        
  2      4.4690000              0.1561285        
  3      1.7713000              0.4009474        
  4      0.7021000              0.4532107        
  5      0.2783000              0.2389983        
  6      0.1103000              0.0596616        
F   6
  1     11.2749000             -0.0737873        
  2      4.4690000             -0.3571723        
  3      1.7713000             -0.4833309        
  4      0.7021000              0.2397543        
  5      0.2783000              0.5210098        
  6      0.1103000              0.1873248        
F   6
  1     11.2749000              0.1504848        
  2      4.4690000              0.6175958        
  3      1.7713000             -0.1524651        
  4      0.7021000             -0.7440038        
  5      0.2783000              0.5033181        
  6      0.1103000              0.3845365        
G   4
  1      6.3768000             -0.0718181        
  2      2.5064000             -0.3567204        
  3      0.9851000             -0.5171641        
  4      0.3872000             -0.2939848        
G   4
  1      6.3768000             -0.2927576        
  2      2.5064000             -0.6034929        
  3      0.9851000              0.1617909        
  4      0.3872000              0.6225390        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Co
data:
COBALT
S   21
  1 4676708.0000000             0.0000086        
  2 700317.2000000              0.0000670        
  3 159373.0000000              0.0003524        
  4  45140.6700000              0.0014862        
  5  14725.7500000              0.0053825        
  6   5315.4480000              0.0172647        
  7   2072.4980000              0.0493040        
  8    858.8231000              0.1225355        
  9    373.6437000              0.2486038        
 10    168.9682000              0.3583791        
 11     78.3197100              0.2784106        
 12     35.5372400              0.0678588        
 13     17.0473500             -0.0011575        
 14      8.1755340              0.0019230        
 15      3.6115780             -0.0008896        
 16      1.6974680              0.0003852        
 17      0.7436360             -0.0001514        
 18      0.1583250              0.0000613        
 19      0.0750090             -0.0000567        
 20      0.0330930              0.0000278        
 21      0.0132370             -0.0000073        
S   21
  1 4676708.0000000            -0.0000026        
  2 700317.2000000             -0.0000204        
  3 159373.0000000             -0.0001075        
  4  45140.6700000             -0.0004538        
  5  14725.7500000             -0.0016500        
  6   5315.4480000             -0.0053419        
  7   2072.4980000             -0.0156239        
  8    858.8231000             -0.0409288        
  9    373.6437000             -0.0931274        
 10    168.9682000             -0.1696550        
 11     78.3197100             -0.1924509        
 12     35.5372400              0.0434714        
 13     17.0473500              0.5173704        
 14      8.1755340              0.5046465        
 15      3.6115780              0.0920129        
 16      1.6974680             -0.0023455        
 17      0.7436360              0.0022423        
 18      0.1583250             -0.0005385        
 19      0.0750090              0.0005012        
 20      0.0330930             -0.0002456        
 21      0.0132370              0.0000642        
S   21
  1 4676708.0000000             0.0000010        
  2 700317.2000000              0.0000076        
  3 159373.0000000              0.0000400        
  4  45140.6700000              0.0001692        
  5  14725.7500000              0.0006148        
  6   5315.4480000              0.0019959        
  7   2072.4980000              0.0058429        
  8    858.8231000              0.0154399        
  9    373.6437000              0.0355154        
 10    168.9682000              0.0669613        
 11     78.3197100              0.0796168        
 12     35.5372400             -0.0187210        
 13     17.0473500             -0.3104228        
 14      8.1755340             -0.4605415        
 15      3.6115780              0.1358724        
 16      1.6974680              0.7302026        
 17      0.7436360              0.3933001        
 18      0.1583250              0.0167952        
 19      0.0750090             -0.0093016        
 20      0.0330930              0.0037519        
 21      0.0132370             -0.0009060        
S   21
  1 4676708.0000000            -0.0000002        
  2 700317.2000000             -0.0000017        
  3 159373.0000000             -0.0000089        
  4  45140.6700000             -0.0000379        
  5  14725.7500000             -0.0001373        
  6   5315.4480000             -0.0004468        
  7   2072.4980000             -0.0013053        
  8    858.8231000             -0.0034624        
  9    373.6437000             -0.0079487        
 10    168.9682000             -0.0151248        
 11     78.3197100             -0.0179403        
 12     35.5372400              0.0039578        
 13     17.0473500              0.0747919        
 14      8.1755340              0.1149008        
 15      3.6115780             -0.0422338        
 16      1.6974680             -0.2468642        
 17      0.7436360             -0.2419882        
 18      0.1583250              0.3722609        
 19      0.0750090              0.5675956        
 20      0.0330930              0.2173794        
 21      0.0132370              0.0035247        
S   21
  1 4676708.0000000             0.0000004        
  2 700317.2000000              0.0000035        
  3 159373.0000000              0.0000177        
  4  45140.6700000              0.0000779        
  5  14725.7500000              0.0002689        
  6   5315.4480000              0.0009300        
  7   2072.4980000              0.0025209        
  8    858.8231000              0.0073269        
  9    373.6437000              0.0149812        
 10    168.9682000              0.0334211        
 11     78.3197100              0.0293121        
 12     35.5372400              0.0099653        
 13     17.0473500             -0.1961004        
 14      8.1755340             -0.1762649        
 15      3.6115780             -0.0386191        
 16      1.6974680              1.0841513        
 17      0.7436360             -0.4262671        
 18      0.1583250             -1.9195620        
 19      0.0750090              1.3732252        
 20      0.0330930              0.2776458        
 21      0.0132370              0.1356901        
S   21
  1 4676708.0000000            -0.0000007        
  2 700317.2000000             -0.0000055        
  3 159373.0000000             -0.0000279        
  4  45140.6700000             -0.0001222        
  5  14725.7500000             -0.0004247        
  6   5315.4480000             -0.0014568        
  7   2072.4980000             -0.0039918        
  8    858.8231000             -0.0114626        
  9    373.6437000             -0.0238679        
 10    168.9682000             -0.0522248        
 11     78.3197100             -0.0483693        
 12     35.5372400             -0.0119317        
 13     17.0473500              0.3094635        
 14      8.1755340              0.3905430        
 15      3.6115780             -0.2853214        
 16      1.6974680             -2.0590340        
 17      0.7436360              2.5781278        
 18      0.1583250             -0.6181502        
 19      0.0750090             -1.3076670        
 20      0.0330930              1.3226252        
 21      0.0132370              0.1003355        
S   21
  1 4676708.0000000             0.0000007        
  2 700317.2000000              0.0000050        
  3 159373.0000000              0.0000282        
  4  45140.6700000              0.0001073        
  5  14725.7500000              0.0004443        
  6   5315.4480000              0.0012261        
  7   2072.4980000              0.0043664        
  8    858.8231000              0.0090697        
  9    373.6437000              0.0282976        
 10    168.9682000              0.0349489        
 11     78.3197100              0.0840348        
 12     35.5372400             -0.0820874        
 13     17.0473500             -0.0853252        
 14      8.1755340             -0.9968384        
 15      3.6115780              2.0696525        
 16      1.6974680             -0.5272583        
 17      0.7436360             -1.4183550        
 18      0.1583250              3.4922751        
 19      0.0750090             -4.0816200        
 20      0.0330930              1.0653131        
 21      0.0132370              0.7592251        
S   21
  1 4676708.0000000            -0.0000010        
  2 700317.2000000             -0.0000073        
  3 159373.0000000             -0.0000422        
  4  45140.6700000             -0.0001581        
  5  14725.7500000             -0.0006660        
  6   5315.4480000             -0.0018044        
  7   2072.4980000             -0.0065650        
  8    858.8231000             -0.0132991        
  9    373.6437000             -0.0429058        
 10    168.9682000             -0.0508896        
 11     78.3197100             -0.1310410        
 12     35.5372400              0.1301428        
 13     17.0473500              0.1408164        
 14      8.1755340              1.9027016        
 15      3.6115780             -5.6643100        
 16      1.6974680              6.1328756        
 17      0.7436360             -2.8956170        
 18      0.1583250             -0.0443428        
 19      0.0750090              2.3067771        
 20      0.0330930             -3.4049790        
 21      0.0132370              1.8766262        
P   15
  1   8421.8420000              0.0001749        
  2   1995.0000000              0.0015377        
  3    647.4855000              0.0085746        
  4    246.7795000              0.0352897        
  5    103.9689000              0.1104856        
  6     46.8105200              0.2515627        
  7     21.9270300              0.3820884        
  8     10.5371500              0.3094567        
  9      4.9806780              0.0875728        
 10      2.3198240              0.0038266        
 11      1.0396090              0.0015123        
 12      0.4289210             -0.0002853        
 13      0.1715680              0.0002014        
 14      0.0686270             -0.0000928        
 15      0.0274510              0.0000289        
P   15
  1   8421.8420000             -0.0000640        
  2   1995.0000000             -0.0005624        
  3    647.4855000             -0.0031626        
  4    246.7795000             -0.0131653        
  5    103.9689000             -0.0425877        
  6     46.8105200             -0.1009536        
  7     21.9270300             -0.1640955        
  8     10.5371500             -0.1146114        
  9      4.9806780              0.1858507        
 10      2.3198240              0.4807124        
 11      1.0396090              0.4051311        
 12      0.4289210              0.0965102        
 13      0.1715680             -0.0015578        
 14      0.0686270              0.0026127        
 15      0.0274510             -0.0006972        
P   15
  1   8421.8420000              0.0000188        
  2   1995.0000000              0.0001662        
  3    647.4855000              0.0009316        
  4    246.7795000              0.0038991        
  5    103.9689000              0.0125983        
  6     46.8105200              0.0301654        
  7     21.9270300              0.0492289        
  8     10.5371500              0.0347515        
  9      4.9806780             -0.0718809        
 10      2.3198240             -0.1828456        
 11      1.0396090             -0.1534736        
 12      0.4289210              0.1559937        
 13      0.1715680              0.5975206        
 14      0.0686270              0.3641942        
 15      0.0274510              0.0401845        
P   15
  1   8421.8420000             -0.0000383        
  2   1995.0000000             -0.0003362        
  3    647.4855000             -0.0018945        
  4    246.7795000             -0.0078932        
  5    103.9689000             -0.0256796        
  6     46.8105200             -0.0611228        
  7     21.9270300             -0.1020196        
  8     10.5371500             -0.0772885        
  9      4.9806780              0.1825778        
 10      2.3198240              0.5178575        
 11      1.0396090             -0.0555423        
 12      0.4289210             -0.9399717        
 13      0.1715680             -0.0557778        
 14      0.0686270              0.6155397        
 15      0.0274510              0.2359969        
P   15
  1   8421.8420000              0.0000399        
  2   1995.0000000              0.0003581        
  3    647.4855000              0.0019728        
  4    246.7795000              0.0084177        
  5    103.9689000              0.0267440        
  6     46.8105200              0.0655127        
  7     21.9270300              0.1057710        
  8     10.5371500              0.1079408        
  9      4.9806780             -0.2925776        
 10      2.3198240             -0.6541275        
 11      1.0396090              0.7675423        
 12      0.4289210              0.6755047        
 13      0.1715680             -1.3219740        
 14      0.0686270              0.2202244        
 15      0.0274510              0.7602001        
P   15
  1   8421.8420000             -0.0000537        
  2   1995.0000000             -0.0005927        
  3    647.4855000             -0.0026636        
  4    246.7795000             -0.0140016        
  5    103.9689000             -0.0356191        
  6     46.8105200             -0.1134129        
  7     21.9270300             -0.1240218        
  8     10.5371500             -0.3189137        
  9      4.9806780              1.0561700        
 10      2.3198240              0.3009816        
 11      1.0396090             -2.1218200        
 12      0.4289210              1.9830532        
 13      0.1715680             -0.4347818        
 14      0.0686270             -0.9317457        
 15      0.0274510              0.9173830        
P   15
  1   8421.8420000              0.0000691        
  2   1995.0000000              0.0007751        
  3    647.4855000              0.0034388        
  4    246.7795000              0.0184717        
  5    103.9689000              0.0467461        
  6     46.8105200              0.1513213        
  7     21.9270300              0.1963007        
  8     10.5371500              0.3861287        
  9      4.9806780             -2.5442090        
 10      2.3198240              3.2431707        
 11      1.0396090             -1.6029170        
 12      0.4289210             -0.4972342        
 13      0.1715680              1.8487048        
 14      0.0686270             -2.0892250        
 15      0.0274510              1.1324392        
D   10
  1    237.5928000              0.0009270        
  2     71.0888100              0.0079387        
  3     27.1190300              0.0360641        
  4     11.4482600              0.1096816        
  5      5.1395420              0.2264578        
  6      2.3326940              0.3136776        
  7      1.0340300              0.3124355        
  8      0.4378990              0.2462833        
  9      0.1689630              0.1263317        
 10      0.0675850              0.0390034        
D   10
  1    237.5928000             -0.0008472        
  2     71.0888100             -0.0072160        
  3     27.1190300             -0.0332324        
  4     11.4482600             -0.1023159        
  5      5.1395420             -0.2139503        
  6      2.3326940             -0.2429566        
  7      1.0340300             -0.0662031        
  8      0.4378990              0.2937819        
  9      0.1689630              0.4167302        
 10      0.0675850              0.3713092        
D   10
  1    237.5928000              0.0012063        
  2     71.0888100              0.0104647        
  3     27.1190300              0.0480299        
  4     11.4482600              0.1545628        
  5      5.1395420              0.3106829        
  6      2.3326940              0.2090521        
  7      1.0340300             -0.3593479        
  8      0.4378990             -0.5128844        
  9      0.1689630              0.0742974        
 10      0.0675850              0.6855019        
D   10
  1    237.5928000             -0.0017141        
  2     71.0888100             -0.0149083        
  3     27.1190300             -0.0695053        
  4     11.4482600             -0.2375036        
  5      5.1395420             -0.4510802        
  6      2.3326940              0.2600533        
  7      1.0340300              0.8010824        
  8      0.4378990             -0.4713708        
  9      0.1689630             -0.7172104        
 10      0.0675850              0.8249891        
D   10
  1    237.5928000              0.0020516        
  2     71.0888100              0.0218297        
  3     27.1190300              0.0869779        
  4     11.4482600              0.3985729        
  5      5.1395420              0.4150750        
  6      2.3326940             -1.3333530        
  7      1.0340300              0.5832683        
  8      0.4378990              0.7967890        
  9      0.1689630             -1.3703940        
 10      0.0675850              0.8298717        
F   6
  1     12.8403000              0.0323691        
  2      5.0894000              0.1578875        
  3      2.0172000              0.4107333        
  4      0.7996000              0.4517069        
  5      0.3169000              0.2285547        
  6      0.1256000              0.0559753        
F   6
  1     12.8403000             -0.0745389        
  2      5.0894000             -0.3766774        
  3      2.0172000             -0.4748131        
  4      0.7996000              0.2764813        
  5      0.3169000              0.5031531        
  6      0.1256000              0.1767600        
F   6
  1     12.8403000              0.1459166        
  2      5.0894000              0.6332214        
  3      2.0172000             -0.2037817        
  4      0.7996000             -0.7136340        
  5      0.3169000              0.5329550        
  6      0.1256000              0.3675116        
G   4
  1      7.2621000             -0.0594147        
  2      2.8544000             -0.3498351        
  3      1.1219000             -0.5066564        
  4      0.4410000             -0.2718922        
G   4
  1      7.2621000              0.3127987        
  2      2.8544000              0.6295906        
  3      1.1219000             -0.2105011        
  4      0.4410000             -0.6000994        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Ni
data:
NICKEL
S   21
  1 5048010.0000000             0.0000086        
  2 755918.1000000              0.0000668        
  3 172026.2000000              0.0003510        
  4  48724.5700000              0.0014802        
  5  15894.8900000              0.0053613        
  6   5737.4680000              0.0171985        
  7   2237.0510000              0.0491275        
  8    927.0302000              0.1221670        
  9    403.3461000              0.2481088        
 10    182.4282000              0.3582623        
 11     84.5891700              0.2791023        
 12     38.4229300              0.0683014        
 13     18.4687900             -0.0011835        
 14      8.8681900              0.0019162        
 15      3.9188700             -0.0008845        
 16      1.8398530              0.0003817        
 17      0.8046630             -0.0001483        
 18      0.1698460              0.0000585        
 19      0.0793700             -0.0000537        
 20      0.0347000              0.0000266        
 21      0.0138800             -0.0000071        
S   21
  1 5048010.0000000            -0.0000026        
  2 755918.1000000             -0.0000204        
  3 172026.2000000             -0.0001076        
  4  48724.5700000             -0.0004541        
  5  15894.8900000             -0.0016512        
  6   5737.4680000             -0.0053463        
  7   2237.0510000             -0.0156411        
  8    927.0302000             -0.0409988        
  9    403.3461000             -0.0933929        
 10    182.4282000             -0.1704003        
 11     84.5891700             -0.1937400        
 12     38.4229300              0.0435405        
 13     18.4687900              0.5195027        
 14      8.8681900              0.5037239        
 15      3.9188700              0.0913908        
 16      1.8398530             -0.0022736        
 17      0.8046630              0.0022082        
 18      0.1698460             -0.0005133        
 19      0.0793700              0.0004748        
 20      0.0347000             -0.0002348        
 21      0.0138800              0.0000624        
S   21
  1 5048010.0000000             0.0000010        
  2 755918.1000000              0.0000077        
  3 172026.2000000              0.0000403        
  4  48724.5700000              0.0001702        
  5  15894.8900000              0.0006185        
  6   5737.4680000              0.0020080        
  7   2237.0510000              0.0058797        
  8    927.0302000              0.0155488        
  9    403.3461000              0.0358090        
 10    182.4282000              0.0676485        
 11     84.5891700              0.0806548        
 12     38.4229300             -0.0189262        
 13     18.4687900             -0.3154584        
 14      8.8681900             -0.4611078        
 15      3.9188700              0.1448987        
 16      1.8398530              0.7304487        
 17      0.8046630              0.3877855        
 18      0.1698460              0.0162280        
 19      0.0793700             -0.0089148        
 20      0.0347000              0.0036440        
 21      0.0138800             -0.0008965        
S   21
  1 5048010.0000000            -0.0000002        
  2 755918.1000000             -0.0000017        
  3 172026.2000000             -0.0000089        
  4  48724.5700000             -0.0000375        
  5  15894.8900000             -0.0001362        
  6   5737.4680000             -0.0004432        
  7   2237.0510000             -0.0012948        
  8    927.0302000             -0.0034381        
  9    403.3461000             -0.0079000        
 10    182.4282000             -0.0150693        
 11     84.5891700             -0.0179107        
 12     38.4229300              0.0039219        
 13     18.4687900              0.0750468        
 14      8.8681900              0.1132425        
 15      3.9188700             -0.0439357        
 16      1.8398530             -0.2443838        
 17      0.8046630             -0.2348542        
 18      0.1698460              0.3686554        
 19      0.0793700              0.5724337        
 20      0.0347000              0.2159243        
 21      0.0138800              0.0002877        
S   21
  1 5048010.0000000             0.0000005        
  2 755918.1000000              0.0000036        
  3 172026.2000000              0.0000181        
  4  48724.5700000              0.0000796        
  5  15894.8900000              0.0002748        
  6   5737.4680000              0.0009496        
  7   2237.0510000              0.0025782        
  8    927.0302000              0.0074869        
  9    403.3461000              0.0153615        
 10    182.4282000              0.0342359        
 11     84.5891700              0.0303236        
 12     38.4229300              0.0099202        
 13     18.4687900             -0.2013734        
 14      8.8681900             -0.1830388        
 15      3.9188700             -0.0217528        
 16      1.8398530              1.0974998        
 17      0.8046630             -0.4679771        
 18      0.1698460             -1.8549820        
 19      0.0793700              1.3222116        
 20      0.0347000              0.2973117        
 21      0.0138800              0.1157162        
S   21
  1 5048010.0000000            -0.0000007        
  2 755918.1000000             -0.0000056        
  3 172026.2000000             -0.0000290        
  4  48724.5700000             -0.0001262        
  5  15894.8900000             -0.0004421        
  6   5737.4680000             -0.0015017        
  7   2237.0510000             -0.0041660        
  8    927.0302000             -0.0117984        
  9    403.3461000             -0.0250661        
 10    182.4282000             -0.0535867        
 11     84.5891700             -0.0523617        
 12     38.4229300             -0.0078368        
 13     18.4687900              0.3105100        
 14      8.8681900              0.4404350        
 15      3.9188700             -0.3962250        
 16      1.8398530             -2.0053650        
 17      0.8046630              2.6304708        
 18      0.1698460             -0.8055990        
 19      0.0793700             -1.1209270        
 20      0.0347000              1.3686309        
 21      0.0138800             -0.0154283        
S   21
  1 5048010.0000000             0.0000009        
  2 755918.1000000              0.0000063        
  3 172026.2000000              0.0000364        
  4  48724.5700000              0.0001348        
  5  15894.8900000              0.0005770        
  6   5737.4680000              0.0015270        
  7   2237.0510000              0.0057149        
  8    927.0302000              0.0111504        
  9    403.3461000              0.0375778        
 10    182.4282000              0.0412961        
 11     84.5891700              0.1172759        
 12     38.4229300             -0.1272878        
 13     18.4687900             -0.0582180        
 14      8.8681900             -1.4995820        
 15      3.9188700              3.4924071        
 16      1.8398530             -2.1907650        
 17      0.8046630             -0.5455901        
 18      0.1698460              3.5960644        
 19      0.0793700             -5.2375860        
 20      0.0347000              2.7668854        
 21      0.0138800             -0.1683986        
S   21
  1 5048010.0000000            -0.0000011        
  2 755918.1000000             -0.0000090        
  3 172026.2000000             -0.0000442        
  4  48724.5700000             -0.0002033        
  5  15894.8900000             -0.0006615        
  6   5737.4680000             -0.0024644        
  7   2237.0510000             -0.0061019        
  8    927.0302000             -0.0198733        
  9    403.3461000             -0.0355458        
 10    182.4282000             -0.0966771        
 11     84.5891700             -0.0583330        
 12     38.4229300             -0.0934702        
 13     18.4687900              0.7591522        
 14      8.8681900              1.3006597        
 15      3.9188700             -6.1242540        
 16      1.8398530              8.0238672        
 17      0.8046630             -5.0460320        
 18      0.1698460              3.8279533        
 19      0.0793700             -3.8396240        
 20      0.0347000              1.3803078        
 21      0.0138800              0.1371575        
P   15
  1   9148.7960000              0.0001736        
  2   2167.1710000              0.0015266        
  3    703.3857000              0.0085213        
  4    268.1342000              0.0351341        
  5    113.0078000              0.1102503        
  6     50.9133900              0.2516806        
  7     23.8774000              0.3825046        
  8     11.4892400              0.3089367        
  9      5.4368840              0.0872290        
 10      2.5338370              0.0039206        
 11      1.1353090              0.0015392        
 12      0.4678910             -0.0002655        
 13      0.1871560              0.0001994        
 14      0.0748620             -0.0000909        
 15      0.0299450              0.0000284        
P   15
  1   9148.7960000             -0.0000640        
  2   2167.1710000             -0.0005629        
  3    703.3857000             -0.0031692        
  4    268.1342000             -0.0132183        
  5    113.0078000             -0.0428710        
  6     50.9133900             -0.1019674        
  7     23.8774000             -0.1659257        
  8     11.4892400             -0.1141167        
  9      5.4368840              0.1896880        
 10      2.5338370              0.4817172        
 11      1.1353090              0.4020203        
 12      0.4678910              0.0955193        
 13      0.1871560             -0.0015489        
 14      0.0748620              0.0025883        
 15      0.0299450             -0.0006906        
P   15
  1   9148.7960000              0.0000196        
  2   2167.1710000              0.0001731        
  3    703.3857000              0.0009722        
  4    268.1342000              0.0040744        
  5    113.0078000              0.0132102        
  6     50.9133900              0.0317129        
  7     23.8774000              0.0519237        
  8     11.4892400              0.0360513        
  9      5.4368840             -0.0772532        
 10      2.5338370             -0.1941497        
 11      1.1353090             -0.1477233        
 12      0.4678910              0.1718753        
 13      0.1871560              0.6042663        
 14      0.0748620              0.3554410        
 15      0.0299450              0.0212506        
P   15
  1   9148.7960000             -0.0000429        
  2   2167.1710000             -0.0003784        
  3    703.3857000             -0.0021280        
  4    268.1342000             -0.0089146        
  5    113.0078000             -0.0289804        
  6     50.9133900             -0.0694999        
  7     23.8774000             -0.1156346        
  8     11.4892400             -0.0901824        
  9      5.4368840              0.2244235        
 10      2.5338370              0.5942960        
 11      1.1353090             -0.1622569        
 12      0.4678910             -1.0340430        
 13      0.1871560              0.1500320        
 14      0.0748620              0.6127340        
 15      0.0299450              0.0948606        
P   15
  1   9148.7960000              0.0000447        
  2   2167.1710000              0.0004210        
  3    703.3857000              0.0022146        
  4    268.1342000              0.0099401        
  5    113.0078000              0.0300748        
  6     50.9133900              0.0785153        
  7     23.8774000              0.1165762        
  8     11.4892400              0.1582313        
  9      5.4368840             -0.4693645        
 10      2.5338370             -0.6653167        
 11      1.1353090              1.2479905        
 12      0.4678910              0.0608825        
 13      0.1871560             -1.2240160        
 14      0.0748620              0.5951147        
 15      0.0299450              0.5080473        
P   15
  1   9148.7960000             -0.0000495        
  2   2167.1710000             -0.0005791        
  3    703.3857000             -0.0024593        
  4    268.1342000             -0.0137421        
  5    113.0078000             -0.0329468        
  6     50.9133900             -0.1129689        
  7     23.8774000             -0.1126527        
  8     11.4892400             -0.3393311        
  9      5.4368840              1.2317926        
 10      2.5338370             -0.1771550        
 11      1.1353090             -1.7137840        
 12      0.4678910              2.0981372        
 13      0.1871560             -0.9419235        
 14      0.0748620             -0.5823576        
 15      0.0299450              0.9511092        
P   15
  1   9148.7960000              0.0000749        
  2   2167.1710000              0.0007214        
  3    703.3857000              0.0037275        
  4    268.1342000              0.0172388        
  5    113.0078000              0.0516092        
  6     50.9133900              0.1378559        
  7     23.8774000              0.2480738        
  8     11.4892400              0.2639479        
  9      5.4368840             -2.4640590        
 10      2.5338370              3.4121318        
 11      1.1353090             -2.0114720        
 12      0.4678910             -0.0421967        
 13      0.1871560              1.5201981        
 14      0.0748620             -1.9853170        
 15      0.0299450              1.1789974        
D   10
  1    258.8667000              0.0009525        
  2     77.4960400              0.0081799        
  3     29.5897200              0.0373082        
  4     12.5152700              0.1132872        
  5      5.6244680              0.2314757        
  6      2.5513030              0.3161360        
  7      1.1280600              0.3108432        
  8      0.4753730              0.2421024        
  9      0.1821280              0.1229839        
 10      0.0728510              0.0351676        
D   10
  1    258.8667000             -0.0009261        
  2     77.4960400             -0.0079244        
  3     29.5897200             -0.0366267        
  4     12.5152700             -0.1130537        
  5      5.6244680             -0.2326325        
  6      2.5513030             -0.2493503        
  7      1.1280600             -0.0353269        
  8      0.4753730              0.3269474        
  9      0.1821280              0.4196984        
 10      0.0728510              0.3181754        
D   10
  1    258.8667000              0.0012366        
  2     77.4960400              0.0107482        
  3     29.5897200              0.0495894        
  4     12.5152700              0.1598774        
  5      5.6244680              0.3192322        
  6      2.5513030              0.1791901        
  7      1.1280600             -0.4130720        
  8      0.4753730             -0.4749400        
  9      0.1821280              0.1711843        
 10      0.0728510              0.6397940        
D   10
  1    258.8667000             -0.0017787        
  2     77.4960400             -0.0157175        
  3     29.5897200             -0.0727320        
  4     12.5152700             -0.2541176        
  5      5.6244680             -0.4630912        
  6      2.5513030              0.3660276        
  7      1.1280600              0.7561037        
  8      0.4753730             -0.6047182        
  9      0.1821280             -0.5581049        
 10      0.0728510              0.7818190        
D   10
  1    258.8667000              0.0020194        
  2     77.4960400              0.0233178        
  3     29.5897200              0.0872867        
  4     12.5152700              0.4366637        
  5      5.6244680              0.3374642        
  6      2.5513030             -1.3921600        
  7      1.1280600              0.8432747        
  8      0.4753730              0.5259686        
  9      0.1821280             -1.2586030        
 10      0.0728510              0.8375133        
F   6
  1     14.2156000              0.0344954        
  2      5.6345000              0.1679319        
  3      2.2333000              0.4235404        
  4      0.8852000              0.4432599        
  5      0.3509000              0.2157909        
  6      0.1391000              0.0513622        
F   6
  1     14.2156000             -0.0779649        
  2      5.6345000             -0.3935911        
  3      2.2333000             -0.4564942        
  4      0.8852000              0.3114760        
  5      0.3509000              0.4920107        
  6      0.1391000              0.1648255        
F   6
  1     14.2156000              0.1532766        
  2      5.6345000              0.6445037        
  3      2.2333000             -0.2641527        
  4      0.8852000             -0.6774664        
  5      0.3509000              0.5632829        
  6      0.1391000              0.3410204        
G   4
  1      8.0399000              0.0644167        
  2      3.1601000              0.3942264        
  3      1.2421000              0.5455206        
  4      0.4882000              0.2687623        
G   4
  1      8.0399000              0.2337494        
  2      3.1601000              0.4363882        
  3      1.2421000             -0.1801696        
  4      0.4882000             -0.4040997        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Cu
data:
COPPER
S   21
  1 9148883.0000000             0.0000045        
  2 1369956.0000000             0.0000347        
  3 311782.6000000              0.0001824        
  4  88318.8000000              0.0007700        
  5  28815.5300000              0.0027976        
  6  10403.4600000              0.0090560        
  7   4057.7910000              0.0264408        
  8   1682.9740000              0.0691804        
  9    733.7543000              0.1564799        
 10    333.2677000              0.2831880        
 11    156.4338000              0.3483474        
 12     74.6972100              0.2172972        
 13     33.3226200              0.0372395        
 14     16.6223700             -0.0025807        
 15      8.2082600              0.0015604        
 16      3.6094000             -0.0006799        
 17      1.6834490              0.0002619        
 18      0.7337570             -0.0000868        
 19      0.1102070              0.0000177        
 20      0.0387860             -0.0000129        
 21      0.0155140              0.0000049        
S   21
  1 9148883.0000000            -0.0000014        
  2 1369956.0000000            -0.0000107        
  3 311782.6000000             -0.0000561        
  4  88318.8000000             -0.0002370        
  5  28815.5300000             -0.0008638        
  6  10403.4600000             -0.0028083        
  7   4057.7910000             -0.0083298        
  8   1682.9740000             -0.0224540        
  9    733.7543000             -0.0545657        
 10    333.2677000             -0.1133921        
 11    156.4338000             -0.1851260        
 12     74.6972100             -0.1587381        
 13     33.3226200              0.1660091        
 14     16.6223700              0.5680884        
 15      8.2082600              0.3950505        
 16      3.6094000              0.0519344        
 17      1.6834490             -0.0010578        
 18      0.7337570              0.0012394        
 19      0.1102070             -0.0001197        
 20      0.0387860              0.0000886        
 21      0.0155140             -0.0000340        
S   21
  1 9148883.0000000             0.0000005        
  2 1369956.0000000             0.0000040        
  3 311782.6000000              0.0000210        
  4  88318.8000000              0.0000886        
  5  28815.5300000              0.0003236        
  6  10403.4600000              0.0010502        
  7   4057.7910000              0.0031294        
  8   1682.9740000              0.0084386        
  9    733.7543000              0.0207702        
 10    333.2677000              0.0436971        
 11    156.4338000              0.0746019        
 12     74.6972100              0.0669604        
 13     33.3226200             -0.0794426        
 14     16.6223700             -0.3848752        
 15      8.2082600             -0.3724662        
 16      3.6094000              0.3193858        
 17      1.6834490              0.7043586        
 18      0.7337570              0.2799624        
 19      0.1102070              0.0057910        
 20      0.0387860             -0.0026652        
 21      0.0155140              0.0009522        
S   21
  1 9148883.0000000            -0.0000001        
  2 1369956.0000000            -0.0000008        
  3 311782.6000000             -0.0000045        
  4  88318.8000000             -0.0000187        
  5  28815.5300000             -0.0000695        
  6  10403.4600000             -0.0002203        
  7   4057.7910000             -0.0006753        
  8   1682.9740000             -0.0017612        
  9    733.7543000             -0.0045222        
 10    333.2677000             -0.0090430        
 11    156.4338000             -0.0167018        
 12     74.6972100             -0.0128842        
 13     33.3226200              0.0133356        
 14     16.6223700              0.0979059        
 15      8.2082600              0.0724974        
 16      3.6094000             -0.0605655        
 17      1.6834490             -0.2971844        
 18      0.7337570             -0.1063761        
 19      0.1102070              0.7953271        
 20      0.0387860              0.3075825        
 21      0.0155140              0.0148355        
S   21
  1 9148883.0000000             0.0000002        
  2 1369956.0000000             0.0000017        
  3 311782.6000000              0.0000094        
  4  88318.8000000              0.0000365        
  5  28815.5300000              0.0001482        
  6  10403.4600000              0.0004226        
  7   4057.7910000              0.0014700        
  8   1682.9740000              0.0032832        
  9    733.7543000              0.0101489        
 10    333.2677000              0.0158848        
 11    156.4338000              0.0406872        
 12     74.6972100              0.0119263        
 13     33.3226200              0.0102203        
 14     16.6223700             -0.2916877        
 15      8.2082600             -0.0233203        
 16      3.6094000             -0.0655306        
 17      1.6834490              1.3229446        
 18      0.7337570             -1.0559410        
 19      0.1102070             -1.2308780        
 20      0.0387860              1.6531394        
 21      0.0155140             -0.2015516        
S   21
  1 9148883.0000000            -0.0000004        
  2 1369956.0000000            -0.0000029        
  3 311782.6000000             -0.0000154        
  4  88318.8000000             -0.0000634        
  5  28815.5300000             -0.0002388        
  6  10403.4600000             -0.0007463        
  7   4057.7910000             -0.0023287        
  8   1682.9740000             -0.0059489        
  9    733.7543000             -0.0156905        
 10    333.2677000             -0.0304429        
 11    156.4338000             -0.0590770        
 12     74.6972100             -0.0416723        
 13     33.3226200              0.0368461        
 14     16.6223700              0.3829534        
 15      8.2082600              0.3638643        
 16      3.6094000             -0.8379095        
 17      1.6834490             -1.3327750        
 18      0.7337570              2.3585238        
 19      0.1102070             -1.8284650        
 20      0.0387860              1.2032456        
 21      0.0155140              0.0447791        
S   21
  1 9148883.0000000             0.0000006        
  2 1369956.0000000             0.0000045        
  3 311782.6000000              0.0000231        
  4  88318.8000000              0.0001018        
  5  28815.5300000              0.0003513        
  6  10403.4600000              0.0012204        
  7   4057.7910000              0.0033544        
  8   1682.9740000              0.0099905        
  9    733.7543000              0.0219001        
 10    333.2677000              0.0540720        
 11    156.4338000              0.0756341        
 12     74.6972100              0.1038940        
 13     33.3226200             -0.1401680        
 14     16.6223700             -0.5126665        
 15      8.2082600             -1.3503980        
 16      3.6094000              5.6933879        
 17      1.6834490             -6.4894760        
 18      0.7337570              2.9509294        
 19      0.1102070             -0.3349516        
 20      0.0387860             -0.6736226        
 21      0.0155140              0.8489410        
S   21
  1 9148883.0000000            -0.0000004        
  2 1369956.0000000            -0.0000023        
  3 311782.6000000             -0.0000208        
  4  88318.8000000             -0.0000403        
  5  28815.5300000             -0.0003651        
  6  10403.4600000             -0.0003145        
  7   4057.7910000             -0.0040766        
  8   1682.9740000             -0.0008187        
  9    733.7543000             -0.0327459        
 10    333.2677000              0.0131141        
 11    156.4338000             -0.1783570        
 12     74.6972100              0.2118313        
 13     33.3226200             -0.6562555        
 14     16.6223700              2.2531713        
 15      8.2082600             -2.3652420        
 16      3.6094000             -0.0447763        
 17      1.6834490              2.0200703        
 18      0.7337570             -1.7425540        
 19      0.1102070              1.8773472        
 20      0.0387860             -3.2480540        
 21      0.0155140              2.2829914        
P   15
  1   9713.2530000              0.0001784        
  2   2300.8890000              0.0015686        
  3    746.7706000              0.0087543        
  4    284.6806000              0.0360811        
  5    119.9999000              0.1129915        
  6     54.0738600              0.2566409        
  7     25.3732100              0.3851875        
  8     12.2096200              0.3028808        
  9      5.7574210              0.0816448        
 10      2.6734020              0.0033881        
 11      1.1868350              0.0015770        
 12      0.4815930             -0.0002208        
 13      0.1926370              0.0002120        
 14      0.0770550             -0.0000895        
 15      0.0308220              0.0000284        
P   15
  1   9713.2530000             -0.0000658        
  2   2300.8890000             -0.0005782        
  3    746.7706000             -0.0032566        
  4    284.6806000             -0.0135780        
  5    119.9999000             -0.0439985        
  6     54.0738600             -0.1041809        
  7     25.3732100             -0.1676802        
  8     12.2096200             -0.1071443        
  9      5.7574210              0.2050046        
 10      2.6734020              0.4829396        
 11      1.1868350              0.3902233        
 12      0.4815930              0.0943774        
 13      0.1926370             -0.0015448        
 14      0.0770550              0.0026439        
 15      0.0308220             -0.0007274        
P   15
  1   9713.2530000              0.0000226        
  2   2300.8890000              0.0001982        
  3    746.7706000              0.0011204        
  4    284.6806000              0.0046657        
  5    119.9999000              0.0152157        
  6     54.0738600              0.0360811        
  7     25.3732100              0.0592550        
  8     12.2096200              0.0370993        
  9      5.7574210             -0.0933945        
 10      2.6734020             -0.2290024        
 11      1.1868350             -0.1232369        
 12      0.4815930              0.2311824        
 13      0.1926370              0.6024109        
 14      0.0770550              0.3065242        
 15      0.0308220              0.0130776        
P   15
  1   9713.2530000             -0.0000470        
  2   2300.8890000             -0.0004156        
  3    746.7706000             -0.0023277        
  4    284.6806000             -0.0097925        
  5    119.9999000             -0.0316589        
  6     54.0738600             -0.0759931        
  7     25.3732100             -0.1244749        
  8     12.2096200             -0.0955157        
  9      5.7574210              0.2789617        
 10      2.6734020              0.6276759        
 11      1.1868350             -0.3261519        
 12      0.4815930             -1.0009900        
 13      0.1926370              0.3326714        
 14      0.0770550              0.5440404        
 15      0.0308220              0.0554239        
P   15
  1   9713.2530000              0.0000495        
  2   2300.8890000              0.0004866        
  3    746.7706000              0.0024554        
  4    284.6806000              0.0115031        
  5    119.9999000              0.0332154        
  6     54.0738600              0.0910985        
  7     25.3732100              0.1248290        
  8     12.2096200              0.1963225        
  9      5.7574210             -0.6786917        
 10      2.6734020             -0.4986374        
 11      1.1868350              1.4798113        
 12      0.4815930             -0.4634203        
 13      0.1926370             -0.9305540        
 14      0.0770550              0.6921701        
 15      0.0308220              0.3684572        
P   15
  1   9713.2530000             -0.0000495        
  2   2300.8890000             -0.0005750        
  3    746.7706000             -0.0024586        
  4    284.6806000             -0.0136626        
  5    119.9999000             -0.0329894        
  6     54.0738600             -0.1116608        
  7     25.3732100             -0.1175665        
  8     12.2096200             -0.3155263        
  9      5.7574210              1.3818450        
 10      2.6734020             -0.7132927        
 11      1.1868350             -1.1090360        
 12      0.4815930              1.9212999        
 13      0.1926370             -1.2000030        
 14      0.0770550             -0.3179660        
 15      0.0308220              0.9354899        
P   15
  1   9713.2530000              0.0000852        
  2   2300.8890000              0.0006669        
  3    746.7706000              0.0042361        
  4    284.6806000              0.0159196        
  5    119.9999000              0.0594358        
  6     54.0738600              0.1202889        
  7     25.3732100              0.3208028        
  8     12.2096200              0.0581344        
  9      5.7574210             -2.2496750        
 10      2.6734020              3.4652132        
 11      1.1868350             -2.3815320        
 12      0.4815930              0.4528051        
 13      0.1926370              1.1267670        
 14      0.0770550             -1.8121360        
 15      0.0308220              1.1659415        
D   10
  1    249.3497000              0.0012640        
  2     74.6383700              0.0106389        
  3     28.3764100              0.0472095        
  4     11.9489300              0.1379366        
  5      5.3176460              0.2626675        
  6      2.3644170              0.3324163        
  7      1.0123860              0.3077990        
  8      0.4067730              0.2166410        
  9      0.1473310              0.0840772        
 10      0.0589320              0.0050438        
D   10
  1    249.3497000             -0.0015531        
  2     74.6383700             -0.0131130        
  3     28.3764100             -0.0589550        
  4     11.9489300             -0.1778206        
  5      5.3176460             -0.3271681        
  6      2.3644170             -0.2409974        
  7      1.0123860              0.1896065        
  8      0.4067730              0.5034045        
  9      0.1473310              0.3070359        
 10      0.0589320              0.0325397        
D   10
  1    249.3497000              0.0018692        
  2     74.6383700              0.0161251        
  3     28.3764100              0.0724092        
  4     11.9489300              0.2362863        
  5      5.3176460              0.3829612        
  6      2.3644170             -0.1679375        
  7      1.0123860             -0.6824603        
  8      0.4067730              0.0886993        
  9      0.1473310              0.6027864        
 10      0.0589320              0.1443810        
D   10
  1    249.3497000             -0.0023354        
  2     74.6383700             -0.0229071        
  3     28.3764100             -0.0939470        
  4     11.9489300             -0.3767594        
  5      5.3176460             -0.3271353        
  6      2.3644170              0.9500969        
  7      1.0123860             -0.0464879        
  8      0.4067730             -0.8856022        
  9      0.1473310              0.5428285        
 10      0.0589320              0.3272240        
D   10
  1    249.3497000              0.0025041        
  2     74.6383700              0.0357945        
  3     28.3764100              0.1118229        
  4     11.9489300              0.6907369        
  5      5.3176460             -0.4708926        
  6      2.3644170             -0.9338754        
  7      1.0123860              1.6653446        
  8      0.4067730             -1.1214400        
  9      0.1473310              0.0350511        
 10      0.0589320              0.5278036        
F   6
  1     15.4333000              0.0390182        
  2      6.1172000              0.1875434        
  3      2.4246000              0.4462125        
  4      0.9610000              0.4264741        
  5      0.3809000              0.1915591        
  6      0.1510000              0.0416518        
F   6
  1     15.4333000             -0.0843767        
  2      6.1172000             -0.4143733        
  3      2.4246000             -0.4172357        
  4      0.9610000              0.3587680        
  5      0.3809000              0.4777457        
  6      0.1510000              0.1542376        
F   6
  1     15.4333000              0.1616831        
  2      6.1172000              0.6348261        
  3      2.4246000             -0.3107576        
  4      0.9610000             -0.6318876        
  5      0.3809000              0.5673402        
  6      0.1510000              0.3500979        
G   4
  1      8.7286000              0.0694594        
  2      3.4308000              0.4369875        
  3      1.3485000              0.5414751        
  4      0.5300000              0.2174397        
G   4
  1      8.7286000             -0.3791541        
  2      3.4308000             -0.5966263        
  3      1.3485000              0.3613781        
  4      0.5300000              0.5126784        


name: Roos Augmented Triple Zeta ANO
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Zn
data:
ZINC
S   21
  1 5820021.0000000             0.0000086        
  2 871523.4000000              0.0000665        
  3 198335.0000000              0.0003495        
  4  56176.3100000              0.0014738        
  5  18325.8200000              0.0053383        
  6   6614.9550000              0.0171271        
  7   2579.1990000              0.0489409        
  8   1068.8490000              0.1217934        
  9    465.1045000              0.2476589        
 10    210.4130000              0.3582432        
 11     97.6162900              0.2798170        
 12     44.3802000              0.0685758        
 13     21.4230800             -0.0013127        
 14     10.3089100              0.0019163        
 15      4.5536450             -0.0008791        
 16      2.1328210              0.0003778        
 17      0.9296970             -0.0001433        
 18      0.1921470              0.0000541        
 19      0.0875950             -0.0000491        
 20      0.0377020              0.0000247        
 21      0.0150810             -0.0000067        
S   21
  1 5820021.0000000            -0.0000026        
  2 871523.4000000             -0.0000205        
  3 198335.0000000             -0.0001080        
  4  56176.3100000             -0.0004559        
  5  18325.8200000             -0.0016578        
  6   6614.9550000             -0.0053685        
  7   2579.1990000             -0.0157124        
  8   1068.8490000             -0.0412257        
  9    465.1045000             -0.0940641        
 10    210.4130000             -0.1719964        
 11     97.6162900             -0.1958500        
 12     44.3802000              0.0453244        
 13     21.4230800              0.5244522        
 14     10.3089100              0.5006010        
 15      4.5536450              0.0894769        
 16      2.1328210             -0.0021743        
 17      0.9296970              0.0021375        
 18      0.1921470             -0.0004691        
 19      0.0875950              0.0004303        
 20      0.0377020             -0.0002165        
 21      0.0150810              0.0000591        
S   21
  1 5820021.0000000             0.0000010        
  2 871523.4000000              0.0000078        
  3 198335.0000000              0.0000408        
  4  56176.3100000              0.0001723        
  5  18325.8200000              0.0006259        
  6   6614.9550000              0.0020329        
  7   2579.1990000              0.0059546        
  8   1068.8490000              0.0157669        
  9    465.1045000              0.0363754        
 10    210.4130000              0.0689273        
 11     97.6162900              0.0823733        
 12     44.3802000             -0.0200931        
 13     21.4230800             -0.3253008        
 14     10.3089100             -0.4602086        
 15      4.5536450              0.1633908        
 16      2.1328210              0.7299936        
 17      0.9296970              0.3766747        
 18      0.1921470              0.0150817        
 19      0.0875950             -0.0082240        
 20      0.0377020              0.0034484        
 21      0.0150810             -0.0008762        
S   21
  1 5820021.0000000            -0.0000002        
  2 871523.4000000             -0.0000017        
  3 198335.0000000             -0.0000091        
  4  56176.3100000             -0.0000386        
  5  18325.8200000             -0.0001399        
  6   6614.9550000             -0.0004559        
  7   2579.1990000             -0.0013309        
  8   1068.8490000             -0.0035427        
  9    465.1045000             -0.0081430        
 10    210.4130000             -0.0156132        
 11     97.6162900             -0.0185358        
 12     44.3802000              0.0041320        
 13     21.4230800              0.0789884        
 14     10.3089100              0.1141316        
 15      4.5536450             -0.0486767        
 16      2.1328210             -0.2515387        
 17      0.9296970             -0.2337560        
 18      0.1921470              0.4380172        
 19      0.0875950              0.5521739        
 20      0.0377020              0.1698573        
 21      0.0150810              0.0024973        
S   21
  1 5820021.0000000             0.0000003        
  2 871523.4000000              0.0000027        
  3 198335.0000000              0.0000137        
  4  56176.3100000              0.0000598        
  5  18325.8200000              0.0002095        
  6   6614.9550000              0.0007112        
  7   2579.1990000              0.0019745        
  8   1068.8490000              0.0055909        
  9    465.1045000              0.0118924        
 10    210.4130000              0.0253915        
 11     97.6162900              0.0247517        
 12     44.3802000              0.0031286        
 13     21.4230800             -0.1455831        
 14     10.3089100             -0.1487271        
 15      4.5536450              0.0323568        
 16      2.1328210              0.6651708        
 17      0.9296970             -0.0966651        
 18      0.1921470             -1.6575130        
 19      0.0875950              0.7510888        
 20      0.0377020              0.7349184        
 21      0.0150810              0.0732319        
S   21
  1 5820021.0000000            -0.0000007        
  2 871523.4000000             -0.0000059        
  3 198335.0000000             -0.0000301        
  4  56176.3100000             -0.0001330        
  5  18325.8200000             -0.0004566        
  6   6614.9550000             -0.0015896        
  7   2579.1990000             -0.0042814        
  8   1068.8490000             -0.0125846        
  9    465.1045000             -0.0255662        
 10    210.4130000             -0.0582753        
 11     97.6162900             -0.0503483        
 12     44.3802000             -0.0200286        
 13     21.4230800              0.3614371        
 14     10.3089100              0.3696434        
 15      4.5536450             -0.2753528        
 16      2.1328210             -2.0987060        
 17      0.9296970              2.4645301        
 18      0.1921470             -0.1095107        
 19      0.0875950             -1.7612880        
 20      0.0377020              1.5307360        
 21      0.0150810             -0.0774783        
S   21
  1 5820021.0000000             0.0000009        
  2 871523.4000000              0.0000062        
  3 198335.0000000              0.0000355        
  4  56176.3100000              0.0001345        
  5  18325.8200000              0.0005591        
  6   6614.9550000              0.0015365        
  7   2579.1990000              0.0055053        
  8   1068.8490000              0.0113832        
  9    465.1045000              0.0359162        
 10    210.4130000              0.0441483        
 11     97.6162900              0.1081545        
 12     44.3802000             -0.1056115        
 13     21.4230800             -0.1189922        
 14     10.3089100             -1.3055770        
 15      4.5536450              3.0303774        
 16      2.1328210             -1.5662070        
 17      0.9296970             -0.9562031        
 18      0.1921470              3.6013858        
 19      0.0875950             -4.8829650        
 20      0.0377020              2.3698012        
 21      0.0150810             -0.0340590        
S   21
  1 5820021.0000000            -0.0000011        
  2 871523.4000000             -0.0000087        
  3 198335.0000000             -0.0000441        
  4  56176.3100000             -0.0001963        
  5  18325.8200000             -0.0006671        
  6   6614.9550000             -0.0023574        
  7   2579.1990000             -0.0062426        
  8   1068.8490000             -0.0187991        
  9    465.1045000             -0.0374100        
 10    210.4130000             -0.0893121        
 11     97.6162900             -0.0733922        
 12     44.3802000             -0.0559832        
 13     21.4230800              0.6963994        
 14     10.3089100              1.2777872        
 15      4.5536450             -5.7953510        
 16      2.1328210              7.3501895        
 17      0.9296970             -4.3536210        
 18      0.1921470              2.5356755        
 19      0.0875950             -1.7426520        
 20      0.0377020             -0.3852316        
 21      0.0150810              0.8911217        
P   15
  1  10684.5800000              0.0001714        
  2   2530.9030000              0.0015087        
  3    821.4820000              0.0084368        
  4    313.2522000              0.0348961        
  5    132.1094000              0.1099359        
  6     59.5875100              0.2520564        
  7     28.0039900              0.3832784        
  8     13.5042500              0.3078260        
  9      6.4018810              0.0865115        
 10      2.9857690              0.0040822        
 11      1.3369020              0.0015857        
 12      0.5499610             -0.0002323        
 13      0.2199840              0.0001958        
 14      0.0879940             -0.0000878        
 15      0.0351980              0.0000274        
P   15
  1  10684.5800000             -0.0000641        
  2   2530.9030000             -0.0005638        
  3    821.4820000             -0.0031804        
  4    313.2522000             -0.0133103        
  5    132.1094000             -0.0433634        
  6     59.5875100             -0.1037319        
  7     28.0039900             -0.1690002        
  8     13.5042500             -0.1128672        
  9      6.4018810              0.1963898        
 10      2.9857690              0.4829795        
 11      1.3369020              0.3967617        
 12      0.5499610              0.0941104        
 13      0.2199840             -0.0015306        
 14      0.0879940              0.0025479        
 15      0.0351980             -0.0006797        
P   15
  1  10684.5800000              0.0000168        
  2   2530.9030000              0.0001482        
  3    821.4820000              0.0008338        
  4    313.2522000              0.0035065        
  5    132.1094000              0.0114135        
  6     59.5875100              0.0275640        
  7     28.0039900              0.0451462        
  8     13.5042500              0.0303909        
  9      6.4018810             -0.0664651        
 10      2.9857690             -0.1615315        
 11      1.3369020             -0.1364279        
 12      0.5499610              0.1165787        
 13      0.2199840              0.5468360        
 14      0.0879940              0.4149079        
 15      0.0351980              0.0795438        
P   15
  1  10684.5800000             -0.0000360        
  2   2530.9030000             -0.0003183        
  3    821.4820000             -0.0017874        
  4    313.2522000             -0.0075341        
  5    132.1094000             -0.0244969        
  6     59.5875100             -0.0593045        
  7     28.0039900             -0.0983075        
  8     13.5042500             -0.0757965        
  9      6.4018810              0.1881581        
 10      2.9857690              0.4690391        
 11      1.3369020             -0.0399937        
 12      0.5499610             -0.8182209        
 13      0.2199840             -0.2206737        
 14      0.0879940              0.5382072        
 15      0.0351980              0.3628488        
P   15
  1  10684.5800000              0.0000420        
  2   2530.9030000              0.0003788        
  3    821.4820000              0.0020876        
  4    313.2522000              0.0089761        
  5    132.1094000              0.0286258        
  6     59.5875100              0.0708920        
  7     28.0039900              0.1149481        
  8     13.5042500              0.1174631        
  9      6.4018810             -0.3365914        
 10      2.9857690             -0.6406425        
 11      1.3369020              0.7452954        
 12      0.5499610              0.7015721        
 13      0.2199840             -1.1502840        
 14      0.0879940             -0.0568782        
 15      0.0351980              0.8428301        
P   15
  1  10684.5800000             -0.0000534        
  2   2530.9030000             -0.0005555        
  3    821.4820000             -0.0026578        
  4    313.2522000             -0.0132177        
  5    132.1094000             -0.0362165        
  6     59.5875100             -0.1072132        
  7     28.0039900             -0.1368465        
  8     13.5042500             -0.2815020        
  9      6.4018810              1.0153917        
 10      2.9857690              0.2591624        
 11      1.3369020             -1.9590820        
 12      0.5499610              1.6931751        
 13      0.2199840             -0.0494415        
 14      0.0879940             -1.2351860        
 15      0.0351980              1.0061185        
P   15
  1  10684.5800000              0.0000728        
  2   2530.9030000              0.0007303        
  3    821.4820000              0.0036333        
  4    313.2522000              0.0175155        
  5    132.1094000              0.0504807        
  6     59.5875100              0.1416367        
  7     28.0039900              0.2380227        
  8     13.5042500              0.2953867        
  9      6.4018810             -2.3891610        
 10      2.9857690              2.9777104        
 11      1.3369020             -1.2389870        
 12      0.5499610             -0.8640304        
 13      0.2199840              2.1021802        
 14      0.0879940             -2.1510650        
 15      0.0351980              1.0853729        
D   10
  1    305.0115000              0.0010250        
  2     91.4000300              0.0088467        
  3     34.9582900              0.0406831        
  4     14.8369700              0.1232399        
  5      6.6807480              0.2479330        
  6      3.0290260              0.3308668        
  7      1.3348390              0.3173635        
  8      0.5586080              0.2230148        
  9      0.2117430              0.0809221        
 10      0.0846970              0.0035432        
D   10
  1    305.0115000             -0.0013860        
  2     91.4000300             -0.0120163        
  3     34.9582900             -0.0559640        
  4     14.8369700             -0.1760541        
  5      6.6807480             -0.3491389        
  6      3.0290260             -0.2730933        
  7      1.3348390              0.2110472        
  8      0.5586080              0.5180431        
  9      0.2117430              0.2610813        
 10      0.0846970              0.0202449        
D   10
  1    305.0115000              0.0015239        
  2     91.4000300              0.0136362        
  3     34.9582900              0.0625750        
  4     14.8369700              0.2169856        
  5      6.6807480              0.4015913        
  6      3.0290260             -0.1695897        
  7      1.3348390             -0.7039918        
  8      0.5586080              0.1308419        
  9      0.2117430              0.5940125        
 10      0.0846970              0.1801863        
D   10
  1    305.0115000             -0.0017946        
  2     91.4000300             -0.0175296        
  3     34.9582900             -0.0760590        
  4     14.8369700             -0.3077546        
  5      6.6807480             -0.4047826        
  6      3.0290260              0.8631571        
  7      1.3348390              0.1240994        
  8      0.5586080             -0.9362263        
  9      0.2117430              0.3962795        
 10      0.0846970              0.5183450        
D   10
  1    305.0115000              0.0017850        
  2     91.4000300              0.0261188        
  3     34.9582900              0.0832537        
  4     14.8369700              0.5297035        
  5      6.6807480             -0.0462489        
  6      3.0290260             -1.2273100        
  7      1.3348390              1.4455574        
  8      0.5586080             -0.4462594        
  9      0.2117430             -0.7216395        
 10      0.0846970              0.9250047        
F   6
  1     16.5744000              0.0455715        
  2      6.5695000              0.2153603        
  3      2.6039000              0.4696477        
  4      1.0321000              0.4040690        
  5      0.4091000              0.1630365        
  6      0.1621000              0.0236161        
F   6
  1     16.5744000             -0.0941222        
  2      6.5695000             -0.4366455        
  3      2.6039000             -0.3740533        
  4      1.0321000              0.4286155        
  5      0.4091000              0.4724145        
  6      0.1621000              0.0987123        
F   6
  1     16.5744000              0.1873342        
  2      6.5695000              0.6545053        
  3      2.6039000             -0.4433802        
  4      1.0321000             -0.5452492        
  5      0.4091000              0.6677663        
  6      0.1621000              0.2400460        
G   4
  1      9.3740000             -0.0925447        
  2      3.6844000             -0.4764832        
  3      1.4482000             -0.5052273        
  4      0.5692000             -0.1957453        
G   4
  1      9.3740000              0.4204175        
  2      3.6844000              0.5515246        
  3      1.4482000             -0.4297044        
  4      0.5692000             -0.4738866        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Ga
data:
GALLIUM
S   1
  1      0.0142880              1.0000000        
P   1
  1      0.0086370              1.0000000        
D   1
  1      0.0290170              1.0000000        
F   1
  1      0.0633370              1.0000000        
G   1
  1      0.1689980              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Ge
data:
GERMANIUM
S   1
  1      0.0220260              1.0000000        
P   1
  1      0.0142970              1.0000000        
D   1
  1      0.0435390              1.0000000        
F   1
  1      0.0878230              1.0000000        
G   1
  1      0.2181000              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: As
data:
ARSENIC
S   1
  1      0.0304900              1.0000000        
P   1
  1      0.0183930              1.0000000        
D   1
  1      0.0658230              1.0000000        
F   1
  1      0.1091440              1.0000000        
G   1
  1      0.2340840              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Se
data:
SELENIUM
S   1
  1      0.0570320              1.0000000        
P   1
  1      0.0380630              1.0000000        
D   1
  1      0.0792440              1.0000000        
F   1
  1      0.1277090              1.0000000        
G   1
  1      0.2694910              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Br
data:
BROMINE
S   1
  1      0.0708980              1.0000000        
P   1
  1      0.0469860              1.0000000        
D   1
  1      0.1230070              1.0000000        
F   1
  1      0.1821610              1.0000000        
G   1
  1      0.3196180              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: In
data:
INDIUM
S   1
  1      0.0143600              1.0000000        
P   1
  1      0.0091890              1.0000000        
D   1
  1      0.0296980              1.0000000        
F   1
  1      0.0552910              1.0000000        
G   1
  1      0.1443600              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Sn
data:
TIN
S   1
  1      0.0124370              1.0000000        
P   1
  1      0.0146980              1.0000000        
D   1
  1      0.0444880              1.0000000        
F   1
  1      0.0738380              1.0000000        
G   1
  1      0.1751010              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Sb
data:
ANTIMONY
S   1
  1      0.0244390              1.0000000        
P   1
  1      0.0182360              1.0000000        
D   1
  1      0.0512360              1.0000000        
F   1
  1      0.0890460              1.0000000        
G   1
  1      0.1854140              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: Te
data:
TELLURIUM
S   1
  1      0.0497320              1.0000000        
P   1
  1      0.0320360              1.0000000        
D   1
  1      0.0628290              1.0000000        
F   1
  1      0.1042840              1.0000000        
G   1
  1      0.2102630              1.0000000        


name: SDB-aug-cc-pVQZ Diffuse
description: 1D Diffuse Functions
elt: I
data:
IODINE
S   1
  1      0.0581080              1.0000000        
P   1
  1      0.0376530              1.0000000        
D   1
  1      0.0747970              1.0000000        
F   1
  1      0.1507360              1.0000000        
G   1
  1      0.2442490              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   11
  1    183.6812990              0.0000460        
  2    101.6371440             -0.0002650        
  3     56.2393070              0.0009720        
  4     31.1191320             -0.0033350        
  5     17.2192800              0.0135370        
  6      9.5280160             -0.0602290        
  7      5.2721770              0.1745210        
  8      2.9172760             -0.1409590        
  9      1.6142290             -0.1325860        
 10      0.8932080             -0.1725520        
 11      0.2128450              0.4708480        
S   1
  1      0.4934650              1.0000000        
S   1
  1      0.0442640              1.0000000        
S   1
  1      0.0976160              1.0000000        
S   1
  1      0.0142880              1.0000000        
P   7
  1     16.3427320              0.0006170        
  2      9.0348110             -0.0063630        
  3      4.9947470              0.0317160        
  4      2.7612640             -0.0473460        
  5      1.5265190             -0.0485180        
  6      0.8439110             -0.0000290        
  7      0.1428090              0.3992510        
P   1
  1      0.3257830              1.0000000        
P   1
  1      0.0274030              1.0000000        
P   1
  1      0.0628660              1.0000000        
P   1
  1      0.0086370              1.0000000        
D   1
  1      0.4333420              1.0000000        
D   1
  1      0.1885190              1.0000000        
D   1
  1      0.0820120              1.0000000        
D   1
  1      0.0290170              1.0000000        
F   1
  1      0.4912310              1.0000000        
F   1
  1      0.1774170              1.0000000        
F   1
  1      0.0633370              1.0000000        
G   1
  1      0.3969130              1.0000000        
G   1
  1      0.1689980              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   11
  1    592.2227540             -0.0000190        
  2    299.5004840              0.0001000        
  3    151.4641900             -0.0003130        
  4     76.5988780              0.0008530        
  5     38.7377900             -0.0024180        
  6     19.5905800              0.0087550        
  7      9.9074010             -0.0432530        
  8      5.0103970              0.1713900        
  9      2.5338720             -0.2158420        
 10      1.2814360             -0.2356390        
 11      0.3085610              0.4601100        
S   1
  1      0.5804130              1.0000000        
S   1
  1      0.0612490              1.0000000        
S   1
  1      0.1385560              1.0000000        
S   1
  1      0.0220260              1.0000000        
P   7
  1     39.8392630             -0.0000910        
  2     19.8113590              0.0007200        
  3      9.8518380             -0.0055920        
  4      4.8991440              0.0369160        
  5      2.4362580             -0.0945060        
  6      1.2115080             -0.0406190        
  7      0.2001130              0.4233010        
P   1
  1      0.4381410              1.0000000        
P   1
  1      0.0394470              1.0000000        
P   1
  1      0.0899340              1.0000000        
P   1
  1      0.0142970              1.0000000        
D   1
  1      0.5165310              1.0000000        
D   1
  1      0.2347290              1.0000000        
D   1
  1      0.1066690              1.0000000        
D   1
  1      0.0435390              1.0000000        
F   1
  1      0.5726360              1.0000000        
F   1
  1      0.2202010              1.0000000        
F   1
  1      0.0878230              1.0000000        
G   1
  1      0.4633960              1.0000000        
G   1
  1      0.2181000              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   11
  1    496.0746690              0.0000290        
  2    251.7883940             -0.0000020        
  3    127.7980900              0.0000320        
  4     64.8653880              0.0002310        
  5     32.9231720             -0.0004030        
  6     16.7105340              0.0027270        
  7      8.4816230             -0.0190750        
  8      4.3049450              0.1361090        
  9      2.1850240             -0.2911950        
 10      1.1090340             -0.2076360        
 11      0.1284130              0.4033810        
S   1
  1      0.2578990              1.0000000        
S   1
  1      0.0624670              1.0000000        
S   1
  1      0.5075100              1.0000000        
S   1
  1      0.0304900              1.0000000        
P   7
  1     41.4842770             -0.0000540        
  2     20.4337600              0.0004690        
  3     10.0649830             -0.0040960        
  4      4.9576720              0.0352440        
  5      2.4419830             -0.1155690        
  6      1.2028380             -0.0371340        
  7      0.1131620              0.3909370        
P   1
  1      0.2455840              1.0000000        
P   1
  1      0.0505590              1.0000000        
P   1
  1      0.5249080              1.0000000        
P   1
  1      0.0183930              1.0000000        
D   1
  1      1.3218810              1.0000000        
D   1
  1      0.4872570              1.0000000        
D   1
  1      0.1796070              1.0000000        
D   1
  1      0.0658230              1.0000000        
F   1
  1      0.6876290              1.0000000        
F   1
  1      0.2723920              1.0000000        
F   1
  1      0.1091440              1.0000000        
G   1
  1      0.5534560              1.0000000        
G   1
  1      0.2340840              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   11
  1    522.2066270              0.0000120        
  2    268.1260450              0.0000290        
  3    137.6688310             -0.0000860        
  4     70.6858120              0.0004230        
  5     36.2935020             -0.0011160        
  6     18.6348330              0.0049530        
  7      9.5680210             -0.0318050        
  8      4.9126830              0.1821030        
  9      2.5224080             -0.3325320        
 10      1.2951260             -0.2403320        
 11      0.0751520              0.0818210        
S   1
  1      0.3134160              1.0000000        
S   1
  1      0.6044890              1.0000000        
S   1
  1      0.1564510              1.0000000        
S   1
  1      0.0570320              1.0000000        
P   7
  1     38.7220300              0.0001650        
  2     18.8022560              0.0001260        
  3      9.1298120             -0.0001570        
  4      4.4331630              0.0173710        
  5      2.1526110             -0.1135640        
  6      1.0452430              0.0166320        
  7      0.0539470              0.0868900        
P   1
  1      0.2546820              1.0000000        
P   1
  1      0.5326430              1.0000000        
P   1
  1      0.1191950              1.0000000        
P   1
  1      0.0380630              1.0000000        
D   1
  1      1.5318250              1.0000000        
D   1
  1      0.5677030              1.0000000        
D   1
  1      0.2103940              1.0000000        
D   1
  1      0.0792440              1.0000000        
F   1
  1      0.7744320              1.0000000        
F   1
  1      0.2975330              1.0000000        
F   1
  1      0.1277090              1.0000000        
G   1
  1      0.5828320              1.0000000        
G   1
  1      0.2694910              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   11
  1    762.0066790              0.0000520        
  2    376.6365900             -0.0000230        
  3    186.1599440              0.0001490        
  4     92.0131660              0.0001420        
  5     45.4792930              0.0001820        
  6     22.4790230              0.0014490        
  7     11.1106930             -0.0118330        
  8      5.4916760              0.1119000        
  9      2.7143670             -0.2561560        
 10      1.3416290             -0.4007910        
 11      0.0901270              0.0897840        
S   1
  1      0.3988620              1.0000000        
S   1
  1      0.9528400              1.0000000        
S   1
  1      0.1919290              1.0000000        
S   1
  1      0.0708980              1.0000000        
P   7
  1     77.0646890              0.0000120        
  2     33.1900760              0.0001780        
  3     14.2942400             -0.0008620        
  4      6.1562170              0.0165350        
  5      2.6513480             -0.1173210        
  6      1.1418780             -0.0129850        
  7      0.0641740              0.0906150        
P   1
  1      0.3131070              1.0000000        
P   1
  1      0.1442090              1.0000000        
P   1
  1      0.6656170              1.0000000        
P   1
  1      0.0469860              1.0000000        
D   1
  1      0.6420240              1.0000000        
D   1
  1      0.3557380              1.0000000        
D   1
  1      0.1971100              1.0000000        
D   1
  1      0.1230070              1.0000000        
F   1
  1      0.9173490              1.0000000        
F   1
  1      0.3599340              1.0000000        
F   1
  1      0.1821610              1.0000000        
G   1
  1      0.6655780              1.0000000        
G   1
  1      0.3196180              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: In
data:
INDIUM
S   11
  1    260.4103720              0.0000290        
  2    140.3828170             -0.0000600        
  3     75.6779970              0.0001780        
  4     40.7967250             -0.0002890        
  5     21.9928230              0.0008310        
  6     11.8559580             -0.0019540        
  7      6.3913460              0.0082930        
  8      3.4454660             -0.0518320        
  9      1.8573920              0.2843780        
 10      1.0012890             -0.5640840        
 11      0.2006590              0.4696610        
S   1
  1      0.5397780              1.0000000        
S   1
  1      0.0408800              1.0000000        
S   1
  1      0.0910510              1.0000000        
S   1
  1      0.0143600              1.0000000        
P   7
  1     48.6768460              0.0000410        
  2     22.0983850             -0.0002010        
  3     10.0322570              0.0008460        
  4      4.5544590             -0.0048970        
  5      2.0676400              0.0400620        
  6      0.9386700             -0.1697800        
  7      0.1658410              0.3708640        
P   1
  1      0.4261390              1.0000000        
P   1
  1      0.0281940              1.0000000        
P   1
  1      0.0683640              1.0000000        
P   1
  1      0.0091890              1.0000000        
D   1
  1      0.6271790              1.0000000        
D   1
  1      0.2358160              1.0000000        
D   1
  1      0.0886660              1.0000000        
D   1
  1      0.0296980              1.0000000        
F   1
  1      0.3952170              1.0000000        
F   1
  1      0.1467980              1.0000000        
F   1
  1      0.0552910              1.0000000        
G   1
  1      0.3239900              1.0000000        
G   1
  1      0.1443600              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Sn
data:
TIN
S   11
  1     38.4899420              0.0001220        
  2     24.2856410             -0.0006380        
  3     15.3232850              0.0025740        
  4      9.6683900             -0.0108040        
  5      6.1003740              0.0552060        
  6      3.8490960             -0.2612420        
  7      2.4286290              0.7008960        
  8      1.5323690             -0.6044690        
  9      0.9668650             -0.2359100        
 10      0.6100540             -0.1507990        
 11      0.1866400              0.5652490        
S   1
  1      0.3849200              1.0000000        
S   1
  1      0.0444900              1.0000000        
S   1
  1      0.0920920              1.0000000        
S   1
  1      0.0124370              1.0000000        
P   7
  1     60.2212000              0.0000420        
  2     27.5393180             -0.0002100        
  3     12.5938050              0.0009210        
  4      5.7591810             -0.0056980        
  5      2.6336890              0.0451000        
  6      1.2043930             -0.1728060        
  7      0.2244350              0.3889450        
P   1
  1      0.5507720              1.0000000        
P   1
  1      0.0396340              1.0000000        
P   1
  1      0.0951810              1.0000000        
P   1
  1      0.0146980              1.0000000        
D   1
  1      0.2938450              1.0000000        
D   1
  1      0.1610550              1.0000000        
D   1
  1      0.0882730              1.0000000        
D   1
  1      0.0444880              1.0000000        
F   1
  1      0.4556300              1.0000000        
F   1
  1      0.1767360              1.0000000        
F   1
  1      0.0738380              1.0000000        
G   1
  1      0.3591600              1.0000000        
G   1
  1      0.1751010              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Sb
data:
ANTIMONY
S   11
  1    134.4073070             -0.0000050        
  2     78.1665010              0.0001560        
  3     45.4588520             -0.0006210        
  4     26.4372480              0.0020130        
  5     15.3749620             -0.0061710        
  6      8.9415300              0.0238200        
  7      5.2000750             -0.1121760        
  8      3.0241780              0.3682080        
  9      1.7587540             -0.3713390        
 10      1.0228290             -0.3157270        
 11      0.5948410              0.0000160        
S   1
  1      0.0598450              1.0000000        
S   1
  1      0.2706150              1.0000000        
S   1
  1      0.1285220              1.0000000        
S   1
  1      0.0244390              1.0000000        
P   7
  1     53.7217630              0.0000530        
  2     25.4683320             -0.0002790        
  3     12.0739880              0.0012910        
  4      5.7240180             -0.0084230        
  5      2.7136340              0.0629900        
  6      1.2864750             -0.2177580        
  7      0.2681730              0.4242890        
P   1
  1      0.6098900              1.0000000        
P   1
  1      0.0500490              1.0000000        
P   1
  1      0.1174810              1.0000000        
P   1
  1      0.0182360              1.0000000        
D   1
  1      0.8023570              1.0000000        
D   1
  1      0.3301090              1.0000000        
D   1
  1      0.1358150              1.0000000        
D   1
  1      0.0512360              1.0000000        
F   1
  1      0.5423170              1.0000000        
F   1
  1      0.2149260              1.0000000        
F   1
  1      0.0890460              1.0000000        
G   1
  1      0.4148900              1.0000000        
G   1
  1      0.1854140              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Te
data:
TELLURIUM
S   12
  1    356.2703560              0.0000780        
  2    200.2259260             -0.0001580        
  3    112.5280860              0.0004070        
  4     63.2414120             -0.0005760        
  5     35.5420260              0.0013890        
  6     19.9748170             -0.0026460        
  7     11.2259580              0.0089500        
  8      6.3090510             -0.0437500        
  9      3.5457220              0.1842070        
 10      1.9927150             -0.1940200        
 11      1.1199170             -0.3627430        
 12      0.0680180              0.1275080        
S   1
  1      0.3022750              1.0000000        
S   1
  1      0.6333530              1.0000000        
S   1
  1      0.1455260              1.0000000        
S   1
  1      0.0497320              1.0000000        
P   8
  1     30.8220740              0.0001610        
  2     17.3592880             -0.0011280        
  3      9.7769170              0.0062950        
  4      5.5064540             -0.0359990        
  5      3.1012880              0.1493110        
  6      1.7466750             -0.2489380        
  7      0.9837440             -0.0648310        
  8      0.0443650              0.0829350        
P   1
  1      0.1981350              1.0000000        
P   1
  1      0.4038890              1.0000000        
P   1
  1      0.0951630              1.0000000        
P   1
  1      0.0320360              1.0000000        
D   1
  1      0.9647710              1.0000000        
D   1
  1      0.3941280              1.0000000        
D   1
  1      0.1610090              1.0000000        
D   1
  1      0.0628290              1.0000000        
F   1
  1      0.5924370              1.0000000        
F   1
  1      0.2287610              1.0000000        
F   1
  1      0.1042840              1.0000000        
G   1
  1      0.4281190              1.0000000        
G   1
  1      0.2102630              1.0000000        


name: SDB-aug-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: I
data:
IODINE
S   11
  1    208.3634160              0.0000170        
  2    117.8734120              0.0000430        
  3     66.6822490             -0.0002200        
  4     37.7228610              0.0008860        
  5     21.3402260             -0.0029400        
  6     12.0723940              0.0131530        
  7      6.8294820             -0.0737860        
  8      3.8635110              0.2725530        
  9      2.1856300             -0.2496550        
 10      1.2364340             -0.4287590        
 11      0.0775970              0.1220050        
S   1
  1      0.3405190              1.0000000        
S   1
  1      0.6858370              1.0000000        
S   1
  1      0.1656200              1.0000000        
S   1
  1      0.0581080              1.0000000        
P   7
  1      9.5386090              0.0019140        
  2      5.9554680             -0.0213810        
  3      3.7183190              0.0942320        
  4      2.3215470             -0.0995310        
  5      1.4494670             -0.1457100        
  6      0.9049800             -0.0001730        
  7      0.0496780              0.0744090        
P   1
  1      0.2183660              1.0000000        
P   1
  1      0.4373980              1.0000000        
P   1
  1      0.1059870              1.0000000        
P   1
  1      0.0376530              1.0000000        
D   1
  1      1.0796940              1.0000000        
D   1
  1      0.4488510              1.0000000        
D   1
  1      0.1865970              1.0000000        
D   1
  1      0.0747970              1.0000000        
F   1
  1      0.7012160              1.0000000        
F   1
  1      0.2728500              1.0000000        
F   1
  1      0.1507360              1.0000000        
G   1
  1      0.4798740              1.0000000        
G   1
  1      0.2442490              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Ga
data:
GALLIUM
S   1
  1      0.0287480              1.0000000        
P   1
  1      0.0146100              1.0000000        
D   1
  1      0.0349270              1.0000000        
F   1
  1      0.0969550              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Ge
data:
GERMANIUM
S   1
  1      0.0427720              1.0000000        
P   1
  1      0.0258390              1.0000000        
D   1
  1      0.0509290              1.0000000        
F   1
  1      0.1330530              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: As
data:
ARSENIC
S   1
  1      0.0538310              1.0000000        
P   1
  1      0.0370980              1.0000000        
D   1
  1      0.0626400              1.0000000        
F   1
  1      0.1582380              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Se
data:
SELENIUM
S   1
  1      0.0664920              1.0000000        
P   1
  1      0.0415830              1.0000000        
D   1
  1      0.0776480              1.0000000        
F   1
  1      0.1915460              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Br
data:
BROMINE
S   1
  1      0.0808210              1.0000000        
P   1
  1      0.0510520              1.0000000        
D   1
  1      0.0967350              1.0000000        
F   1
  1      0.2592890              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: In
data:
INDIUM
S   1
  1      0.0259950              1.0000000        
P   1
  1      0.0149830              1.0000000        
D   1
  1      0.0295360              1.0000000        
F   1
  1      0.0826760              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Sn
data:
TIN
S   1
  1      0.0347710              1.0000000        
P   1
  1      0.0252210              1.0000000        
D   1
  1      0.0418500              1.0000000        
F   1
  1      0.1074800              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Sb
data:
ANTIMONY
S   1
  1      0.0428380              1.0000000        
P   1
  1      0.0322940              1.0000000        
D   1
  1      0.0530050              1.0000000        
F   1
  1      0.1260310              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: Te
data:
TELLURIUM
S   1
  1      0.0545640              1.0000000        
P   1
  1      0.0362710              1.0000000        
D   1
  1      0.0662560              1.0000000        
F   1
  1      0.1481570              1.0000000        


name: SDB-aug-cc-pVTZ Diffuse
description: 1D Diffuse Functions
elt: I
data:
IODINE
S   1
  1      0.0657390              1.0000000        
P   1
  1      0.0418350              1.0000000        
D   1
  1      0.0738310              1.0000000        
F   1
  1      0.1939730              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Li
data:
LITHIUM
L   3
  1      0.6177000             -0.1628700              0.0620500        
  2      0.1434000              0.1264300              0.2471900        
  3      0.0504800              0.7617900              0.5214000        
L   1
  1      0.0192300              0.2180000              0.3429000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Be
data:
BERYLLIUM
L   3
  1      1.4470000             -0.1564700              0.0892400        
  2      0.3522000              0.1091900              0.3099900        
  3      0.1219000              0.6753800              0.5184200        
L   1
  1      0.0439500              0.3298700              0.2791100        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: B
data:
BORON
L   3
  1      2.7100000             -0.1498700              0.0947400        
  2      0.6552000              0.0844200              0.3080700        
  3      0.2248000              0.6975100              0.4687600        
L   1
  1      0.0758400              0.3284200              0.3502500        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: C
data:
CARBON
L   3
  1      4.2860000             -0.1472200              0.1025700        
  2      1.0460000              0.0812500              0.3298700        
  3      0.3447000              0.7136000              0.4821200        
L   1
  1      0.1128000              0.3152100              0.3159300        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: N
data:
NITROGEN
L   3
  1      6.4030000             -0.1395500              0.1033600        
  2      1.5800000              0.0549200              0.3320500        
  3      0.5094000              0.7167800              0.4870800        
L   1
  1      0.1623000              0.3321000              0.3131200        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: O
data:
OXYGEN
L   3
  1      8.5190000             -0.1455100              0.1100700        
  2      2.0730000              0.0828600              0.3496900        
  3      0.6471000              0.7432500              0.4809300        
L   1
  1      0.2000000              0.2847200              0.3072700        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: F
data:
FLUORINE
L   3
  1     11.1200000             -0.1445100              0.1130000        
  2      2.6870000              0.0897100              0.3584100        
  3      0.8210000              0.7565900              0.4800200        
L   1
  1      0.2475000              0.2657000              0.3038100        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ne
data:
NEON
L   3
  1     14.0700000             -0.1446300              0.1151400        
  2      3.3890000              0.0933100              0.3647900        
  3      1.0210000              0.7629700              0.4805200        
L   1
  1      0.3031000              0.2566100              0.2989600        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Na
data:
SODIUM
L   3
  1      0.4299000             -0.2087400             -0.0257100        
  2      0.0889700              0.3120600              0.2160800        
  3      0.0355000              0.7030000              0.5419600        
L   1
  1      0.0145500              0.1164800              0.3548400        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Mg
data:
MAGNESIUM
L   3
  1      0.6606000             -0.2445100             -0.0442100        
  2      0.1845000              0.2532300              0.2732300        
  3      0.0698300              0.6972000              0.5762600        
L   1
  1      0.0274000              0.2165500              0.2815200        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Al
data:
ALUMINUM
L   3
  1      0.9011000             -0.3037700             -0.0792900        
  2      0.4495000              0.1338200              0.1654000        
  3      0.1405000              0.7603700              0.5301500        
L   1
  1      0.0487400              0.3223200              0.4772400        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Si
data:
SILICON
L   3
  1      1.1670000             -0.3240300             -0.0845000        
  2      0.5268000              0.1843800              0.2378600        
  3      0.1807000              0.7773700              0.5653200        
L   1
  1      0.0648000              0.2676700              0.3743300        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: P
data:
PHOSPHOROUS
L   3
  1      1.4590000             -0.3409100             -0.0937800        
  2      0.6549000              0.2153500              0.2920500        
  3      0.2256000              0.7957800              0.5868800        
L   1
  1      0.0811500              0.2309200              0.3063100        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: S
data:
SULFUR
L   3
  1      1.8170000             -0.3401500             -0.1009600        
  2      0.8379000              0.1960100              0.3124400        
  3      0.2854000              0.8266600              0.5790600        
L   1
  1      0.0993900              0.2165200              0.3074800        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Cl
data:
CHLORINE
L   3
  1      2.2250000             -0.3309800             -0.1260400        
  2      1.1730000              0.1152800              0.2995200        
  3      0.3851000              0.8471700              0.5835700        
L   1
  1      0.1301000              0.2653400              0.3409700        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ar
data:
ARGON
L   3
  1      2.7060000             -0.3128600             -0.1092700        
  2      1.2780000              0.1182100              0.3260100        
  3      0.4354000              0.8678600              0.5795200        
L   1
  1      0.1476000              0.2226400              0.3034900        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: K
data:
POTASSIUM
L   3
  1      0.2201000             -0.2860270             -0.0662450        
  2      0.0482500              0.4820500              0.3568980        
  3      0.0224200              0.6758410              0.7044260        
L   1
  1      0.0102000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ca
data:
CALCIUM
L   3
  1      0.2604000             -0.6764660             -0.2703740        
  2      0.1439000              0.5256930              0.4078070        
  3      0.0485900              0.9602160              0.8281290        
L   1
  1      0.0216700              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Sc
data:
SCANDIUM
L   4
  1     40.0700000             -0.0032960             -0.0077530        
  2      3.6650000             -0.6556170             -0.6155920        
  3      3.0470000              0.1032530              0.7802610        
  4      0.9588000              1.3201990              0.8340790        
L   2
  1      1.2640000             -0.0575960             -0.0317790        
  2      0.0750200              1.0164680              1.0040650        
L   1
  1      0.0274100              1.0000000              1.0000000        
L   1
  1      0.3557000              1.0000000              1.0000000        
D   4
  1     23.2400000              0.0262880        
  2      6.1430000              0.1428810        
  3      2.0070000              0.3981780        
  4      0.6652000              0.6402010        
D   1
  1      0.2021000              1.0000000        
D   1
  1      0.0545400              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ti
data:
TITANIUM
L   4
  1     51.0800000             -0.0020040             -0.0069490        
  2      4.1800000             -0.6196860             -0.3266130        
  3      2.9970000              0.1560290              0.5442540        
  4      1.0190000              1.2488170              0.7896310        
L   2
  1      1.3830000             -0.0728910             -0.0259490        
  2      0.0812800              1.0201840              1.0033530        
L   1
  1      0.0302300              1.0000000              1.0000000        
L   1
  1      0.3745000              1.0000000              1.0000000        
D   4
  1     28.1100000              0.0257460        
  2      7.6300000              0.1412600        
  3      2.5280000              0.4006070        
  4      0.8543000              0.6345320        
D   1
  1      0.2673000              1.0000000        
D   1
  1      0.0743000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: V
data:
VANADIUM
L   4
  1     48.1600000             -0.0042770             -0.0080070        
  2      4.6850000             -0.5455540             -0.2656730        
  3      3.1150000              0.1317990              0.5229440        
  4      1.0980000              1.2180220              0.7544340        
L   2
  1      1.5650000             -0.0854260             -0.0228160        
  2      0.0940900              1.0235840              1.0030660        
L   1
  1      0.0337000              1.0000000              1.0000000        
L   1
  1      0.3936000              1.0000000              1.0000000        
D   4
  1     33.3600000              0.0255300        
  2      9.3310000              0.1403360        
  3      3.1580000              0.3979330        
  4      1.1130000              0.6290270        
D   1
  1      0.3608000              1.0000000        
D   1
  1      0.1007000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Cr
data:
CHROMIUM
L   4
  1     23.1200000             -0.0059180             -0.0180180        
  2      5.0360000             -0.5907500             -0.1449960        
  3      2.8670000              0.2961200              0.4974160        
  4      1.1440000              1.1076460              0.6728840        
L   2
  1      1.5710000             -0.0903290             -0.0372810        
  2      0.0965400              1.0251640              1.0048790        
L   1
  1      0.0349200              1.0000000              1.0000000        
L   1
  1      0.4529000              1.0000000              1.0000000        
D   4
  1     37.8900000              0.0259100        
  2     10.5800000              0.1441300        
  3      3.6030000              0.4035970        
  4      1.2700000              0.6208460        
D   1
  1      0.4118000              1.0000000        
D   1
  1      0.1126000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Mn
data:
MANGANESE
L   4
  1     72.1700000             -0.0026350             -0.0071720        
  2      5.7280000             -0.5931840             -0.2456490        
  3      3.7290000              0.2246560              0.5322830        
  4      1.3210000              1.1753420              0.7305360        
L   2
  1      1.8270000             -0.0961460             -0.0326000        
  2      0.1130000              1.0266680              1.0043760        
L   1
  1      0.0389000              1.0000000              1.0000000        
L   1
  1      0.4754000              1.0000000              1.0000000        
D   4
  1     42.6300000              0.0260950        
  2     11.9700000              0.1467720        
  3      4.0910000              0.4071150        
  4      1.4500000              0.6145900        
D   1
  1      0.4700000              1.0000000        
D   1
  1      0.1281000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Fe
data:
IRON
L   4
  1     70.2800000             -0.0026110             -0.0079400        
  2      6.0610000             -0.6924350             -0.2901510        
  3      4.1340000              0.3625300              0.5910280        
  4      1.4210000              1.1406450              0.7194480        
L   2
  1      1.9780000             -0.0981720             -0.0337310        
  2      0.1213000              1.0269570              1.0044620        
L   1
  1      0.0410000              1.0000000              1.0000000        
L   1
  1      0.5121000              1.0000000              1.0000000        
D   4
  1     47.1000000              0.0266080        
  2     13.1200000              0.1520100        
  3      4.4780000              0.4138270        
  4      1.5810000              0.6055420        
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1382000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Co
data:
COBALT
L   4
  1     75.6800000             -0.0052710             -0.0080850        
  2      6.4960000             -0.7055250             -0.3909880        
  3      4.7910000              0.3478800              0.6800780        
  4      1.5940000              1.1755950              0.7295940        
L   2
  1      2.3370000             -0.0892670             -0.0159350        
  2      0.1269000              1.0225890              1.0019450        
L   1
  1      0.0423200              1.0000000              1.0000000        
L   1
  1      0.5572000              1.0000000              1.0000000        
D   4
  1     51.6900000              0.0254470        
  2     14.7000000              0.1495290        
  3      4.8510000              0.4250560        
  4      1.6430000              0.6054650        
D   1
  1      0.5075000              1.0000000        
D   1
  1      0.1433000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ni
data:
NICKEL
L   4
  1     89.3600000             -0.0052200             -0.0075290        
  2      7.2650000             -0.6839930             -0.4458620        
  3      5.5720000              0.2510500              0.7063640        
  4      1.8500000              1.2364510              0.7536060        
L   2
  1      3.2350000             -0.0634180              0.0011360        
  2      0.1295000              1.0132370              0.9998950        
L   1
  1      0.0432700              1.0000000              1.0000000        
L   1
  1      0.6594000              1.0000000              1.0000000        
D   4
  1     58.7300000              0.0262460        
  2     16.7100000              0.1503340        
  3      5.7830000              0.4133850        
  4      2.0640000              0.6041140        
D   1
  1      0.6752000              1.0000000        
D   1
  1      0.1825000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Cu
data:
COPPER
L   4
  1     83.4200000             -0.0048290             -0.0082840        
  2      7.9700000             -0.6447990             -0.3218950        
  3      5.6000000              0.2652400              0.6181330        
  4      1.9320000              1.1897910              0.7221840        
L   2
  1      2.8660000             -0.0747740             -0.0005410        
  2      0.1319000              1.0170370              1.0000580        
L   1
  1      0.0440000              1.0000000              1.0000000        
L   1
  1      0.6874000              1.0000000              1.0000000        
D   4
  1     65.8000000              0.0255970        
  2     18.8200000              0.1486090        
  3      6.5380000              0.4117860        
  4      2.3480000              0.6055070        
D   1
  1      0.7691000              1.0000000        
D   1
  1      0.2065000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Zn
data:
ZINC
L   4
  1    113.5000000             -0.0042800             -0.0074290        
  2      8.3080000             -0.8202320             -0.4326050        
  3      6.3320000              0.4250060              0.7234510        
  4      2.1460000              1.1980770              0.7272170        
L   2
  1      2.9060000             -0.0823560             -0.0230010        
  2      0.1623000              1.0215740              1.0028240        
L   1
  1      0.0536900              1.0000000              1.0000000        
L   1
  1      0.8116000              1.0000000              1.0000000        
D   4
  1     65.9900000              0.0276530        
  2     19.8100000              0.1587940        
  3      6.9450000              0.4209710        
  4      2.5430000              0.5852770        
D   1
  1      0.9165000              1.0000000        
D   1
  1      0.3264000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ga
data:
GALLIUM
L   4
  1    113.9000000             -0.0017110             -0.0080460        
  2      9.1550000             -0.8230360             -0.3574320        
  3      6.6330000              0.4586180              0.6637940        
  4      2.2780000              1.1618170              0.7136190        
L   1
  1      0.0746100              1.0000000              1.0000000        
L   2
  1      2.1230000             -0.1455060             -0.0962610        
  2      0.1939000              1.0511470              1.0175730        
L   1
  1      0.8818000              1.0000000              1.0000000        
D   4
  1     70.4300000              0.0288770        
  2     21.0500000              0.1662530        
  3      7.4010000              0.4277760        
  4      2.7520000              0.5704100        
D   1
  1      1.0260000              1.0000000        
D   1
  1      0.3907000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ge
data:
GERMANIUM
L   4
  1      1.8340000              0.4938600              0.0064140        
  2      1.5290000             -0.8573540             -0.0860520        
  3      0.3594000              0.4108300              0.3832320        
  4      0.1470000              0.8003780              0.6981850        
L   1
  1      0.0559800              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: As
data:
ARSENIC
L   4
  1      2.7090000              0.1214790             -0.0029200        
  2      1.5780000             -0.5189180             -0.0950540        
  3      0.4358000              0.4287910              0.4246820        
  4      0.1776000              0.8080780              0.6712900        
L   1
  1      0.0698400              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Se
data:
SELENIUM
L   4
  1      3.7110000              0.0557440             -0.0060140        
  2      1.5860000             -0.5105200             -0.1214470        
  3      0.5339000              0.4807550              0.4526070        
  4      0.2085000              0.8102920              0.6697510        
L   1
  1      0.0782100              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Br
data:
BROMINE
L   4
  1      3.2760000              0.2005700              0.0054110        
  2      2.0440000             -0.6492960             -0.1323910        
  3      0.6398000              0.4054010              0.4300270        
  4      0.2561000              0.8726070              0.6860090        
L   1
  1      0.0956700              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Kr
data:
KRYPTON
L   4
  1      3.0810000              0.5337890              0.0359060        
  2      2.4130000             -1.0014650             -0.1696950        
  3      0.7386000              0.4155100              0.4350800        
  4      0.2941000              0.8801030              0.6857600        
L   1
  1      0.1095000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Rb
data:
RUBIDIUM
L   3
  1      0.1543000             -0.7533900             -0.1086840        
  2      0.0989200              0.4062700              0.0555870        
  3      0.0322700              1.1124870              1.0141680        
L   1
  1      0.0149000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Sr
data:
STRONTIUM
L   3
  1      0.1836000             -1.0751390             -0.9555490        
  2      0.1252000              0.9470370              0.8564470        
  3      0.0396800              0.9342260              0.8715580        
L   1
  1      0.0184000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Y
data:
YTTRIUM
L   4
  1     29.8400000             -0.0062940             -0.0034570        
  2      3.2420000              1.4362310             -0.0973860        
  3      2.6940000             -2.5502130             -0.0989330        
  4      0.8430000              1.7560650              1.1121900        
L   2
  1      1.3240000             -0.0579760             -0.0258910        
  2      0.0680600              1.0148740              1.0028330        
L   1
  1      0.0272900              1.0000000              1.0000000        
L   1
  1      0.3015000              1.0000000              1.0000000        
D   3
  1      5.3990000              0.0120200        
  2      1.0660000              0.3429500        
  3      0.3892000              0.7393970        
D   1
  1      0.1300000              1.0000000        
D   1
  1      0.0412100              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Zr
data:
ZIRCONIUM
L   4
  1     30.5300000             -0.0045040             -0.0040920        
  2      3.5180000              1.7088990             -0.0786650        
  3      2.9710000             -2.9185180             -0.1405880        
  4      0.9587000              1.8229580              1.1305260        
L   2
  1      0.9293000             -0.0619580             -0.0602170        
  2      0.0691000              1.0207390              1.0093020        
L   1
  1      0.0275900              1.0000000              1.0000000        
L   1
  1      0.3764000              1.0000000              1.0000000        
D   3
  1      6.1910000              0.0120000        
  2      1.3200000              0.3250050        
  3      0.5359000              0.7402990        
D   1
  1      0.1900000              1.0000000        
D   1
  1      0.0590000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Nb
data:
NIOBIUM
L   4
  1     38.5300000             -0.0020590             -0.0035760        
  2      3.9070000              1.6188670             -0.0332170        
  3      3.2740000             -2.8308600             -0.1855680        
  4      1.0520000              1.8184650              1.1334710        
L   2
  1      1.0570000             -0.0719190             -0.0678150        
  2      0.0787600              1.0237970              1.0102540        
L   1
  1      0.0309100              1.0000000              1.0000000        
L   1
  1      0.4165000              1.0000000              1.0000000        
D   3
  1      7.9940000              0.0104330        
  2      1.5500000              0.3180710        
  3      0.6666000              0.7396540        
D   1
  1      0.2462000              1.0000000        
D   1
  1      0.0786000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Mo
data:
MOLYBDENUM
L   4
  1     39.6700000             -0.0097160             -0.0040150        
  2      4.6330000              0.7701260             -0.0341460        
  3      3.2080000             -2.2295300             -0.2518170        
  4      1.2240000              2.0464950              1.1923470        
L   2
  1      1.1810000             -0.0752220             -0.0719710        
  2      0.0848900              1.0241370              1.0102270        
L   1
  1      0.0327600              1.0000000              1.0000000        
L   1
  1      0.4728000              1.0000000              1.0000000        
D   3
  1      9.0510000              0.0108830        
  2      1.7770000              0.3118290        
  3      0.7848000              0.7418020        
D   1
  1      0.2899000              1.0000000        
D   1
  1      0.0910700              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Tc
data:
TECHNETIUM
L   4
  1     48.8700000             -0.0064850             -0.0034920        
  2      4.7700000              1.3309300              0.0375140        
  3      3.7400000             -2.6988320             -0.2978010        
  4      1.3050000              1.9562630              1.1749000        
L   2
  1      1.7440000             -0.0942750             -0.0854010        
  2      0.1206000              1.0286040              1.0109460        
L   1
  1      0.0431000              1.0000000              1.0000000        
L   1
  1      0.4940000              1.0000000              1.0000000        
D   3
  1      9.4510000              0.0121950        
  2      1.8870000              0.3469500        
  3      0.8506000              0.7071230        
D   1
  1      0.3258000              1.0000000        
D   1
  1      0.1031000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ru
data:
RUTHENIUM
L   4
  1     56.0000000             -0.0028370             -0.0031980        
  2      4.6250000              1.8916610             -0.1037660        
  3      3.7930000             -3.4310110             -0.1275940        
  4      1.3670000              2.0744460              1.1465330        
L   2
  1      1.5280000             -0.0690350             -0.0729900        
  2      0.0967300              1.0203430              1.0086420        
L   1
  1      0.0363600              1.0000000              1.0000000        
L   1
  1      0.5183000              1.0000000              1.0000000        
D   3
  1     10.3000000              0.0119610        
  2      2.0440000              0.3645750        
  3      0.8988000              0.6943160        
D   1
  1      0.3443000              1.0000000        
D   1
  1      0.1108000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Rh
data:
RHODIUM
L   4
  1     56.8700000             -0.0030870             -0.0037480        
  2      5.9450000              0.7005100             -0.0147720        
  3      4.0780000             -2.1608670             -0.2689750        
  4      1.5470000              2.0294340              1.1936040        
L   2
  1      1.8940000             -0.0817000             -0.0710930        
  2      0.1179000              1.0233080              1.0082800        
L   1
  1      0.0421900              1.0000000              1.0000000        
L   1
  1      0.5963000              1.0000000              1.0000000        
D   3
  1     11.5600000              0.0135190        
  2      2.2400000              0.3700810        
  3      1.0150000              0.6849360        
D   1
  1      0.3960000              1.0000000        
D   1
  1      0.1262000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Pd
data:
PALLADIUM
L   4
  1     41.8200000             -0.0165220             -0.0055550        
  2      5.4600000              2.7494780              0.0567730        
  3      4.6000000             -4.4573430             -0.3886410        
  4      1.7520000              2.2539330              1.2319970        
L   2
  1      2.1770000             -0.0750290             -0.0561780        
  2      0.1149000              1.0190490              1.0055150        
L   1
  1      0.0421900              1.0000000              1.0000000        
L   1
  1      0.6691000              1.0000000              1.0000000        
D   3
  1     12.4000000              0.0137590        
  2      2.4040000              0.3941210        
  3      1.1430000              0.6559460        
D   1
  1      0.4693000              1.0000000        
D   1
  1      0.1513000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ag
data:
SILVER
L   4
  1     63.5600000             -0.0007310             -0.0042340        
  2      6.3900000              1.3927360              0.0612760        
  3      5.0220000             -2.8731020             -0.3387460        
  4      1.7890000              2.0173610              1.1908320        
L   2
  1      2.4510000             -0.0725390             -0.0498300        
  2      0.1561000              1.0213580              1.0065160        
L   1
  1      0.0522700              1.0000000              1.0000000        
L   1
  1      0.6871000              1.0000000              1.0000000        
D   3
  1     14.6400000              0.0136280        
  2      2.6930000              0.3726950        
  3      1.2330000              0.6812940        
D   1
  1      0.5057000              1.0000000        
D   1
  1      0.1900000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Cd
data:
CADMIUM
L   4
  1     63.3800000             -0.0004640             -0.0048740        
  2      6.7140000              2.2928770              0.1896300        
  3      5.6020000             -3.9028840             -0.4918720        
  4      1.9710000              2.0846040              1.2135010        
L   2
  1      2.6960000             -0.0648660             -0.0533380        
  2      0.1758000              1.0196610              1.0071020        
L   1
  1      0.0564700              1.0000000              1.0000000        
L   1
  1      0.7689000              1.0000000              1.0000000        
D   3
  1     15.5100000              0.0120650        
  2      2.9410000              0.3701680        
  3      1.3790000              0.6807600        
D   1
  1      0.5782000              1.0000000        
D   1
  1      0.2300000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: In
data:
INDIUM
L   4
  1     71.7600000              0.0007330             -0.0045130        
  2      7.6540000              1.0897810              0.0316150        
  3      5.6160000             -2.7310890             -0.3380060        
  4      2.1040000              2.1128440              1.2134640        
L   1
  1      0.0826700              1.0000000              1.0000000        
L   2
  1      2.6100000             -0.0996900             -0.1103170        
  2      0.1901000              1.0312300              1.0139000        
L   1
  1      0.8410000              1.0000000              1.0000000        
D   3
  1     17.1600000              0.0148930        
  2      3.1270000              0.3881350        
  3      1.4750000              0.6626390        
D   1
  1      0.6452000              1.0000000        
D   1
  1      0.2754000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Sn
data:
TIN
L   4
  1      2.6040000              0.0310420             -0.0050530        
  2      0.7532000             -0.6118590             -0.1801000        
  3      0.3191000              0.5481630              0.3700680        
  4      0.1239000              0.8491500              0.7813340        
L   1
  1      0.0479800              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Sb
data:
ANTIMONY
L   4
  1      0.9922000              0.6900760              0.1802290        
  2      0.8089000             -1.5804950             -0.4870930        
  3      0.4312000              0.8152480              0.4739360        
  4      0.1498000              0.8949940              0.8044140        
L   1
  1      0.0580300              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Te
data:
TELLURIUM
L   4
  1      2.3640000              0.0871790             -0.0039820        
  2      0.9769000             -0.7768260             -0.2369000        
  3      0.4647000              0.5632500              0.4014670        
  4      0.1771000              0.9260530              0.7931790        
L   1
  1      0.0673700              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: I
data:
IODINE
L   4
  1      2.6250000              0.0736600             -0.0088800        
  2      1.0140000             -0.8368700             -0.2573510        
  3      0.5009000              0.6562470              0.4553680        
  4      0.2023000              0.9007440              0.7601070        
L   1
  1      0.0780000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Xe
data:
XENON
L   4
  1      1.7390000              0.3490910             -0.0054290        
  2      1.1690000             -1.1975120             -0.2773420        
  3      0.5765000              0.7584090              0.4671890        
  4      0.2218000              0.8886990              0.7634560        
L   1
  1      0.0848600              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Cs
data:
CESIUM
L   3
  1      0.1157000             -0.5199940             -0.1505600        
  2      0.0531700              0.4933610              0.2216020        
  3      0.0189700              0.8723120              0.8964860        
L   1
  1      0.0077400              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ba
data:
BARIUM
L   3
  1      0.1266000             -1.5602870             -0.6866370        
  2      0.0943300              1.4825380              0.8073460        
  3      0.0302000              0.8789170              0.8224360        
L   1
  1      0.0153100              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: La
data:
LANTHANUM
L   5
  1      9.1730000             -0.0548330             -0.0097980        
  2      3.1200000              0.6766040              0.2312620        
  3      2.1040000             -1.0344290             -0.6012150        
  4      1.3200000             -0.5189070              0.1951890        
  5      0.4960000              1.6316030              1.0761370        
L   2
  1      0.6182000             -0.1070950             -0.0518690        
  2      0.0454600              1.0334480              1.0081080        
L   1
  1      0.0177500              1.0000000              1.0000000        
L   1
  1      0.2004000              1.0000000              1.0000000        
D   3
  1      1.2380000             -0.0537970        
  2      0.6061000              0.3801440        
  3      0.2518000              0.7203490        
D   1
  1      0.0978700              1.0000000        
D   1
  1      0.0353600              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ce
data:
CERIUM
L   3
  1      3.4570000              3.1374910              1.9497170        
  2      4.2910000             -1.4295170             -0.9123110        
  3      2.2900000             -2.6758480             -2.0200370        
L   1
  1      0.2857000              1.0000000              1.0000000        
L   1
  1      0.6684000              1.0000000              1.0000000        
L   1
  1      0.0695700              1.0000000              1.0000000        
D   2
  1      0.5916000              0.3946620        
  2      0.3002000              0.6503440        
D   1
  1      0.1244000              1.0000000        
F   5
  1     83.8800000              0.0073850        
  2     29.9700000              0.0618920        
  3     13.0500000              0.2011820        
  4      5.7270000              0.3887940        
  5      2.5490000              0.5522320        
F   2
  1      1.0750000              0.7217270        
  2      0.3986000              0.3878060        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Hf
data:
HAFNIUM
L   4
  1      4.7110000              0.4032730              0.0137910        
  2      3.3310000             -0.9965400             -0.1799910        
  3      0.9844000              0.9793380              0.6936010        
  4      0.3587000              0.4457910              0.4618770        
L   1
  1      0.0856800              1.0000000              1.0000000        
L   1
  1      0.0350000              1.0000000              1.0000000        
L   1
  1      0.6448000              1.0000000              1.0000000        
D   3
  1      3.2980000             -0.0050620        
  2      0.9286000              0.4276360        
  3      0.3405000              0.6679430        
D   1
  1      0.1230000              1.0000000        
D   1
  1      0.0426800              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ta
data:
TANTALUM
L   4
  1      5.5540000              0.2644290              0.0160920        
  2      3.4360000             -0.8658430             -0.1828620        
  3      1.0330000              1.0085830              0.7224420        
  4      0.3747000              0.4208260              0.4361680        
L   1
  1      0.0934000              1.0000000              1.0000000        
L   1
  1      0.0368400              1.0000000              1.0000000        
L   1
  1      0.7315000              1.0000000              1.0000000        
D   3
  1      3.4380000             -0.0107970        
  2      1.0160000              0.4394740        
  3      0.3733000              0.6589290        
D   1
  1      0.1351000              1.0000000        
D   1
  1      0.0480700              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: W
data:
TUNGSTEN
L   4
  1      4.3280000              1.9739600              0.1727520        
  2      3.8980000             -2.6053770             -0.3483720        
  3      1.1080000              1.0529200              0.7274250        
  4      0.4047000              0.4126130              0.4346350        
L   1
  1      0.0977600              1.0000000              1.0000000        
L   1
  1      0.0375000              1.0000000              1.0000000        
L   1
  1      0.8219000              1.0000000              1.0000000        
D   3
  1      3.6530000             -0.0162970        
  2      1.1120000              0.4501080        
  3      0.4148000              0.6488570        
D   1
  1      0.1495000              1.0000000        
D   1
  1      0.0525500              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Re
data:
RHENIUM
L   4
  1      4.6660000              1.4517090              0.1564570        
  2      4.0620000             -2.1017710             -0.3429000        
  3      1.1880000              1.0622950              0.7385950        
  4      0.4339000              0.4166940              0.4320920        
L   1
  1      0.1048000              1.0000000              1.0000000        
L   1
  1      0.0398100              1.0000000              1.0000000        
L   1
  1      0.9127000              1.0000000              1.0000000        
D   3
  1      3.8460000             -0.0213600        
  2      1.2160000              0.4562840        
  3      0.4585000              0.6436060        
D   1
  1      0.1659000              1.0000000        
D   1
  1      0.0583600              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Os
data:
OSMIUM
L   4
  1      5.0190000              1.7267290              0.2839560        
  2      4.4440000             -2.3641850             -0.4621630        
  3      1.2300000              1.0704060              0.7632510        
  4      0.4501000              0.3919560              0.4039440        
L   1
  1      0.1104000              1.0000000              1.0000000        
L   1
  1      0.0410100              1.0000000              1.0000000        
L   1
  1      1.0020000              1.0000000              1.0000000        
D   3
  1      3.8290000             -0.0281630        
  2      1.3390000              0.4576330        
  3      0.5165000              0.6425510        
D   1
  1      0.1880000              1.0000000        
D   1
  1      0.0655200              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Ir
data:
IRIDIUM
L   4
  1      5.5220000              1.0528490              0.1439880        
  2      4.5790000             -1.6970010             -0.3255630        
  3      1.2890000              1.0876090              0.7764420        
  4      0.4734000              0.3772300              0.3893280        
L   1
  1      0.1159000              1.0000000              1.0000000        
L   1
  1      0.0427600              1.0000000              1.0000000        
L   1
  1      1.1160000              1.0000000              1.0000000        
D   3
  1      4.3930000             -0.0253910        
  2      1.4030000              0.4757180        
  3      0.5593000              0.6181820        
D   1
  1      0.2129000              1.0000000        
D   1
  1      0.0763400              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Pt
data:
PLATINUM
L   4
  1      6.6530000              0.2822560              0.0365750        
  2      3.9950000             -1.0759670             -0.2846060        
  3      1.5410000              1.1312550              0.7523460        
  4      0.5599000              0.4782410              0.4765850        
L   1
  1      0.1277000              1.0000000              1.0000000        
L   1
  1      0.0475400              1.0000000              1.0000000        
L   1
  1      1.2000000              1.0000000              1.0000000        
D   3
  1      4.6580000             -0.0263270        
  2      1.4870000              0.4959950        
  3      0.6093000              0.5948770        
D   1
  1      0.2527000              1.0000000        
D   1
  1      0.0950800              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Au
data:
GOLD
L   4
  1      7.4190000              0.2225460              0.0199240        
  2      4.0230000             -1.0860450             -0.2999970        
  3      1.6980000              1.1560390              0.7489190        
  4      0.6271000              0.5180610              0.5040230        
L   1
  1      0.1515000              1.0000000              1.0000000        
L   1
  1      0.0492500              1.0000000              1.0000000        
L   1
  1      1.5020000              1.0000000              1.0000000        
D   3
  1      3.6300000             -0.0874020        
  2      1.9120000              0.4686340        
  3      0.8423000              0.6548050        
D   1
  1      0.3756000              1.0000000        
D   1
  1      0.1544000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Hg
data:
MERCURY
L   5
  1     25.5400000             -0.0220410             -0.0060680        
  2      8.4580000              0.3098450              0.0630000        
  3      4.4930000             -1.0809840             -0.3145020        
  4      1.7510000              1.0936000              0.7463980        
  5      0.6753000              0.5192020              0.4872530        
L   1
  1      0.1520000              1.0000000              1.0000000        
L   1
  1      0.0478000              1.0000000              1.0000000        
L   1
  1      1.5860000              1.0000000              1.0000000        
D   3
  1      4.2040000             -0.0558490        
  2      1.8710000              0.4782210        
  3      0.8215000              0.6220060        
D   1
  1      0.3700000              1.0000000        
D   1
  1      0.1674000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Tl
data:
THALLIUM
L   5
  1     27.7200000             -0.0159390             -0.0052810        
  2      8.5830000              0.3072290              0.0724550        
  3      4.6500000             -1.1245120             -0.3434130        
  4      1.8760000              1.1147980              0.7596200        
  5      0.7369000              0.5317580              0.4895500        
L   1
  1      0.1600000              1.0000000              1.0000000        
L   1
  1      0.0618100              1.0000000              1.0000000        
L   1
  1      1.6290000              1.0000000              1.0000000        
D   3
  1      4.2840000             -0.0774320        
  2      2.1360000              0.4554020        
  3      0.9832000              0.6528920        
D   1
  1      0.4500000              1.0000000        
D   1
  1      0.2040000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Pb
data:
LEAD
L   4
  1      1.5340000              0.2256520              0.0282570        
  2      0.9923000             -0.6589980             -0.1406590        
  3      0.2241000              0.7662140              0.4281320        
  4      0.0966400              0.5009340              0.6634220        
L   1
  1      0.0390000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Bi
data:
BISMUTH
L   4
  1      1.7460000              0.1623270              0.0160870        
  2      0.9925000             -0.6538540             -0.1582840        
  3      0.2642000              0.8013500              0.4609320        
  4      0.1135000              0.5168610              0.6497700        
L   1
  1      0.0464200              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Po
data:
POLONIUM
L   4
  1      1.8970000              0.1326900              0.0067960        
  2      1.0000000             -0.6815460             -0.1761420        
  3      0.3107000              0.8401790              0.4900920        
  4      0.1273000              0.5369420              0.6457590        
L   1
  1      0.0510000              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: At
data:
ASTATINE
L   4
  1      2.6760000              0.0689730             -0.0026520        
  2      0.9805000             -0.7186680             -0.1949710        
  3      0.3598000              0.9171230              0.5061720        
  4      0.1483000              0.5467490              0.6531710        
L   1
  1      0.0588700              1.0000000              1.0000000        


name: SBKJC VDZ ECP
description: VDZ Valence Double Zeta designed for an ECP
elt: Rn
data:
RADON
L   4
  1      2.4890000              0.0828200              0.0047270        
  2      1.0130000             -0.8032000             -0.2311800        
  3      0.4072000              0.9830730              0.5413540        
  4      0.1646000              0.5530510              0.6477450        
L   1
  1      0.0650000              1.0000000              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   12
  1    183.6812990              0.0000460        
  2    101.6371440             -0.0002650        
  3     56.2393070              0.0009720        
  4     31.1191320             -0.0033350        
  5     17.2192800              0.0135370        
  6      9.5280160             -0.0602290        
  7      5.2721770              0.1745210        
  8      2.9172760             -0.1409590        
  9      1.6142290             -0.1325860        
 10      0.8932080             -0.1725520        
 11      0.4934650              0.0809420        
 12      0.0442640              0.1400920        
S   1
  1      0.2128450              1.0000000        
S   1
  1      0.0976160              1.0000000        
S   1
  1      0.0287480              1.0000000        
P   8
  1     16.3427320              0.0006170        
  2      9.0348110             -0.0063630        
  3      4.9947470              0.0317160        
  4      2.7612640             -0.0473460        
  5      1.5265190             -0.0485180        
  6      0.8439110             -0.0000290        
  7      0.3257830              0.1817710        
  8      0.0274030              0.1471610        
P   1
  1      0.1428090              1.0000000        
P   1
  1      0.0628660              1.0000000        
P   1
  1      0.0146100              1.0000000        
D   1
  1      0.3158480              1.0000000        
D   1
  1      0.1115430              1.0000000        
D   1
  1      0.0349270              1.0000000        
F   1
  1      0.2838330              1.0000000        
F   1
  1      0.0969550              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   12
  1    592.2227540             -0.0000190        
  2    299.5004840              0.0001000        
  3    151.4641900             -0.0003130        
  4     76.5988780              0.0008530        
  5     38.7377900             -0.0024180        
  6     19.5905800              0.0087550        
  7      9.9074010             -0.0432530        
  8      5.0103970              0.1713900        
  9      2.5338720             -0.2158420        
 10      1.2814360             -0.2356390        
 11      0.5804130             -0.0220740        
 12      0.0612490              0.1710640        
S   1
  1      0.3085610              1.0000000        
S   1
  1      0.1385560              1.0000000        
S   1
  1      0.0427720              1.0000000        
P   8
  1     39.8392630             -0.0000910        
  2     19.8113590              0.0007200        
  3      9.8518380             -0.0055920        
  4      4.8991440              0.0369160        
  5      2.4362580             -0.0945060        
  6      1.2115080             -0.0406190        
  7      0.4381410              0.1875780        
  8      0.0394470              0.1315550        
P   1
  1      0.2001130              1.0000000        
P   1
  1      0.0899340              1.0000000        
P   1
  1      0.0258390              1.0000000        
D   1
  1      0.4040690              1.0000000        
D   1
  1      0.1474090              1.0000000        
D   1
  1      0.0509290              1.0000000        
F   1
  1      0.3534250              1.0000000        
F   1
  1      0.1330530              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   12
  1    496.0746690              0.0000290        
  2    251.7883940             -0.0000020        
  3    127.7980900              0.0000320        
  4     64.8653880              0.0002310        
  5     32.9231720             -0.0004030        
  6     16.7105340              0.0027270        
  7      8.4816230             -0.0190750        
  8      4.3049450              0.1361090        
  9      2.1850240             -0.2911950        
 10      1.1090340             -0.2076360        
 11      0.2578990              0.5387640        
 12      0.0624670              0.0794250        
S   1
  1      0.5075100              1.0000000        
S   1
  1      0.1284130              1.0000000        
S   1
  1      0.0538310              1.0000000        
P   8
  1     41.4842770             -0.0000540        
  2     20.4337600              0.0004690        
  3     10.0649830             -0.0040960        
  4      4.9576720              0.0352440        
  5      2.4419830             -0.1155690        
  6      1.2028380             -0.0371340        
  7      0.2455840              0.4434070        
  8      0.0505590              0.1110690        
P   1
  1      0.5249080              1.0000000        
P   1
  1      0.1131620              1.0000000        
P   1
  1      0.0370980              1.0000000        
D   1
  1      0.4015240              1.0000000        
D   1
  1      0.1716520              1.0000000        
D   1
  1      0.0626400              1.0000000        
F   1
  1      0.4315080              1.0000000        
F   1
  1      0.1582380              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   12
  1    522.2066270              0.0000120        
  2    268.1260450              0.0000290        
  3    137.6688310             -0.0000860        
  4     70.6858120              0.0004230        
  5     36.2935020             -0.0011160        
  6     18.6348330              0.0049530        
  7      9.5680210             -0.0318050        
  8      4.9126830              0.1821030        
  9      2.5224080             -0.3325320        
 10      1.2951260             -0.2403320        
 11      0.3134160              0.5510190        
 12      0.0751520              0.0818210        
S   1
  1      0.6044890              1.0000000        
S   1
  1      0.1564510              1.0000000        
S   1
  1      0.0664920              1.0000000        
P   8
  1     38.7220300              0.0001650        
  2     18.8022560              0.0001260        
  3      9.1298120             -0.0001570        
  4      4.4331630              0.0173710        
  5      2.1526110             -0.1135640        
  6      1.0452430              0.0166320        
  7      0.2546820              0.4379090        
  8      0.0539470              0.0868900        
P   1
  1      0.5326430              1.0000000        
P   1
  1      0.1191950              1.0000000        
P   1
  1      0.0415830              1.0000000        
D   1
  1      0.4754120              1.0000000        
D   1
  1      0.2077760              1.0000000        
D   1
  1      0.0776480              1.0000000        
F   1
  1      0.4817040              1.0000000        
F   1
  1      0.1915460              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   12
  1    762.0066790              0.0000520        
  2    376.6365900             -0.0000230        
  3    186.1599440              0.0001490        
  4     92.0131660              0.0001420        
  5     45.4792930              0.0001820        
  6     22.4790230              0.0014490        
  7     11.1106930             -0.0118330        
  8      5.4916760              0.1119000        
  9      2.7143670             -0.2561560        
 10      1.3416290             -0.4007910        
 11      0.3988620              0.5908340        
 12      0.0901270              0.0897840        
S   1
  1      0.9528400              1.0000000        
S   1
  1      0.1919290              1.0000000        
S   1
  1      0.0808210              1.0000000        
P   8
  1     77.0646890              0.0000120        
  2     33.1900760              0.0001780        
  3     14.2942400             -0.0008620        
  4      6.1562170              0.0165350        
  5      2.6513480             -0.1173210        
  6      1.1418780             -0.0129850        
  7      0.3131070              0.4482900        
  8      0.0641740              0.0906150        
P   1
  1      0.1442090              1.0000000        
P   1
  1      0.6656170              1.0000000        
P   1
  1      0.0510520              1.0000000        
D   1
  1      0.6013860              1.0000000        
D   1
  1      0.2523660              1.0000000        
D   1
  1      0.0967350              1.0000000        
F   1
  1      0.5812580              1.0000000        
F   1
  1      0.2592890              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: In
data:
INDIUM
S   12
  1    260.4103720              0.0000290        
  2    140.3828170             -0.0000600        
  3     75.6779970              0.0001780        
  4     40.7967250             -0.0002890        
  5     21.9928230              0.0008310        
  6     11.8559580             -0.0019540        
  7      6.3913460              0.0082930        
  8      3.4454660             -0.0518320        
  9      1.8573920              0.2843780        
 10      1.0012890             -0.5640840        
 11      0.5397780             -0.0474790        
 12      0.0408800              0.1725080        
S   1
  1      0.2006590              1.0000000        
S   1
  1      0.0910510              1.0000000        
S   1
  1      0.0259950              1.0000000        
P   8
  1     48.6768460              0.0000410        
  2     22.0983850             -0.0002010        
  3     10.0322570              0.0008460        
  4      4.5544590             -0.0048970        
  5      2.0676400              0.0400620        
  6      0.9386700             -0.1697800        
  7      0.4261390              0.0661640        
  8      0.0281940              0.2193230        
P   1
  1      0.1658410              1.0000000        
P   1
  1      0.0683640              1.0000000        
P   1
  1      0.0149830              1.0000000        
D   2
  1      0.6271790             -0.1550755        
  2      0.2358160              0.7292935        
D   1
  1      0.0886660              1.0000000        
D   1
  1      0.0295360              1.0000000        
F   1
  1      0.2390940              1.0000000        
F   1
  1      0.0826760              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sn
data:
TIN
S   12
  1     38.4899420              0.0001220        
  2     24.2856410             -0.0006380        
  3     15.3232850              0.0025740        
  4      9.6683900             -0.0108040        
  5      6.1003740              0.0552060        
  6      3.8490960             -0.2612420        
  7      2.4286290              0.7008960        
  8      1.5323690             -0.6044690        
  9      0.9668650             -0.2359100        
 10      0.6100540             -0.1507990        
 11      0.3849200              0.2148350        
 12      0.0444900              0.0956740        
S   1
  1      0.1866400              1.0000000        
S   1
  1      0.0920920              1.0000000        
S   1
  1      0.0347710              1.0000000        
P   8
  1     60.2212000              0.0000420        
  2     27.5393180             -0.0002100        
  3     12.5938050              0.0009210        
  4      5.7591810             -0.0056980        
  5      2.6336890              0.0451000        
  6      1.2043930             -0.1728060        
  7      0.5507720              0.0285410        
  8      0.0396340              0.2073430        
P   1
  1      0.2244350              1.0000000        
P   1
  1      0.0951810              1.0000000        
P   1
  1      0.0252210              1.0000000        
D   1
  1      0.2699130              1.0000000        
D   1
  1      0.1140290              1.0000000        
D   1
  1      0.0418500              1.0000000        
F   1
  1      0.2846360              1.0000000        
F   1
  1      0.1074800              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sb
data:
ANTIMONY
S   12
  1    134.4073070             -0.0000050        
  2     78.1665010              0.0001560        
  3     45.4588520             -0.0006210        
  4     26.4372480              0.0020130        
  5     15.3749620             -0.0061710        
  6      8.9415300              0.0238200        
  7      5.2000750             -0.1121760        
  8      3.0241780              0.3682080        
  9      1.7587540             -0.3713390        
 10      1.0228290             -0.3157270        
 11      0.5948410              0.0000160        
 12      0.0598450              0.1430470        
S   1
  1      0.2706150              1.0000000        
S   1
  1      0.1285220              1.0000000        
S   1
  1      0.0428380              1.0000000        
P   8
  1     53.7217630              0.0000530        
  2     25.4683320             -0.0002790        
  3     12.0739880              0.0012910        
  4      5.7240180             -0.0084230        
  5      2.7136340              0.0629900        
  6      1.2864750             -0.2177580        
  7      0.6098900              0.0253020        
  8      0.0500490              0.1852460        
P   1
  1      0.2681730              1.0000000        
P   1
  1      0.1174810              1.0000000        
P   1
  1      0.0322940              1.0000000        
D   1
  1      0.2902980              1.0000000        
D   1
  1      0.1427360              1.0000000        
D   1
  1      0.0530050              1.0000000        
F   1
  1      0.3351440              1.0000000        
F   1
  1      0.1260310              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Te
data:
TELLURIUM
S   13
  1    356.2703560              0.0000780        
  2    200.2259260             -0.0001580        
  3    112.5280860              0.0004070        
  4     63.2414120             -0.0005760        
  5     35.5420260              0.0013890        
  6     19.9748170             -0.0026460        
  7     11.2259580              0.0089500        
  8      6.3090510             -0.0437500        
  9      3.5457220              0.1842070        
 10      1.9927150             -0.1940200        
 11      1.1199170             -0.3627430        
 12      0.3022750              0.5650470        
 13      0.0680180              0.1275080        
S   1
  1      0.6333530              1.0000000        
S   1
  1      0.1455260              1.0000000        
S   1
  1      0.0545640              1.0000000        
P   9
  1     30.8220740              0.0001610        
  2     17.3592880             -0.0011280        
  3      9.7769170              0.0062950        
  4      5.5064540             -0.0359990        
  5      3.1012880              0.1493110        
  6      1.7466750             -0.2489380        
  7      0.9837440             -0.0648310        
  8      0.1981350              0.4699770        
  9      0.0443650              0.0829350        
P   1
  1      0.4038890              1.0000000        
P   1
  1      0.0951630              1.0000000        
P   1
  1      0.0362710              1.0000000        
D   2
  1      0.9647710             -0.1793582        
  2      0.3941280              0.5744324        
D   1
  1      0.1610090              1.0000000        
D   1
  1      0.0662560              1.0000000        
F   1
  1      0.3609320              1.0000000        
F   1
  1      0.1481570              1.0000000        


name: SDB-aug-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: I
data:
IODINE
S   12
  1    208.3634160              0.0000170        
  2    117.8734120              0.0000430        
  3     66.6822490             -0.0002200        
  4     37.7228610              0.0008860        
  5     21.3402260             -0.0029400        
  6     12.0723940              0.0131530        
  7      6.8294820             -0.0737860        
  8      3.8635110              0.2725530        
  9      2.1856300             -0.2496550        
 10      1.2364340             -0.4287590        
 11      0.3405190              0.5919630        
 12      0.0775970              0.1220050        
S   1
  1      0.6858370              1.0000000        
S   1
  1      0.1656200              1.0000000        
S   1
  1      0.0657390              1.0000000        
P   8
  1      9.5386090              0.0019140        
  2      5.9554680             -0.0213810        
  3      3.7183190              0.0942320        
  4      2.3215470             -0.0995310        
  5      1.4494670             -0.1457100        
  6      0.9049800             -0.0001730        
  7      0.2183660              0.4617230        
  8      0.0496780              0.0744090        
P   1
  1      0.4373980              1.0000000        
P   1
  1      0.1059870              1.0000000        
P   1
  1      0.0418350              1.0000000        
D   2
  1      1.0796940             -0.1205572        
  2      0.4488510              0.5583476        
D   1
  1      0.1865970              1.0000000        
D   1
  1      0.0738310              1.0000000        
F   1
  1      0.4293190              1.0000000        
F   1
  1      0.1939730              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   11
  1    183.6812990              0.0000460        
  2    101.6371440             -0.0002650        
  3     56.2393070              0.0009720        
  4     31.1191320             -0.0033350        
  5     17.2192800              0.0135370        
  6      9.5280160             -0.0602290        
  7      5.2721770              0.1745210        
  8      2.9172760             -0.1409590        
  9      1.6142290             -0.1325860        
 10      0.8932080             -0.1725520        
 11      0.2128450              0.4708480        
S   1
  1      0.4934650              1.0000000        
S   1
  1      0.0442640              1.0000000        
S   1
  1      0.0976160              1.0000000        
P   7
  1     16.3427320              0.0006170        
  2      9.0348110             -0.0063630        
  3      4.9947470              0.0317160        
  4      2.7612640             -0.0473460        
  5      1.5265190             -0.0485180        
  6      0.8439110             -0.0000290        
  7      0.1428090              0.3992510        
P   1
  1      0.3257830              1.0000000        
P   1
  1      0.0274030              1.0000000        
P   1
  1      0.0628660              1.0000000        
D   1
  1      0.4333420              1.0000000        
D   1
  1      0.1885190              1.0000000        
D   1
  1      0.0820120              1.0000000        
F   1
  1      0.4912310              1.0000000        
F   1
  1      0.1774170              1.0000000        
G   1
  1      0.3969130              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   11
  1    592.2227540             -0.0000190        
  2    299.5004840              0.0001000        
  3    151.4641900             -0.0003130        
  4     76.5988780              0.0008530        
  5     38.7377900             -0.0024180        
  6     19.5905800              0.0087550        
  7      9.9074010             -0.0432530        
  8      5.0103970              0.1713900        
  9      2.5338720             -0.2158420        
 10      1.2814360             -0.2356390        
 11      0.3085610              0.4601100        
S   1
  1      0.5804130              1.0000000        
S   1
  1      0.0612490              1.0000000        
S   1
  1      0.1385560              1.0000000        
P   7
  1     39.8392630             -0.0000910        
  2     19.8113590              0.0007200        
  3      9.8518380             -0.0055920        
  4      4.8991440              0.0369160        
  5      2.4362580             -0.0945060        
  6      1.2115080             -0.0406190        
  7      0.2001130              0.4233010        
P   1
  1      0.4381410              1.0000000        
P   1
  1      0.0394470              1.0000000        
P   1
  1      0.0899340              1.0000000        
D   1
  1      0.5165310              1.0000000        
D   1
  1      0.2347290              1.0000000        
D   1
  1      0.1066690              1.0000000        
F   1
  1      0.5726360              1.0000000        
F   1
  1      0.2202010              1.0000000        
G   1
  1      0.4633960              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   11
  1    496.0746690              0.0000290        
  2    251.7883940             -0.0000020        
  3    127.7980900              0.0000320        
  4     64.8653880              0.0002310        
  5     32.9231720             -0.0004030        
  6     16.7105340              0.0027270        
  7      8.4816230             -0.0190750        
  8      4.3049450              0.1361090        
  9      2.1850240             -0.2911950        
 10      1.1090340             -0.2076360        
 11      0.1284130              0.4033810        
S   1
  1      0.2578990              1.0000000        
S   1
  1      0.0624670              1.0000000        
S   1
  1      0.5075100              1.0000000        
P   7
  1     41.4842770             -0.0000540        
  2     20.4337600              0.0004690        
  3     10.0649830             -0.0040960        
  4      4.9576720              0.0352440        
  5      2.4419830             -0.1155690        
  6      1.2028380             -0.0371340        
  7      0.1131620              0.3909370        
P   1
  1      0.2455840              1.0000000        
P   1
  1      0.0505590              1.0000000        
P   1
  1      0.5249080              1.0000000        
D   1
  1      1.3218810              1.0000000        
D   1
  1      0.4872570              1.0000000        
D   1
  1      0.1796070              1.0000000        
F   1
  1      0.6876290              1.0000000        
F   1
  1      0.2723920              1.0000000        
G   1
  1      0.5534560              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   11
  1    522.2066270              0.0000120        
  2    268.1260450              0.0000290        
  3    137.6688310             -0.0000860        
  4     70.6858120              0.0004230        
  5     36.2935020             -0.0011160        
  6     18.6348330              0.0049530        
  7      9.5680210             -0.0318050        
  8      4.9126830              0.1821030        
  9      2.5224080             -0.3325320        
 10      1.2951260             -0.2403320        
 11      0.0751520              0.0818210        
S   1
  1      0.3134160              1.0000000        
S   1
  1      0.6044890              1.0000000        
S   1
  1      0.1564510              1.0000000        
P   7
  1     38.7220300              0.0001650        
  2     18.8022560              0.0001260        
  3      9.1298120             -0.0001570        
  4      4.4331630              0.0173710        
  5      2.1526110             -0.1135640        
  6      1.0452430              0.0166320        
  7      0.0539470              0.0868900        
P   1
  1      0.2546820              1.0000000        
P   1
  1      0.5326430              1.0000000        
P   1
  1      0.1191950              1.0000000        
D   1
  1      1.5318250              1.0000000        
D   1
  1      0.5677030              1.0000000        
D   1
  1      0.2103940              1.0000000        
F   1
  1      0.7744320              1.0000000        
F   1
  1      0.2975330              1.0000000        
G   1
  1      0.5828320              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   11
  1    762.0066790              0.0000520        
  2    376.6365900             -0.0000230        
  3    186.1599440              0.0001490        
  4     92.0131660              0.0001420        
  5     45.4792930              0.0001820        
  6     22.4790230              0.0014490        
  7     11.1106930             -0.0118330        
  8      5.4916760              0.1119000        
  9      2.7143670             -0.2561560        
 10      1.3416290             -0.4007910        
 11      0.0901270              0.0897840        
S   1
  1      0.3988620              1.0000000        
S   1
  1      0.9528400              1.0000000        
S   1
  1      0.1919290              1.0000000        
P   7
  1     77.0646890              0.0000120        
  2     33.1900760              0.0001780        
  3     14.2942400             -0.0008620        
  4      6.1562170              0.0165350        
  5      2.6513480             -0.1173210        
  6      1.1418780             -0.0129850        
  7      0.0641740              0.0906150        
P   1
  1      0.3131070              1.0000000        
P   1
  1      0.1442090              1.0000000        
P   1
  1      0.6656170              1.0000000        
D   1
  1      0.6420240              1.0000000        
D   1
  1      0.3557380              1.0000000        
D   1
  1      0.1971100              1.0000000        
F   1
  1      0.9173490              1.0000000        
F   1
  1      0.3599340              1.0000000        
G   1
  1      0.6655780              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Kr
data:
KRYPTON
S   11
  1    442.8931540              0.0001200        
  2    239.2602730             -0.0001660        
  3    129.2534720              0.0004420        
  4     69.8254670             -0.0003420        
  5     37.7211980              0.0009320        
  6     20.3777910             -0.0000170        
  7     11.0085150             -0.0162340        
  8      5.9470330              0.1429740        
  9      3.2127130             -0.2390570        
 10      1.7355760             -0.3468200        
 11      0.1024490              0.0837230        
S   1
  1      0.4453280              1.0000000        
S   1
  1      0.9199970              1.0000000        
S   1
  1      0.2168650              1.0000000        
P   7
  1     23.8489560              0.0005090        
  2     12.8722890             -0.0022670        
  3      6.9477180              0.0220690        
  4      3.7499770             -0.0677550        
  5      2.0240210             -0.0929880        
  6      1.0924500              0.1288200        
  7      0.0645370              0.0510250        
P   1
  1      0.2780400              1.0000000        
P   1
  1      0.5570170              1.0000000        
P   1
  1      0.1363200              1.0000000        
D   1
  1      0.7204390              1.0000000        
D   1
  1      0.4117370              1.0000000        
D   1
  1      0.2353110              1.0000000        
F   1
  1      1.0822760              1.0000000        
F   1
  1      0.4428600              1.0000000        
G   1
  1      0.7668820              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: In
data:
INDIUM
S   11
  1    260.4103720              0.0000290        
  2    140.3828170             -0.0000600        
  3     75.6779970              0.0001780        
  4     40.7967250             -0.0002890        
  5     21.9928230              0.0008310        
  6     11.8559580             -0.0019540        
  7      6.3913460              0.0082930        
  8      3.4454660             -0.0518320        
  9      1.8573920              0.2843780        
 10      1.0012890             -0.5640840        
 11      0.2006590              0.4696610        
S   1
  1      0.5397780              1.0000000        
S   1
  1      0.0408800              1.0000000        
S   1
  1      0.0910510              1.0000000        
P   7
  1     48.6768460              0.0000410        
  2     22.0983850             -0.0002010        
  3     10.0322570              0.0008460        
  4      4.5544590             -0.0048970        
  5      2.0676400              0.0400620        
  6      0.9386700             -0.1697800        
  7      0.1658410              0.3708640        
P   1
  1      0.4261390              1.0000000        
P   1
  1      0.0281940              1.0000000        
P   1
  1      0.0683640              1.0000000        
D   1
  1      0.6271790              1.0000000        
D   1
  1      0.2358160              1.0000000        
D   1
  1      0.0886660              1.0000000        
F   1
  1      0.3952170              1.0000000        
F   1
  1      0.1467980              1.0000000        
G   1
  1      0.3239900              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Sn
data:
TIN
S   11
  1     38.4899420              0.0001220        
  2     24.2856410             -0.0006380        
  3     15.3232850              0.0025740        
  4      9.6683900             -0.0108040        
  5      6.1003740              0.0552060        
  6      3.8490960             -0.2612420        
  7      2.4286290              0.7008960        
  8      1.5323690             -0.6044690        
  9      0.9668650             -0.2359100        
 10      0.6100540             -0.1507990        
 11      0.1866400              0.5652490        
S   1
  1      0.3849200              1.0000000        
S   1
  1      0.0444900              1.0000000        
S   1
  1      0.0920920              1.0000000        
P   7
  1     60.2212000              0.0000420        
  2     27.5393180             -0.0002100        
  3     12.5938050              0.0009210        
  4      5.7591810             -0.0056980        
  5      2.6336890              0.0451000        
  6      1.2043930             -0.1728060        
  7      0.2244350              0.3889450        
P   1
  1      0.5507720              1.0000000        
P   1
  1      0.0396340              1.0000000        
P   1
  1      0.0951810              1.0000000        
D   1
  1      0.2938450              1.0000000        
D   1
  1      0.1610550              1.0000000        
D   1
  1      0.0882730              1.0000000        
F   1
  1      0.4556300              1.0000000        
F   1
  1      0.1767360              1.0000000        
G   1
  1      0.3591600              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Sb
data:
ANTIMONY
S   11
  1    134.4073070             -0.0000050        
  2     78.1665010              0.0001560        
  3     45.4588520             -0.0006210        
  4     26.4372480              0.0020130        
  5     15.3749620             -0.0061710        
  6      8.9415300              0.0238200        
  7      5.2000750             -0.1121760        
  8      3.0241780              0.3682080        
  9      1.7587540             -0.3713390        
 10      1.0228290             -0.3157270        
 11      0.5948410              0.0000160        
S   1
  1      0.0598450              1.0000000        
S   1
  1      0.2706150              1.0000000        
S   1
  1      0.1285220              1.0000000        
P   7
  1     53.7217630              0.0000530        
  2     25.4683320             -0.0002790        
  3     12.0739880              0.0012910        
  4      5.7240180             -0.0084230        
  5      2.7136340              0.0629900        
  6      1.2864750             -0.2177580        
  7      0.2681730              0.4242890        
P   1
  1      0.6098900              1.0000000        
P   1
  1      0.0500490              1.0000000        
P   1
  1      0.1174810              1.0000000        
D   1
  1      0.8023570              1.0000000        
D   1
  1      0.3301090              1.0000000        
D   1
  1      0.1358150              1.0000000        
F   1
  1      0.5423170              1.0000000        
F   1
  1      0.2149260              1.0000000        
G   1
  1      0.4148900              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Te
data:
TELLURIUM
S   12
  1    356.2703560              0.0000780        
  2    200.2259260             -0.0001580        
  3    112.5280860              0.0004070        
  4     63.2414120             -0.0005760        
  5     35.5420260              0.0013890        
  6     19.9748170             -0.0026460        
  7     11.2259580              0.0089500        
  8      6.3090510             -0.0437500        
  9      3.5457220              0.1842070        
 10      1.9927150             -0.1940200        
 11      1.1199170             -0.3627430        
 12      0.0680180              0.1275080        
S   1
  1      0.3022750              1.0000000        
S   1
  1      0.6333530              1.0000000        
S   1
  1      0.1455260              1.0000000        
P   8
  1     30.8220740              0.0001610        
  2     17.3592880             -0.0011280        
  3      9.7769170              0.0062950        
  4      5.5064540             -0.0359990        
  5      3.1012880              0.1493110        
  6      1.7466750             -0.2489380        
  7      0.9837440             -0.0648310        
  8      0.0443650              0.0829350        
P   1
  1      0.1981350              1.0000000        
P   1
  1      0.4038890              1.0000000        
P   1
  1      0.0951630              1.0000000        
D   1
  1      0.9647710              1.0000000        
D   1
  1      0.3941280              1.0000000        
D   1
  1      0.1610090              1.0000000        
F   1
  1      0.5924370              1.0000000        
F   1
  1      0.2287610              1.0000000        
G   1
  1      0.4281190              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: I
data:
IODINE
S   11
  1    208.3634160              0.0000170        
  2    117.8734120              0.0000430        
  3     66.6822490             -0.0002200        
  4     37.7228610              0.0008860        
  5     21.3402260             -0.0029400        
  6     12.0723940              0.0131530        
  7      6.8294820             -0.0737860        
  8      3.8635110              0.2725530        
  9      2.1856300             -0.2496550        
 10      1.2364340             -0.4287590        
 11      0.0775970              0.1220050        
S   1
  1      0.3405190              1.0000000        
S   1
  1      0.6858370              1.0000000        
S   1
  1      0.1656200              1.0000000        
P   7
  1      9.5386090              0.0019140        
  2      5.9554680             -0.0213810        
  3      3.7183190              0.0942320        
  4      2.3215470             -0.0995310        
  5      1.4494670             -0.1457100        
  6      0.9049800             -0.0001730        
  7      0.0496780              0.0744090        
P   1
  1      0.2183660              1.0000000        
P   1
  1      0.4373980              1.0000000        
P   1
  1      0.1059870              1.0000000        
D   1
  1      1.0796940              1.0000000        
D   1
  1      0.4488510              1.0000000        
D   1
  1      0.1865970              1.0000000        
F   1
  1      0.7012160              1.0000000        
F   1
  1      0.2728500              1.0000000        
G   1
  1      0.4798740              1.0000000        


name: SDB-cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Xe
data:
XENON
S   11
  1    226.2482130             -0.0000230        
  2    127.7239880              0.0001710        
  3     72.1040700             -0.0006030        
  4     40.7049380              0.0018320        
  5     22.9791740             -0.0058310        
  6     12.9724410              0.0243180        
  7      7.3233370             -0.1199020        
  8      4.1342460              0.3889070        
  9      2.3339080             -0.3587420        
 10      1.3175620             -0.4510790        
 11      0.0856590              0.1069240        
S   1
  1      0.3632860              1.0000000        
S   1
  1      0.6610530              1.0000000        
S   1
  1      0.1802750              1.0000000        
P   7
  1     10.5866780              0.0013770        
  2      6.4624630             -0.0151590        
  3      3.9449040              0.0789220        
  4      2.4081020             -0.1049280        
  5      1.4699860             -0.1513750        
  6      0.8973290              0.0393470        
  7      0.0547600              0.0611170        
P   1
  1      0.2325120              1.0000000        
P   1
  1      0.4590930              1.0000000        
P   1
  1      0.1148580              1.0000000        
D   1
  1      1.2968940              1.0000000        
D   1
  1      0.5318460              1.0000000        
D   1
  1      0.2181060              1.0000000        
F   1
  1      0.8011440              1.0000000        
F   1
  1      0.3255640              1.0000000        
G   1
  1      0.5450000              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   12
  1    183.6812990              0.0000460        
  2    101.6371440             -0.0002650        
  3     56.2393070              0.0009720        
  4     31.1191320             -0.0033350        
  5     17.2192800              0.0135370        
  6      9.5280160             -0.0602290        
  7      5.2721770              0.1745210        
  8      2.9172760             -0.1409590        
  9      1.6142290             -0.1325860        
 10      0.8932080             -0.1725520        
 11      0.4934650              0.0809420        
 12      0.0442640              0.1400920        
S   1
  1      0.2128450              1.0000000        
S   1
  1      0.0976160              1.0000000        
P   8
  1     16.3427320              0.0006170        
  2      9.0348110             -0.0063630        
  3      4.9947470              0.0317160        
  4      2.7612640             -0.0473460        
  5      1.5265190             -0.0485180        
  6      0.8439110             -0.0000290        
  7      0.3257830              0.1817710        
  8      0.0274030              0.1471610        
P   1
  1      0.1428090              1.0000000        
P   1
  1      0.0628660              1.0000000        
D   1
  1      0.3158480              1.0000000        
D   1
  1      0.1115430              1.0000000        
F   1
  1      0.2838330              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   12
  1    592.2227540             -0.0000190        
  2    299.5004840              0.0001000        
  3    151.4641900             -0.0003130        
  4     76.5988780              0.0008530        
  5     38.7377900             -0.0024180        
  6     19.5905800              0.0087550        
  7      9.9074010             -0.0432530        
  8      5.0103970              0.1713900        
  9      2.5338720             -0.2158420        
 10      1.2814360             -0.2356390        
 11      0.5804130             -0.0220740        
 12      0.0612490              0.1710640        
S   1
  1      0.3085610              1.0000000        
S   1
  1      0.1385560              1.0000000        
P   8
  1     39.8392630             -0.0000910        
  2     19.8113590              0.0007200        
  3      9.8518380             -0.0055920        
  4      4.8991440              0.0369160        
  5      2.4362580             -0.0945060        
  6      1.2115080             -0.0406190        
  7      0.4381410              0.1875780        
  8      0.0394470              0.1315550        
P   1
  1      0.2001130              1.0000000        
P   1
  1      0.0899340              1.0000000        
D   1
  1      0.4040690              1.0000000        
D   1
  1      0.1474090              1.0000000        
F   1
  1      0.3534250              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   12
  1    496.0746690              0.0000290        
  2    251.7883940             -0.0000020        
  3    127.7980900              0.0000320        
  4     64.8653880              0.0002310        
  5     32.9231720             -0.0004030        
  6     16.7105340              0.0027270        
  7      8.4816230             -0.0190750        
  8      4.3049450              0.1361090        
  9      2.1850240             -0.2911950        
 10      1.1090340             -0.2076360        
 11      0.2578990              0.5387640        
 12      0.0624670              0.0794250        
S   1
  1      0.5075100              1.0000000        
S   1
  1      0.1284130              1.0000000        
P   8
  1     41.4842770             -0.0000540        
  2     20.4337600              0.0004690        
  3     10.0649830             -0.0040960        
  4      4.9576720              0.0352440        
  5      2.4419830             -0.1155690        
  6      1.2028380             -0.0371340        
  7      0.2455840              0.4434070        
  8      0.0505590              0.1110690        
P   1
  1      0.5249080              1.0000000        
P   1
  1      0.1131620              1.0000000        
D   1
  1      0.4015240              1.0000000        
D   1
  1      0.1716520              1.0000000        
F   1
  1      0.4315080              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   12
  1    522.2066270              0.0000120        
  2    268.1260450              0.0000290        
  3    137.6688310             -0.0000860        
  4     70.6858120              0.0004230        
  5     36.2935020             -0.0011160        
  6     18.6348330              0.0049530        
  7      9.5680210             -0.0318050        
  8      4.9126830              0.1821030        
  9      2.5224080             -0.3325320        
 10      1.2951260             -0.2403320        
 11      0.3134160              0.5510190        
 12      0.0751520              0.0818210        
S   1
  1      0.6044890              1.0000000        
S   1
  1      0.1564510              1.0000000        
P   8
  1     38.7220300              0.0001650        
  2     18.8022560              0.0001260        
  3      9.1298120             -0.0001570        
  4      4.4331630              0.0173710        
  5      2.1526110             -0.1135640        
  6      1.0452430              0.0166320        
  7      0.2546820              0.4379090        
  8      0.0539470              0.0868900        
P   1
  1      0.5326430              1.0000000        
P   1
  1      0.1191950              1.0000000        
D   1
  1      0.4754120              1.0000000        
D   1
  1      0.2077760              1.0000000        
F   1
  1      0.4817040              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   12
  1    762.0066790              0.0000520        
  2    376.6365900             -0.0000230        
  3    186.1599440              0.0001490        
  4     92.0131660              0.0001420        
  5     45.4792930              0.0001820        
  6     22.4790230              0.0014490        
  7     11.1106930             -0.0118330        
  8      5.4916760              0.1119000        
  9      2.7143670             -0.2561560        
 10      1.3416290             -0.4007910        
 11      0.3988620              0.5908340        
 12      0.0901270              0.0897840        
S   1
  1      0.9528400              1.0000000        
S   1
  1      0.1919290              1.0000000        
P   8
  1     77.0646890              0.0000120        
  2     33.1900760              0.0001780        
  3     14.2942400             -0.0008620        
  4      6.1562170              0.0165350        
  5      2.6513480             -0.1173210        
  6      1.1418780             -0.0129850        
  7      0.3131070              0.4482900        
  8      0.0641740              0.0906150        
P   1
  1      0.1442090              1.0000000        
P   1
  1      0.6656170              1.0000000        
D   1
  1      0.6013860              1.0000000        
D   1
  1      0.2523660              1.0000000        
F   1
  1      0.5812580              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Kr
data:
KRYPTON
S   12
  1    442.8931540              0.0001200        
  2    239.2602730             -0.0001660        
  3    129.2534720              0.0004420        
  4     69.8254670             -0.0003420        
  5     37.7211980              0.0009320        
  6     20.3777910             -0.0000170        
  7     11.0085150             -0.0162340        
  8      5.9470330              0.1429740        
  9      3.2127130             -0.2390570        
 10      1.7355760             -0.3468200        
 11      0.4453280              0.5975600        
 12      0.1024490              0.0837230        
S   1
  1      0.9199970              1.0000000        
S   1
  1      0.2168650              1.0000000        
P   8
  1     23.8489560              0.0005090        
  2     12.8722890             -0.0022670        
  3      6.9477180              0.0220690        
  4      3.7499770             -0.0677550        
  5      2.0240210             -0.0929880        
  6      1.0924500              0.1288200        
  7      0.2780400              0.4046340        
  8      0.0645370              0.0510250        
P   1
  1      0.5570170              1.0000000        
P   1
  1      0.1363200              1.0000000        
D   1
  1      0.6924520              1.0000000        
D   1
  1      0.2960830              1.0000000        
F   1
  1      0.7042210              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: In
data:
INDIUM
S   12
  1    260.4103720              0.0000290        
  2    140.3828170             -0.0000600        
  3     75.6779970              0.0001780        
  4     40.7967250             -0.0002890        
  5     21.9928230              0.0008310        
  6     11.8559580             -0.0019540        
  7      6.3913460              0.0082930        
  8      3.4454660             -0.0518320        
  9      1.8573920              0.2843780        
 10      1.0012890             -0.5640840        
 11      0.5397780             -0.0474790        
 12      0.0408800              0.1725080        
S   1
  1      0.2006590              1.0000000        
S   1
  1      0.0910510              1.0000000        
P   8
  1     48.6768460              0.0000410        
  2     22.0983850             -0.0002010        
  3     10.0322570              0.0008460        
  4      4.5544590             -0.0048970        
  5      2.0676400              0.0400620        
  6      0.9386700             -0.1697800        
  7      0.4261390              0.0661640        
  8      0.0281940              0.2193230        
P   1
  1      0.1658410              1.0000000        
P   1
  1      0.0683640              1.0000000        
D   2
  1      0.6271790             -0.1550755        
  2      0.2358160              0.7292935        
D   1
  1      0.0886660              1.0000000        
F   1
  1      0.2390940              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sn
data:
TIN
S   12
  1     38.4899420              0.0001220        
  2     24.2856410             -0.0006380        
  3     15.3232850              0.0025740        
  4      9.6683900             -0.0108040        
  5      6.1003740              0.0552060        
  6      3.8490960             -0.2612420        
  7      2.4286290              0.7008960        
  8      1.5323690             -0.6044690        
  9      0.9668650             -0.2359100        
 10      0.6100540             -0.1507990        
 11      0.3849200              0.2148350        
 12      0.0444900              0.0956740        
S   1
  1      0.1866400              1.0000000        
S   1
  1      0.0920920              1.0000000        
P   8
  1     60.2212000              0.0000420        
  2     27.5393180             -0.0002100        
  3     12.5938050              0.0009210        
  4      5.7591810             -0.0056980        
  5      2.6336890              0.0451000        
  6      1.2043930             -0.1728060        
  7      0.5507720              0.0285410        
  8      0.0396340              0.2073430        
P   1
  1      0.2244350              1.0000000        
P   1
  1      0.0951810              1.0000000        
D   1
  1      0.2699130              1.0000000        
D   1
  1      0.1140290              1.0000000        
F   1
  1      0.2846360              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sb
data:
ANTIMONY
S   12
  1    134.4073070             -0.0000050        
  2     78.1665010              0.0001560        
  3     45.4588520             -0.0006210        
  4     26.4372480              0.0020130        
  5     15.3749620             -0.0061710        
  6      8.9415300              0.0238200        
  7      5.2000750             -0.1121760        
  8      3.0241780              0.3682080        
  9      1.7587540             -0.3713390        
 10      1.0228290             -0.3157270        
 11      0.5948410              0.0000160        
 12      0.0598450              0.1430470        
S   1
  1      0.2706150              1.0000000        
S   1
  1      0.1285220              1.0000000        
P   8
  1     53.7217630              0.0000530        
  2     25.4683320             -0.0002790        
  3     12.0739880              0.0012910        
  4      5.7240180             -0.0084230        
  5      2.7136340              0.0629900        
  6      1.2864750             -0.2177580        
  7      0.6098900              0.0253020        
  8      0.0500490              0.1852460        
P   1
  1      0.2681730              1.0000000        
P   1
  1      0.1174810              1.0000000        
D   1
  1      0.2902980              1.0000000        
D   1
  1      0.1427360              1.0000000        
F   1
  1      0.3351440              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Te
data:
TELLURIUM
S   13
  1    356.2703560              0.0000780        
  2    200.2259260             -0.0001580        
  3    112.5280860              0.0004070        
  4     63.2414120             -0.0005760        
  5     35.5420260              0.0013890        
  6     19.9748170             -0.0026460        
  7     11.2259580              0.0089500        
  8      6.3090510             -0.0437500        
  9      3.5457220              0.1842070        
 10      1.9927150             -0.1940200        
 11      1.1199170             -0.3627430        
 12      0.3022750              0.5650470        
 13      0.0680180              0.1275080        
S   1
  1      0.6333530              1.0000000        
S   1
  1      0.1455260              1.0000000        
P   9
  1     30.8220740              0.0001610        
  2     17.3592880             -0.0011280        
  3      9.7769170              0.0062950        
  4      5.5064540             -0.0359990        
  5      3.1012880              0.1493110        
  6      1.7466750             -0.2489380        
  7      0.9837440             -0.0648310        
  8      0.1981350              0.4699770        
  9      0.0443650              0.0829350        
P   1
  1      0.4038890              1.0000000        
P   1
  1      0.0951630              1.0000000        
D   2
  1      0.9647710             -0.1793582        
  2      0.3941280              0.5744324        
D   1
  1      0.1610090              1.0000000        
F   1
  1      0.3609320              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: I
data:
IODINE
S   12
  1    208.3634160              0.0000170        
  2    117.8734120              0.0000430        
  3     66.6822490             -0.0002200        
  4     37.7228610              0.0008860        
  5     21.3402260             -0.0029400        
  6     12.0723940              0.0131530        
  7      6.8294820             -0.0737860        
  8      3.8635110              0.2725530        
  9      2.1856300             -0.2496550        
 10      1.2364340             -0.4287590        
 11      0.3405190              0.5919630        
 12      0.0775970              0.1220050        
S   1
  1      0.6858370              1.0000000        
S   1
  1      0.1656200              1.0000000        
P   8
  1      9.5386090              0.0019140        
  2      5.9554680             -0.0213810        
  3      3.7183190              0.0942320        
  4      2.3215470             -0.0995310        
  5      1.4494670             -0.1457100        
  6      0.9049800             -0.0001730        
  7      0.2183660              0.4617230        
  8      0.0496780              0.0744090        
P   1
  1      0.4373980              1.0000000        
P   1
  1      0.1059870              1.0000000        
D   2
  1      1.0796940             -0.1205572        
  2      0.4488510              0.5583476        
D   1
  1      0.1865970              1.0000000        
F   1
  1      0.4293190              1.0000000        


name: SDB-cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Xe
data:
XENON
S   12
  1    226.2482130             -0.0000230        
  2    127.7239880              0.0001710        
  3     72.1040700             -0.0006030        
  4     40.7049380              0.0018320        
  5     22.9791740             -0.0058310        
  6     12.9724410              0.0243180        
  7      7.3233370             -0.1199020        
  8      4.1342460              0.3889070        
  9      2.3339080             -0.3587420        
 10      1.3175620             -0.4510790        
 11      0.3632860              0.6162500        
 12      0.0856590              0.1069240        
S   1
  1      0.6610530              1.0000000        
S   1
  1      0.1802750              1.0000000        
P   8
  1     10.5866780              0.0013770        
  2      6.4624630             -0.0151590        
  3      3.9449040              0.0789220        
  4      2.4081020             -0.1049280        
  5      1.4699860             -0.1513750        
  6      0.8973290              0.0393470        
  7      0.2325120              0.4537510        
  8      0.0547600              0.0611170        
P   1
  1      0.4590930              1.0000000        
P   1
  1      0.1148580              1.0000000        
D   1
  1      0.4406030              1.0000000        
D   1
  1      0.2286500              1.0000000        
F   1
  1      0.5156420              1.0000000        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: H
data:
HYDROGEN
S   2
  1      1.309756377            0.430128498      
  2      0.233135974            0.678913531      


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: He
data:
HELIUM
S   2
  1      2.4328790              0.4301280        
  2      0.4330510              0.6789140        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   2
  1      6.1638450              0.4301280        
  2      1.0971610              0.6789140        
L   2
  1      0.2459160              0.0494720              0.5115410        
  2      0.0623710              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   2
  1     11.5356690              0.4301280        
  2      2.0533430              0.6789140        
L   2
  1      0.5081630              0.0494720              0.5115410        
  2      0.1288840              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   2
  1     18.6568730              0.4301280        
  2      3.3209140              0.6789140        
L   2
  1      0.8645500              0.0494720              0.5115410        
  2      0.2192730              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   2
  1     27.38503303             0.430128498      
  2      4.874522052            0.678913531      
L   2
  1      1.136748189            0.049471769            0.511540708      
  2      0.288309360            0.963782408            0.612819896      


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   2
  1     37.8964750              0.4301280        
  2      6.7455540              0.6789140        
L   2
  1      1.4610890              0.0494720              0.5115410        
  2      0.3705710              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   2
  1     49.9809710              0.4301280        
  2      8.8965880              0.6789140        
L   2
  1      1.9452370              0.0494720              0.5115410        
  2      0.4933630              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   2
  1     63.7352020              0.4301280        
  2     11.3448340              0.6789140        
L   2
  1      2.4985480              0.0494720              0.5115410        
  2      0.6336980              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Ne
data:
NEON
S   2
  1     79.1591680              0.4301280        
  2     14.0902920              0.6789140        
L   2
  1      3.1870760              0.0494720              0.5115410        
  2      0.8083270              0.9637820              0.6128200        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   2
  1     95.8910160              0.4301280        
  2     17.0685520              0.6789140        
L   2
  1      4.6533520              0.0494720              0.5115410        
  2      1.1802130              0.9637820              0.6128200        
L   2
  1      0.2840050             -0.2983990              0.3480470        
  2      0.0974390              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   2
  1    114.4231830              0.4301280        
  2     20.3672690              0.6789140        
L   2
  1      5.8443550              0.0494720              0.5115410        
  2      1.4822830              0.9637820              0.6128200        
L   2
  1      0.3178150             -0.2983990              0.3480470        
  2      0.1090390              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   2
  1    134.3774610              0.4301280        
  2     23.9191200              0.6789140        
L   2
  1      7.3043300              0.0494720              0.5115410        
  2      1.8525710              0.9637820              0.6128200        
L   2
  1      0.3747870             -0.2983990              0.3480470        
  2      0.1285860              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   2
  1    155.9346910              0.4301280        
  2     27.7562960              0.6789140        
L   2
  1      8.9639960              0.0494720              0.5115410        
  2      2.2735060              0.9637820              0.6128200        
L   2
  1      0.4660350             -0.2983990              0.3480470        
  2      0.1598920              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHOROUS
S   2
  1    179.0948740              0.4301280        
  2     31.8787970              0.6789140        
L   2
  1     10.8341890              0.0494720              0.5115410        
  2      2.7478370              0.9637820              0.6128200        
L   2
  1      0.5872910             -0.2983990              0.3480470        
  2      0.2014940              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   2
  1    203.8580090              0.4301280        
  2     36.2866230              0.6789140        
L   2
  1     12.8814430              0.0494720              0.5115410        
  2      3.2670740              0.9637820              0.6128200        
L   2
  1      0.7225530             -0.2983990              0.3480470        
  2      0.2479010              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   2
  1    229.9441040              0.4301280        
  2     40.9299350              0.6789140        
L   2
  1     15.0576100              0.0494720              0.5115410        
  2      3.8190080              0.9637820              0.6128200        
L   2
  1      0.8883460             -0.2983990              0.3480470        
  2      0.3047830              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Ar
data:
ARGON
S   2
  1    257.8966190              0.4301280        
  2     45.9054680              0.6789140        
L   2
  1     17.4552940              0.0494720              0.5115410        
  2      4.4271240              0.9637820              0.6128200        
L   2
  1      1.0530930             -0.2983990              0.3480470        
  2      0.3613060              1.2279830              0.7222520        


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   2
  1    295.0121465              0.4301284983     
  2     52.51201337             0.6789135305     
L   2
  1     20.25259239             0.0494717692           0.5115407076     
  2      5.136592224            0.9637824081           0.6128198961     
L   2
  1      1.466966455           -0.298398604            0.3480471912     
  2      0.503301550            1.227982887            0.7222523221     
L   2
  1      0.254048142           -0.661560302            0.1309890515     
  2      0.102239820            1.510754134            0.8946431268     


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   2
  1    326.5671727              0.4301284983     
  2     58.12879211             0.6789135305     
L   2
  1     23.01915102             0.0494717692           0.5115407076     
  2      5.838264545            0.9637824081           0.6128198961     
L   2
  1      1.757469459           -0.2983986044           0.3480471912     
  2      0.602970232            1.2279828870           0.7222523221     
L   2
  1      0.229785047           -0.6615603018           0.1309890515     
  2      0.092475315            1.5107541340           0.8946431268     


name: STO-2G
description: MB Minimal Basis: 1 Function/AO
elt: Sr
data:
STRONTIUM
S   2
  1   1185.7623300              0.4301284983     
  2    211.0650970              0.6789135305     
L   2
  1    101.8394821              0.0494717692           0.5115407076     
  2     25.82918184             0.9637824081           0.6128198961     
L   2
  1     12.54411156            -0.3121716958           0.2940025217     
  2      3.879731996            1.2253984220           0.7800415894     
L   2
  1      1.240560967           -0.6615603018           0.1309890515     
  2      0.499254706            1.5107541340           0.8946431268     
L   2
  1      0.2632280820          -1.0936897920          -0.1047403535     
  2      0.1273435176           1.8813746560           1.0876267930     
D   2
  1     12.54411156             0.6006042500     
  2      3.879731996            0.5292040571     


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Na
data:
SODIUM
S   3
  1    250.7724300              0.1543289673     
  2     45.6785110              0.5353281423     
  3     12.3623880              0.4446345422     
L   3
  1     12.0401930             -0.09996722919          0.1559162750     
  2      2.7978819              0.39951282610          0.6076837186     
  3      0.9099580              0.70011546890          0.3919573931     
L   3
  1      1.4787406             -0.2196203690           0.01058760429    
  2      0.4125649              0.2255954336           0.59516700530    
  3      0.1614751              0.9003984260           0.46200101200    
D   1
  1      0.0900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Mg
data:
MAGNESIUM
S   3
  1    299.2374000              0.1543289673     
  2     54.5064700              0.5353281423     
  3     14.7515800              0.4446345422     
L   3
  1     15.1218200             -0.09996722919          0.1559162750     
  2      3.5139870              0.39951282610          0.6076837186     
  3      1.1428570              0.70011546890          0.3919573931     
L   3
  1      1.3954480             -0.2196203690           0.01058760429    
  2      0.3893260              0.2255954336           0.59516700530    
  3      0.1523800              0.9003984260           0.46200101200    
D   1
  1      0.0900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Al
data:
ALUMINUM
S   3
  1    351.4214767              0.1543289673     
  2     64.01186067             0.5353281423     
  3     17.32410761             0.4446345422     
L   3
  1     18.89939621            -0.09996722919          0.1559162750     
  2      4.391813233            0.39951282610          0.6076837186     
  3      1.428353970            0.70011546890          0.3919573931     
L   3
  1      1.3954482930          -0.2196203690           0.01058760429    
  2      0.3893265318           0.2255954336           0.59516700530    
  3      0.1523797659           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Si
data:
SILICON
S   3
  1    407.7975514              0.1543289673     
  2     74.28083305             0.5353281423     
  3     20.10329229             0.4446345422     
L   3
  1     23.19365606            -0.09996722919          0.1559162750     
  2      5.389706871            0.39951282610          0.6076837186     
  3      1.752899952            0.70011546890          0.3919573931     
L   3
  1      1.4787406220          -0.2196203690           0.01058760429    
  2      0.4125648801           0.2255954336           0.59516700530    
  3      0.1614750979           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: P
data:
PHOSPHOROUS
S   3
  1    468.3656378              0.1543289673     
  2     85.31338559             0.5353281423     
  3     23.08913156             0.4446345422     
L   3
  1     28.03263958            -0.09996722919          0.1559162750     
  2      6.514182577            0.39951282610          0.6076837186     
  3      2.118614352            0.70011546890          0.3919573931     
L   3
  1      1.7431032310          -0.2196203690           0.01058760429    
  2      0.4863213771           0.2255954336           0.59516700530    
  3      0.1903428909           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: S
data:
SULFUR
S   3
  1    533.1257359              0.1543289673     
  2     97.10951830             0.5353281423     
  3     26.28162542             0.4446345422     
L   3
  1     33.32975173            -0.09996722919          0.1559162750     
  2      7.745117521            0.39951282610          0.6076837186     
  3      2.518952599            0.70011546890          0.3919573931     
L   3
  1      2.0291942740          -0.2196203690           0.01058760429    
  2      0.5661400518           0.2255954336           0.59516700530    
  3      0.2215833792           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Cl
data:
CHLORINE
S   3
  1    601.3456136              0.1543289673     
  2    109.5358542              0.5353281423     
  3     29.64467686             0.4446345422     
L   3
  1     38.96041889            -0.09996722919          0.1559162750     
  2      9.053563477            0.39951282610          0.6076837186     
  3      2.944499834            0.70011546890          0.3919573931     
L   3
  1      2.1293864950          -0.2196203690           0.01058760429    
  2      0.5940934274           0.2255954336           0.59516700530    
  3      0.2325241410           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G*
description: MBP Minimal Basis + Polarization on second row
elt: Ar
data:
ARGON
S   3
  1    674.4465184              0.1543289673     
  2    122.8512753              0.5353281423     
  3     33.24834945             0.4446345422     
L   3
  1     45.16424392            -0.09996722919          0.1559162750     
  2     10.49519900             0.39951282610          0.6076837186     
  3      3.413364448            0.70011546890          0.3919573931     
L   3
  1      2.6213665180          -0.2196203690           0.01058760429    
  2      0.7313546050           0.2255954336           0.59516700530    
  3      0.2862472356           0.9003984260           0.46200101200    
D   1
  1      0.3900000              1.0000000        


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: H
data:
HYDROGEN
S   3
  1      3.42525091             0.15432897       
  2      0.62391373             0.53532814       
  3      0.16885540             0.44463454       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: He
data:
HELIUM
S   3
  1      6.36242139             0.15432897       
  2      1.15892300             0.53532814       
  3      0.31364979             0.44463454       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   3
  1     16.1195750              0.15432897       
  2      2.9362007              0.53532814       
  3      0.7946505              0.44463454       
L   3
  1      0.6362897             -0.09996723             0.15591627       
  2      0.1478601              0.39951283             0.60768372       
  3      0.0480887              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   3
  1     30.1678710              0.15432897       
  2      5.4951153              0.53532814       
  3      1.4871927              0.44463454       
L   3
  1      1.3148331             -0.09996723             0.15591627       
  2      0.3055389              0.39951283             0.60768372       
  3      0.0993707              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   3
  1     48.7911130              0.15432897       
  2      8.8873622              0.53532814       
  3      2.4052670              0.44463454       
L   3
  1      2.2369561             -0.09996723             0.15591627       
  2      0.5198205              0.39951283             0.60768372       
  3      0.1690618              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   3
  1     71.6168370              0.15432897       
  2     13.0450960              0.53532814       
  3      3.5305122              0.44463454       
L   3
  1      2.9412494             -0.09996723             0.15591627       
  2      0.6834831              0.39951283             0.60768372       
  3      0.2222899              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   3
  1     99.1061690              0.15432897       
  2     18.0523120              0.53532814       
  3      4.8856602              0.44463454       
L   3
  1      3.7804559             -0.09996723             0.15591627       
  2      0.8784966              0.39951283             0.60768372       
  3      0.2857144              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   3
  1    130.7093200              0.15432897       
  2     23.8088610              0.53532814       
  3      6.4436083              0.44463454       
L   3
  1      5.0331513             -0.09996723             0.15591627       
  2      1.1695961              0.39951283             0.60768372       
  3      0.3803890              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   3
  1    166.6791300              0.15432897       
  2     30.3608120              0.53532814       
  3      8.2168207              0.44463454       
L   3
  1      6.4648032             -0.09996723             0.15591627       
  2      1.5022812              0.39951283             0.60768372       
  3      0.4885885              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ne
data:
NEON
S   3
  1    207.0156100              0.15432897       
  2     37.7081510              0.53532814       
  3     10.2052970              0.44463454       
L   3
  1      8.2463151             -0.09996723             0.15591627       
  2      1.9162662              0.39951283             0.60768372       
  3      0.6232293              0.70011547             0.39195739       


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   3
  1    250.7724300              0.1543289673     
  2     45.6785110              0.5353281423     
  3     12.3623880              0.4446345422     
L   3
  1     12.0401930             -0.09996722919          0.1559162750     
  2      2.7978819              0.39951282610          0.6076837186     
  3      0.9099580              0.70011546890          0.3919573931     
L   3
  1      1.4787406             -0.2196203690           0.01058760429    
  2      0.4125649              0.2255954336           0.59516700530    
  3      0.1614751              0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   3
  1    299.2374000              0.1543289673     
  2     54.5064700              0.5353281423     
  3     14.7515800              0.4446345422     
L   3
  1     15.1218200             -0.09996722919          0.1559162750     
  2      3.5139870              0.39951282610          0.6076837186     
  3      1.1428570              0.70011546890          0.3919573931     
L   3
  1      1.3954480             -0.2196203690           0.01058760429    
  2      0.3893260              0.2255954336           0.59516700530    
  3      0.1523800              0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   3
  1    351.4214767              0.1543289673     
  2     64.01186067             0.5353281423     
  3     17.32410761             0.4446345422     
L   3
  1     18.89939621            -0.09996722919          0.1559162750     
  2      4.391813233            0.39951282610          0.6076837186     
  3      1.428353970            0.70011546890          0.3919573931     
L   3
  1      1.3954482930          -0.2196203690           0.01058760429    
  2      0.3893265318           0.2255954336           0.59516700530    
  3      0.1523797659           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   3
  1    407.7975514              0.1543289673     
  2     74.28083305             0.5353281423     
  3     20.10329229             0.4446345422     
L   3
  1     23.19365606            -0.09996722919          0.1559162750     
  2      5.389706871            0.39951282610          0.6076837186     
  3      1.752899952            0.70011546890          0.3919573931     
L   3
  1      1.4787406220          -0.2196203690           0.01058760429    
  2      0.4125648801           0.2255954336           0.59516700530    
  3      0.1614750979           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHOROUS
S   3
  1    468.3656378              0.1543289673     
  2     85.31338559             0.5353281423     
  3     23.08913156             0.4446345422     
L   3
  1     28.03263958            -0.09996722919          0.1559162750     
  2      6.514182577            0.39951282610          0.6076837186     
  3      2.118614352            0.70011546890          0.3919573931     
L   3
  1      1.7431032310          -0.2196203690           0.01058760429    
  2      0.4863213771           0.2255954336           0.59516700530    
  3      0.1903428909           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   3
  1    533.1257359              0.1543289673     
  2     97.10951830             0.5353281423     
  3     26.28162542             0.4446345422     
L   3
  1     33.32975173            -0.09996722919          0.1559162750     
  2      7.745117521            0.39951282610          0.6076837186     
  3      2.518952599            0.70011546890          0.3919573931     
L   3
  1      2.0291942740          -0.2196203690           0.01058760429    
  2      0.5661400518           0.2255954336           0.59516700530    
  3      0.2215833792           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   3
  1    601.3456136              0.1543289673     
  2    109.5358542              0.5353281423     
  3     29.64467686             0.4446345422     
L   3
  1     38.96041889            -0.09996722919          0.1559162750     
  2      9.053563477            0.39951282610          0.6076837186     
  3      2.944499834            0.70011546890          0.3919573931     
L   3
  1      2.1293864950          -0.2196203690           0.01058760429    
  2      0.5940934274           0.2255954336           0.59516700530    
  3      0.2325241410           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ar
data:
ARGON
S   3
  1    674.4465184              0.1543289673     
  2    122.8512753              0.5353281423     
  3     33.24834945             0.4446345422     
L   3
  1     45.16424392            -0.09996722919          0.1559162750     
  2     10.49519900             0.39951282610          0.6076837186     
  3      3.413364448            0.70011546890          0.3919573931     
L   3
  1      2.6213665180          -0.2196203690           0.01058760429    
  2      0.7313546050           0.2255954336           0.59516700530    
  3      0.2862472356           0.9003984260           0.46200101200    


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   3
  1    771.5103681              0.1543289673     
  2    140.5315766              0.5353281423     
  3     38.03332899             0.4446345422     
L   3
  1     52.40203979            -0.0999672292           0.1559162750     
  2     12.17710710             0.3995128261           0.6076837186     
  3      3.960373165            0.7001154689           0.3919573931     
L   3
  1      3.651583985           -0.2196203690           0.0105876043     
  2      1.018782663            0.2255954336           0.5951670053     
  3      0.3987446295           0.9003984260           0.4620010120     
L   3
  1      0.5039822505          -0.3088441215          -0.1215468600     
  2      0.1860011465           0.0196064117           0.5715227604     
  3      0.08214006743          1.1310344420           0.5498949471     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   3
  1    854.0324951              0.1543289673     
  2    155.5630851              0.5353281423     
  3     42.10144179             0.4446345422     
L   3
  1     59.56029944            -0.0999672292           0.1559162750     
  2     13.84053270             0.3995128261           0.6076837186     
  3      4.501370797            0.7001154689           0.3919573931     
L   3
  1      4.374706256           -0.2196203690           0.0105876043     
  2      1.220531941            0.2255954336           0.5951670053     
  3      0.477707930            0.9003984260           0.4620010120     
L   3
  1      0.4558489757          -0.3088441215          -0.1215468600     
  2      0.1682369410           0.0196064117           0.5715227604     
  3      0.0742952070           1.1310344420           0.5498949471     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Sc
data:
SCANDIUM
S   3
  1    941.6624250              0.1543289673     
  2    171.5249862              0.5353281423     
  3     46.42135516             0.4446345422     
L   3
  1     67.17668771            -0.0999672292           0.1559162750     
  2     15.61041754             0.3995128261           0.6076837186     
  3      5.076992278            0.7001154689           0.3919573931     
L   3
  1      4.698159231           -0.2277635023           0.0049515112     
  2      1.433088313            0.2175436044           0.5777664691     
  3      0.552930024            0.9166769611           0.4846460366     
L   3
  1      0.6309328384          -0.3088441215          -0.1215468600     
  2      0.2328538976           0.0196064117           0.5715227604     
  3      0.1028307363           1.1310344420           0.5498949471     
D   3
  1      0.5517000679           0.2197679508     
  2      0.1682861055           0.6555473627     
  3      0.0649300112           0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ti
data:
TITANIUM
S   3
  1   1033.5712450              0.1543289673     
  2    188.2662926              0.5353281423     
  3     50.95220601             0.4446345422     
L   3
  1     75.25120460            -0.0999672292           0.1559162750     
  2     17.48676162             0.3995128261           0.6076837186     
  3      5.687237606            0.7001154689           0.3919573931     
L   3
  1      5.395535474           -0.2277635023           0.0049515112     
  2      1.645810296            0.2175436044           0.5777664691     
  3      0.635004777            0.9166769611           0.4846460366     
L   3
  1      0.7122640246          -0.3088441215          -0.1215468600     
  2      0.2628702203           0.0196064117           0.5715227604     
  3      0.1160862609           1.1310344420           0.5498949471     
D   3
  1      1.645981194            0.2197679508     
  2      0.502076728            0.6555473627     
  3      0.193716810            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: V
data:
VANADIUM
S   3
  1   1130.7625170              0.1543289673     
  2    205.9698041              0.5353281423     
  3     55.74346711             0.4446345422     
L   3
  1     83.78385011            -0.0999672292           0.1559162750     
  2     19.46956493             0.3995128261           0.6076837186     
  3      6.332106784            0.7001154689           0.3919573931     
L   3
  1      6.141151276           -0.2277635023           0.0049515112     
  2      1.873246881            0.2175436044           0.5777664691     
  3      0.7227568825           0.9166769611           0.4846460366     
L   3
  1      0.7122640246          -0.3088441215          -0.1215468600     
  2      0.2628702203           0.0196064117           0.5715227604     
  3      0.1160862609           1.1310344420           0.5498949471     
D   3
  1      2.964817927            0.2197679508     
  2      0.9043639676           0.6555473627     
  3      0.3489317337           0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Cr
data:
CHROMIUM
S   3
  1   1232.3204500              0.1543289673     
  2    224.4687082              0.5353281423     
  3     60.74999251             0.4446345422     
L   3
  1     92.77462423            -0.0999672292           0.1559162750     
  2     21.55882749             0.3995128261           0.6076837186     
  3      7.011599810            0.7001154689           0.3919573931     
L   3
  1      6.899488096           -0.2277635023           0.0049515112     
  2      2.104563782            0.2175436044           0.5777664691     
  3      0.8120061343           0.9166769611           0.4846460366     
L   3
  1      0.7547780537          -0.3088441215          -0.1215468600     
  2      0.2785605708           0.0196064117           0.5715227604     
  3      0.1230152851           1.1310344420           0.5498949471     
D   3
  1      4.241479241            0.2197679508     
  2      1.293786360            0.6555473627     
  3      0.4991829993           0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Mn
data:
MANGANESE
S   3
  1   1337.1532660              0.1543289673     
  2    243.5641365              0.5353281423     
  3     65.91796062             0.4446345422     
L   3
  1    102.0220021             -0.0999672292           0.1559162750     
  2     23.70771923             0.3995128261           0.6076837186     
  3      7.710486098            0.7001154689           0.3919573931     
L   3
  1      7.701960922           -0.2277635023           0.0049515112     
  2      2.349343572            0.2175436044           0.5777664691     
  3      0.906449787            0.9166769611           0.4846460366     
L   3
  1      0.670982286           -0.3088441215          -0.1215468600     
  2      0.247634663            0.0196064117           0.5715227604     
  3      0.109358078            1.1310344420           0.5498949471     
D   3
  1      5.426950461            0.2197679508     
  2      1.655392868            0.6555473627     
  3      0.638702032            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Fe
data:
IRON
S   3
  1   1447.4004110              0.1543289673     
  2    263.6457916              0.5353281423     
  3     71.35284019             0.4446345422     
L   3
  1    111.9194891             -0.0999672292           0.1559162750     
  2     26.00768236             0.3995128261           0.6076837186     
  3      8.458505490            0.7001154689           0.3919573931     
L   3
  1      8.548569754           -0.2277635023           0.0049515112     
  2      2.607586250            0.2175436044           0.5777664691     
  3      1.006087840            0.9166769611           0.4846460366     
L   3
  1      0.5921156814          -0.3088441215          -0.1215468600     
  2      0.2185279254           0.0196064117           0.5715227604     
  3      0.0965042359           1.1310344420           0.5498949471     
D   3
  1      6.411803475            0.2197679508     
  2      1.955804428            0.6555473627     
  3      0.754610151            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Co
data:
COBALT
S   3
  1   1557.2987040              0.1543289673     
  2    283.6639029              0.5353281423     
  3     76.77052234             0.4446345422     
L   3
  1    121.8344741             -0.0999672292           0.1559162750     
  2     28.31171164             0.3995128261           0.6076837186     
  3      9.207847321            0.7001154689           0.3919573931     
L   3
  1      9.480851678           -0.2277635023           0.0049515112     
  2      2.891961952            0.2175436044           0.5777664691     
  3      1.115808827            0.9166769611           0.4846460366     
L   3
  1      0.5921156814          -0.3088441215          -0.1215468600     
  2      0.2185279254           0.0196064117           0.5715227604     
  3      0.0965042359           1.1310344420           0.5498949471     
D   3
  1      7.664527389            0.2197679508     
  2      2.337925151            0.6555473627     
  3      0.902044205            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ni
data:
NICKEL
S   3
  1   1679.7710280              0.1543289673     
  2    305.9723896              0.5353281423     
  3     82.80806943             0.4446345422     
L   3
  1    132.8588899             -0.0999672292           0.1559162750     
  2     30.87354878             0.3995128261           0.6076837186     
  3     10.04103627             0.7001154689           0.3919573931     
L   3
  1     10.33074335            -0.2277635023           0.0049515112     
  2      3.151206003            0.2175436044           0.5777664691     
  3      1.215833241            0.9166769611           0.4846460366     
L   3
  1      0.6309328384          -0.3088441215          -0.1215468600     
  2      0.2328538976           0.0196064117           0.5715227604     
  3      0.1028307363           1.1310344420           0.5498949471     
D   3
  1      8.627722755            0.2197679508     
  2      2.631730438            0.6555473627     
  3      1.015403419            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Cu
data:
COPPER
S   3
  1   1801.8067300              0.1543289673     
  2    328.2013450              0.5353281423     
  3     88.82409228             0.4446345422     
L   3
  1    144.1212184             -0.0999672292           0.1559162750     
  2     33.49067173             0.3995128261           0.6076837186     
  3     10.89220588             0.7001154689           0.3919573931     
L   3
  1     11.30775402            -0.2277635023           0.0049515112     
  2      3.449225397            0.2175436044           0.5777664691     
  3      1.330818388            0.9166769611           0.4846460366     
L   3
  1      0.6309328384          -0.3088441215          -0.1215468600     
  2      0.2328538976           0.0196064117           0.5715227604     
  3      0.1028307363           1.1310344420           0.5498949471     
D   3
  1      9.647911930            0.2197679508     
  2      2.942920654            0.6555473627     
  3      1.135470278            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Zn
data:
ZINC
S   3
  1   1929.4323010              0.1543289673     
  2    351.4485021              0.5353281423     
  3     95.11568021             0.4446345422     
L   3
  1    155.8416755             -0.0999672292           0.1559162750     
  2     36.21425391             0.3995128261           0.6076837186     
  3     11.77799934             0.7001154689           0.3919573931     
L   3
  1     12.28152744            -0.2277635023           0.0049515112     
  2      3.746257327            0.2175436044           0.5777664691     
  3      1.445422541            0.9166769611           0.4846460366     
L   3
  1      0.8897138854          -0.3088441215          -0.1215468600     
  2      0.3283603790           0.0196064117           0.5715227604     
  3      0.1450074055           1.1310344420           0.5498949471     
D   3
  1     10.94737077             0.2197679508     
  2      3.339297018            0.6555473627     
  3      1.288404602            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ga
data:
GALLIUM
S   3
  1   2061.4245320              0.1543289673     
  2    375.4910517              0.5353281423     
  3    101.6225324              0.4446345422     
L   3
  1    167.7618680             -0.0999672292           0.1559162750     
  2     38.98425028             0.3995128261           0.6076837186     
  3     12.67888813             0.7001154689           0.3919573931     
L   3
  1     12.61505520            -0.2277635023           0.0049515112     
  2      3.847993927            0.2175436044           0.5777664691     
  3      1.484675684            0.9166769611           0.4846460366     
L   3
  1      0.7985243736          -0.3088441215          -0.1215468600     
  2      0.2947057141           0.0196064117           0.5715227604     
  3      0.1301451506           1.1310344420           0.5498949471     
D   3
  1     12.61505520             0.2197679508     
  2      3.847993927            0.6555473627     
  3      1.484675684            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ge
data:
GERMANIUM
S   3
  1   2196.3842290              0.1543289673     
  2    400.0741292              0.5353281423     
  3    108.2756726              0.4446345422     
L   3
  1    180.3890380             -0.0999672292           0.1559162750     
  2     41.91853304             0.3995128261           0.6076837186     
  3     13.63320795             0.7001154689           0.3919573931     
L   3
  1     14.19665619            -0.2277635023           0.0049515112     
  2      4.330432640            0.2175436044           0.5777664691     
  3      1.670815538            0.9166769611           0.4846460366     
L   3
  1      0.9858325600          -0.3088441215          -0.1215468600     
  2      0.3638342150           0.0196064117           0.5715227604     
  3      0.1606730254           1.1310344420           0.5498949471     
D   3
  1     14.19665619             0.2197679508     
  2      4.330432640            0.6555473627     
  3      1.670815538            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: As
data:
ARSENIC
S   3
  1   2337.0656730              0.1543289673     
  2    425.6994298              0.5353281423     
  3    115.2108790              0.4446345422     
L   3
  1    193.1970535             -0.0999672292           0.1559162750     
  2     44.89484040             0.3995128261           0.6076837186     
  3     14.60119548             0.7001154689           0.3919573931     
L   3
  1     15.87163584            -0.2277635023           0.0049515112     
  2      4.841354819            0.2175436044           0.5777664691     
  3      1.867945198            0.9166769611           0.4846460366     
L   3
  1      1.1076814640          -0.3088441215          -0.1215468600     
  2      0.4088041239           0.0196064117           0.5715227604     
  3      0.1805322114           1.1310344420           0.5498949471     
D   3
  1     15.87163584             0.2197679508     
  2      4.841354819            0.6555473627     
  3      1.867945198            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Se
data:
SELENIUM
S   3
  1   2480.6268140              0.1543289673     
  2    451.8492708              0.5353281423     
  3    122.2880464              0.4446345422     
L   3
  1    206.1578780             -0.0999672292           0.1559162750     
  2     47.90665727             0.3995128261           0.6076837186     
  3     15.58073180             0.7001154689           0.3919573931     
L   3
  1     17.63999414            -0.2277635023           0.0049515112     
  2      5.380760465            0.2175436044           0.5777664691     
  3      2.076064666            0.9166769611           0.4846460366     
L   3
  1      1.2146442970          -0.3088441215          -0.1215468600     
  2      0.4482801363           0.0196064117           0.5715227604     
  3      0.1979652346           1.1310344420           0.5498949471     
D   3
  1     17.63999414             0.2197679508     
  2      5.380760465            0.6555473627     
  3      2.076064666            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Br
data:
BROMINE
S   3
  1   2629.9974710              0.1543289673     
  2    479.0573224              0.5353281423     
  3    129.6516070              0.4446345422     
L   3
  1    219.8350255             -0.0999672292           0.1559162750     
  2     51.08493222             0.3995128261           0.6076837186     
  3     16.61440546             0.7001154689           0.3919573931     
L   3
  1     19.50173109            -0.2277635023           0.0049515112     
  2      5.948649577            0.2175436044           0.5777664691     
  3      2.295173940            0.9166769611           0.4846460366     
L   3
  1      1.3960374880          -0.3088441215          -0.1215468600     
  2      0.5152256318           0.0196064117           0.5715227604     
  3      0.2275290713           1.1310344420           0.5498949471     
D   3
  1     19.50173109             0.2197679508     
  2      5.948649577            0.6555473627     
  3      2.295173940            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Kr
data:
KRYPTON
S   3
  1   2782.1600550              0.1543289673     
  2    506.7739270              0.5353281423     
  3    137.1528019              0.4446345422     
L   3
  1    233.9514118             -0.0999672292           0.1559162750     
  2     54.36527681             0.3995128261           0.6076837186     
  3     17.68127533             0.7001154689           0.3919573931     
L   3
  1     21.45684671            -0.2277635023           0.0049515112     
  2      6.545022156            0.2175436044           0.5777664691     
  3      2.525273021            0.9166769611           0.4846460366     
L   3
  1      1.5900493360          -0.3088441215          -0.1215468600     
  2      0.5868282053           0.0196064117           0.5715227604     
  3      0.2591495227           1.1310344420           0.5498949471     
D   3
  1     21.45684671             0.2197679508     
  2      6.545022156            0.6555473627     
  3      2.525273021            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Rb
data:
RUBIDIUM
S   3
  1   2938.6015290              0.1543289673     
  2    535.2699370              0.5353281423     
  3    144.8649340              0.4446345422     
L   3
  1    248.5070370             -0.0999672292           0.1559162750     
  2     57.7476910              0.3995128261           0.6076837186     
  3     18.7813410              0.7001154689           0.3919573931     
L   3
  1     23.50534097            -0.2277635023           0.0049515111     
  2      7.169878201            0.2175436044           0.5777664691     
  3      2.766361909            0.9166769611           0.4846460366     
L   3
  1      2.247796820           -0.3088441215          -0.1215468600     
  2      0.829578393            0.0196064117           0.5715227604     
  3      0.366350565            1.1310344420           0.5498949471     
L   3
  1      0.4869939919          -0.3842642607          -0.3481691526     
  2      0.2622161565          -0.1972567438           0.6290323690     
  3      0.1158254875           1.3754955120           0.6662832743     
D   3
  1     23.50534097             0.2197679508     
  2      7.169878201            0.6555473627     
  3      2.766361909            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Sr
data:
STRONTIUM
S   3
  1   3100.9839510              0.1543289673     
  2    564.8480978              0.5353281423     
  3    152.8699389              0.4446345422     
L   3
  1    263.5019007             -0.0999672292           0.1559162750     
  2     61.23217493             0.3995128261           0.6076837186     
  3     19.91460372             0.7001154689           0.3919573931     
L   3
  1     25.57886692            -0.2277635023           0.0049515111     
  2      7.802369707            0.2175436044           0.5777664691     
  3      3.010396794            0.9166769611           0.4846460366     
L   3
  1      2.461032403           -0.3088441215          -0.1215468600     
  2      0.908275734            0.0196064117           0.5715227604     
  3      0.401104140            1.1310344420           0.5498949471     
L   3
  1      0.4370804803          -0.3842642607          -0.3481691526     
  2      0.2353408164          -0.1972567438           0.6290323690     
  3      0.1039541771           1.3754955120           0.6662832743     
D   3
  1     25.57886692             0.2197679508     
  2      7.802369707            0.6555473627     
  3      3.010396794            0.2865732590     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Y
data:
YTTRIUM
S   3
  1   3266.0268690              0.1543289673     
  2    594.9108710              0.5353281423     
  3    161.0060990              0.4446345422     
L   3
  1    277.9377240             -0.0999672292           0.1559162750     
  2     64.5867500              0.3995128261           0.6076837186     
  3     21.0056160              0.7001154689           0.3919573931     
L   3
  1     30.6713260             -0.2277635023           0.0049515111     
  2      8.5572220              0.2175436044           0.5777664691     
  3      3.3492390              0.9166769611           0.4846460366     
L   3
  1      2.6676880             -0.3306100626          -0.1283927634     
  2      0.9845440              0.0576109533           0.5852047641     
  3      0.4347850              1.1557874500           0.5439442040     
L   3
  1      0.2074240             -0.3842642607          -0.3481691526     
  2      0.1116850             -0.1972567438           0.6290323690     
  3      0.0493330              1.3754955120           0.6662832743     
D   3
  1      5.6600430              0.2197679508     
  2      1.7747150              0.6555473627     
  3      0.6912950              0.2865732590     
D   3
  1      2.1282120              0.1250662138     
  2      0.9625940              0.6686785577     
  3      0.4728610              0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Zr
data:
ZIRCONIUM
S   3
  1   3435.3486770              0.1543289673     
  2    625.7530498              0.5353281423     
  3    169.3531958              0.4446345422     
L   3
  1    293.7830292             -0.0999672292           0.1559162750     
  2     68.26885797             0.3995128261           0.6076837186     
  3     22.20315144             0.7001154689           0.3919573931     
L   3
  1     30.73293103            -0.2277635023           0.0049515111     
  2      9.374523538            0.2175436044           0.5777664691     
  3      3.616982618            0.9166769611           0.4846460366     
L   3
  1      2.827607815           -0.3306100626          -0.1283927634     
  2      1.101055827            0.0576109533           0.5852047641     
  3      0.4846874856           1.1557874500           0.5439442040     
L   3
  1      0.8878301887          -0.3842642607          -0.3481691526     
  2      0.3457164736          -0.1972567438           0.6290323690     
  3      0.1521852428           1.3754955120           0.6662832743     
D   3
  1     30.73293103             0.2197679508     
  2      9.374523538            0.6555473627     
  3      3.616982618            0.2865732590     
D   3
  1      0.4869939919           0.1250662138     
  2      0.2622161565           0.6686785577     
  3      0.1158254875           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Nb
data:
NIOBIUM
S   3
  1   3610.7428640              0.1543289673     
  2    657.7013201              0.5353281423     
  3    177.9996445              0.4446345422     
L   3
  1    310.0675728             -0.0999672292           0.1559162750     
  2     72.05303569             0.3995128261           0.6076837186     
  3     23.43388348             0.7001154689           0.3919573931     
L   3
  1     33.01997858            -0.2277635023           0.0049515111     
  2     10.07214594             0.2175436044           0.5777664691     
  3      3.886147028            0.9166769611           0.4846460366     
L   3
  1      3.144798430           -0.3306100626          -0.1283927634     
  2      1.224568208            0.0576109533           0.5852047641     
  3      0.5390579399           1.1557874500           0.5439442040     
L   3
  1      0.4869939919          -0.3842642607          -0.3481691526     
  2      0.2622161565          -0.1972567438           0.6290323690     
  3      0.1158254875           1.3754955120           0.6662832743     
D   3
  1     33.01997858             0.2197679508     
  2     10.07214594             0.6555473627     
  3      3.886147028            0.2865732590     
D   3
  1      1.344878866            0.1250662138     
  2      0.5236888594           0.6686785577     
  3      0.2305291251           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Mo
data:
MOLYBDENUM
S   3
  1   3788.6661150              0.1543289673     
  2    690.1102623              0.5353281423     
  3    186.7707691              0.4446345422     
L   3
  1    326.4309567             -0.0999672292           0.1559162750     
  2     75.85553420             0.3995128261           0.6076837186     
  3     24.67057401             0.7001154689           0.3919573931     
L   3
  1     35.46948129            -0.2277635023           0.0049515111     
  2     10.81932234             0.2175436044           0.5777664691     
  3      4.174430912            0.9166769611           0.4846460366     
L   3
  1      3.496895188           -0.3306100626          -0.1283927634     
  2      1.361672861            0.0576109533           0.5852047641     
  3      0.5994117456           1.1557874500           0.5439442040     
L   3
  1      0.5129625081          -0.3842642607          -0.3481691526     
  2      0.2761985970          -0.1972567438           0.6290323690     
  3      0.1220017773           1.3754955120           0.6662832743     
D   3
  1     35.46948129             0.2197679508     
  2     10.81932234             0.6555473627     
  3      4.174430912            0.2865732590     
D   3
  1      1.702112315            0.1250662138     
  2      0.6627937127           0.6686785577     
  3      0.2917634240           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Tc
data:
TECHNETIUM
S   3
  1   3970.8682570              0.1543289673     
  2    723.2986098              0.5353281423     
  3    195.7528311              0.4446345422     
L   3
  1    343.5846323             -0.0999672292           0.1559162750     
  2     79.84167952             0.3995128261           0.6076837186     
  3     25.96699219             0.7001154689           0.3919573931     
L   3
  1     38.08991983            -0.2277635023           0.0049515111     
  2     11.61863962             0.2175436044           0.5777664691     
  3      4.482832367            0.9166769611           0.4846460366     
L   3
  1      3.829752708           -0.3306100626          -0.1283927634     
  2      1.491285854            0.0576109533           0.5852047641     
  3      0.6564677040           1.1557874500           0.5439442040     
L   3
  1      0.4616999826          -0.3842642607          -0.3481691526     
  2      0.2485968963          -0.1972567438           0.6290323690     
  3      0.1098096207           1.3754955120           0.6662832743     
D   3
  1     38.08991983             0.2197679508     
  2     11.61863962             0.6555473627     
  3      4.482832367            0.2865732590     
D   3
  1      2.101373228            0.1250662138     
  2      0.8182638428           0.6686785577     
  3      0.3602017580           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ru
data:
RUTHENIUM
S   3
  1   4159.2742100              0.1543289673     
  2    757.6169894              0.5353281423     
  3    205.0407239              0.4446345422     
L   3
  1    360.7986561             -0.0999672292           0.1559162750     
  2     83.84184843             0.3995128261           0.6076837186     
  3     27.26797127             0.7001154689           0.3919573931     
L   3
  1     40.71751678            -0.2277635023           0.0049515111     
  2     12.42014044             0.2175436044           0.5777664691     
  3      4.792076302            0.9166769611           0.4846460366     
L   3
  1      4.197516371           -0.3306100626          -0.1283927634     
  2      1.634491118            0.0576109533           0.5852047641     
  3      0.7195070139           1.1557874500           0.5439442040     
L   3
  1      0.4131354848          -0.3842642607          -0.3481691526     
  2      0.2224479167          -0.1972567438           0.6290323690     
  3      0.0982591566           1.3754955120           0.6662832743     
D   3
  1     40.71751678             0.2197679508     
  2     12.42014044             0.6555473627     
  3      4.792076302            0.2865732590     
D   3
  1      2.390895761            0.1250662138     
  2      0.9310024167           0.6686785577     
  3      0.4098295558           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Rh
data:
RHODIUM
S   3
  1   4350.0777940              0.1543289673     
  2    792.3721005              0.5353281423     
  3    214.4468133              0.4446345422     
L   3
  1    378.4334264             -0.0999672292           0.1559162750     
  2     87.93978981             0.3995128261           0.6076837186     
  3     28.60074899             0.7001154689           0.3919573931     
L   3
  1     43.52179455            -0.2277635023           0.0049515111     
  2     13.27553454             0.2175436044           0.5777664691     
  3      5.122113939            0.9166769611           0.4846460366     
L   3
  1      4.540857408           -0.3306100626          -0.1283927634     
  2      1.768186338            0.0576109533           0.5852047641     
  3      0.7783599789           1.1557874500           0.5439442040     
L   3
  1      0.4131354848          -0.3842642607          -0.3481691526     
  2      0.2224479167          -0.1972567438           0.6290323690     
  3      0.0982591566           1.3754955120           0.6662832743     
D   3
  1     43.52179455             0.2197679508     
  2     13.27553454             0.6555473627     
  3      5.122113939            0.2865732590     
D   3
  1      2.779066094            0.1250662138     
  2      1.082153932            0.6686785577     
  3      0.4763668250           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Pd
data:
PALLADIUM
S   3
  1   4545.1602690              0.1543289673     
  2    827.9066168              0.5353281423     
  3    224.0638402              0.4446345422     
L   3
  1    396.4889433             -0.0999672292           0.1559162750     
  2     92.13550365             0.3995128261           0.6076837186     
  3     29.96532535             0.7001154689           0.3919573931     
L   3
  1     46.41945097            -0.2277635023           0.0049515111     
  2     14.15941211             0.2175436044           0.5777664691     
  3      5.463141383            0.9166769611           0.4846460366     
L   3
  1      4.919104589           -0.3306100626          -0.1283927634     
  2      1.915473830            0.0576109533           0.5852047641     
  3      0.8431962954           1.1557874500           0.5439442040     
L   3
  1      0.4370804803          -0.3842642607          -0.3481691526     
  2      0.2353408164          -0.1972567438           0.6290323690     
  3      0.1039541771           1.3754955120           0.6662832743     
D   3
  1     46.41945097             0.2197679508     
  2     14.15941211             0.6555473627     
  3      5.463141383            0.2865732590     
D   3
  1      3.025977448            0.1250662138     
  2      1.178299934            0.6686785577     
  3      0.5186905316           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Ag
data:
SILVER
S   3
  1   4744.5216340              0.1543289673     
  2    864.2205383              0.5353281423     
  3    233.8918045              0.4446345422     
L   3
  1    414.9652069             -0.0999672292           0.1559162750     
  2     96.42898995             0.3995128261           0.6076837186     
  3     31.36170035             0.7001154689           0.3919573931     
L   3
  1     49.41048605            -0.2277635023           0.0049515111     
  2     15.07177314             0.2175436044           0.5777664691     
  3      5.815158634            0.9166769611           0.4846460366     
L   3
  1      5.290230450           -0.3306100626          -0.1283927634     
  2      2.059988316            0.0576109533           0.5852047641     
  3      0.9068119281           1.1557874500           0.5439442040     
L   3
  1      0.4370804803          -0.3842642607          -0.3481691526     
  2      0.2353408164          -0.1972567438           0.6290323690     
  3      0.1039541771           1.3754955120           0.6662832743     
D   3
  1     49.41048605             0.2197679508     
  2     15.07177314             0.6555473627     
  3      5.815158634            0.2865732590     
D   3
  1      3.283395668            0.1250662138     
  2      1.278537254            0.6686785577     
  3      0.5628152469           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Cd
data:
CADMIUM
S   3
  1   4950.2619050              0.1543289673     
  2    901.6963856              0.5353281423     
  3    244.0342313              0.4446345422     
L   3
  1    433.4469385             -0.0999672292           0.1559162750     
  2    100.7237469              0.3995128261           0.6076837186     
  3     32.75848861             0.7001154689           0.3919573931     
L   3
  1     52.59279235            -0.2277635023           0.0049515111     
  2     16.04247800             0.2175436044           0.5777664691     
  3      6.189686744            0.9166769611           0.4846460366     
L   3
  1      5.674851796           -0.3306100626          -0.1283927634     
  2      2.209757875            0.0576109533           0.5852047641     
  3      0.9727408566           1.1557874500           0.5439442040     
L   3
  1      0.5949150981          -0.3842642607          -0.3481691526     
  2      0.3203250000          -0.1972567438           0.6290323690     
  3      0.1414931855           1.3754955120           0.6662832743     
D   3
  1     52.59279235             0.2197679508     
  2     16.04247800             0.6555473627     
  3      6.189686744            0.2865732590     
D   3
  1      3.642963976            0.1250662138     
  2      1.418551290            0.6686785577     
  3      0.6244497700           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: In
data:
INDIUM
S   3
  1   5158.2247140              0.1543289673     
  2    939.5770707              0.5353281423     
  3    254.2862231              0.4446345422     
L   3
  1    452.3313223             -0.0999672292           0.1559162750     
  2    105.1120716              0.3995128261           0.6076837186     
  3     34.18570799             0.7001154689           0.3919573931     
L   3
  1     55.97539769            -0.2277635023           0.0049515112     
  2     17.07428044             0.2175436044           0.5777664691     
  3      6.587788204            0.9166769611           0.4846460366     
L   3
  1      5.048549180           -0.3306100626          -0.1283927634     
  2      1.965878882            0.0576109534           0.5852047641     
  3      0.8653847237           1.1155787450           0.5439442040     
L   3
  1      0.5669230612          -0.3842642607          -0.3481691526     
  2      0.3052530187          -0.1972567438           0.6290323690     
  3      0.1348356264           1.3754955120           0.6662832743     
D   3
  1     55.97539769             0.2197679508     
  2     17.07428044             0.6555473627     
  3      6.587788204            0.2865732590     
D   3
  1      5.048549180            0.1250662138     
  2      1.965878882            0.6686785577     
  3      0.8653847237           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Sn
data:
TIN
S   3
  1   5370.4664130              0.1543289673     
  2    978.2371611              0.5353281423     
  3    264.7491522              0.4446345422     
L   3
  1    472.0515322             -0.0999672292           0.1559162750     
  2    109.6946243              0.3995128261           0.6076837186     
  3     35.67609636             0.7001154689           0.3919573931     
L   3
  1     59.15141188            -0.2277635023           0.0049515112     
  2     18.04306600             0.2175436044           0.5777664691     
  3      6.961575790            0.9166769611           0.4846460366     
L   3
  1      5.583138529           -0.3306100626          -0.1283927634     
  2      2.174045204            0.0576109534           0.5852047641     
  3      0.9570200509           1.1155787450           0.5439442040     
L   3
  1      0.6235816420          -0.3842642607          -0.3481691526     
  2      0.3357601616          -0.1972567438           0.6290323690     
  3      0.1483111678           1.3754955120           0.6662832743     
D   3
  1     59.15141188             0.2197679508     
  2     18.04306600             0.6555473627     
  3      6.961575790            0.2865732590     
D   3
  1      5.583138529            0.1250662138     
  2      2.174045204            0.6686785577     
  3      0.9570200509           0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Sb
data:
ANTIMONY
S   3
  1   5586.9870020              0.1543289673     
  2   1017.6766570              0.5353281423     
  3    275.4230189              0.4446345422     
L   3
  1    492.1924888             -0.0999672292           0.1559162750     
  2    114.3749494              0.3995128261           0.6076837186     
  3     37.19828336             0.7001154689           0.3919573931     
L   3
  1     62.52179775            -0.2277635023           0.0049515112     
  2     19.07114112             0.2175436044           0.5777664691     
  3      7.358239131            0.9166769611           0.4846460366     
L   3
  1      6.120693149           -0.3306100626          -0.1283927634     
  2      2.383366187            0.0576109534           0.5852047641     
  3      1.049163663            1.1155787450           0.5439442040     
L   3
  1      0.6529226928          -0.3842642607          -0.3481691526     
  2      0.3515585034          -0.1972567438           0.6290323690     
  3      0.1552895732           1.3754955120           0.6662832743     
D   3
  1     62.52179775             0.2197679508     
  2     19.07114112             0.6555473627     
  3      7.358239131            0.2865732590     
D   3
  1      6.120693149            0.1250662138     
  2      2.383366187            0.6686785577     
  3      1.049163663            0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: Te
data:
TELLURIUM
S   3
  1   5810.0615910              0.1543289673     
  2   1058.3099720              0.5353281423     
  3    286.4199797              0.4446345422     
L   3
  1    512.7541920             -0.0999672292           0.1559162750     
  2    119.1530471              0.3995128261           0.6076837186     
  3     38.75226900             0.7001154689           0.3919573931     
L   3
  1     65.98556227            -0.2277635023           0.0049515112     
  2     20.12769970             0.2175436044           0.5777664691     
  3      7.765892279            0.9166769611           0.4846460366     
L   3
  1      6.707956921           -0.3306100626          -0.1283927634     
  2      2.612043655            0.0576109534           0.5852047641     
  3      1.149828048            1.1155787450           0.5439442040     
L   3
  1      0.7012713483          -0.3842642607          -0.3481691526     
  2      0.3775912653          -0.1972567438           0.6290323690     
  3      0.1667887020           1.3754955120           0.6662832743     
D   3
  1     65.98556227             0.2197679508     
  2     20.12769970             0.6555473627     
  3      7.765892279            0.2865732590     
D   3
  1      6.707956921            0.1250662138     
  2      2.612043655            0.6686785577     
  3      1.149828048            0.3052468245     


name: STO-3G
description: MB Minimal Basis: 1 Function/AO
elt: I
data:
IODINE
S   3
  1   6035.1836230              0.1543289673     
  2   1099.3162310              0.5353281423     
  3    297.5178737              0.4446345422     
L   3
  1    533.7366418             -0.0999672292           0.1559162750     
  2    124.0289171              0.3995128261           0.6076837186     
  3     40.33805328             0.7001154689           0.3919573931     
L   3
  1     69.54270545            -0.2277635023           0.0049515112     
  2     21.21274175             0.2175436044           0.5777664691     
  3      8.184535234            0.9166769611           0.4846460366     
L   3
  1      7.295991196           -0.3306100626          -0.1283927634     
  2      2.841021154            0.0576109534           0.5852047641     
  3      1.250624506            1.1155787450           0.5439442040     
L   3
  1      0.7900364582          -0.3842642607          -0.3481691526     
  2      0.4253857892          -0.1972567438           0.6290323690     
  3      0.1879003836           1.3754955120           0.6662832743     
D   3
  1     69.54270545             0.2197679508     
  2     21.21274175             0.6555473627     
  3      8.184535234            0.2865732590     
D   3
  1      7.295991196            0.1250662138     
  2      2.841021154            0.6686785577     
  3      1.250624506            0.3052468245     


name: SV (Dunning-Hay)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   7
  1   9995.0000000              0.0011660        
  2   1506.0000000              0.0088760        
  3    350.3000000              0.0423800        
  4    104.1000000              0.1429290        
  5     34.8400000              0.3553720        
  6     12.2200000              0.4620850        
  7      4.3690000              0.1408480        
S   2
  1     12.2200000             -0.1484520        
  2      1.2080000              1.0552700        
S   1
  1      0.3634000              1.0000000        
P   4
  1     44.3600000              0.0208760        
  2     10.0800000              0.1301070        
  3      2.9960000              0.3961660        
  4      0.9383000              0.6204040        
P   1
  1      0.2733000              1.0000000        


name: SV (Dunning-Hay)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   7
  1  12100.0000000              0.0012000        
  2   1821.0000000              0.0090920        
  3    432.8000000              0.0413050        
  4    132.5000000              0.1378670        
  5     43.7700000              0.3624330        
  6     14.9100000              0.4722470        
  7      5.1270000              0.1300350        
S   2
  1     14.9100000             -0.1408100        
  2      1.4910000              1.0533270        
S   1
  1      0.4468000              1.0000000        
P   4
  1     56.4500000              0.0208750        
  2     12.9200000              0.1300320        
  3      3.8650000              0.3956790        
  4      1.2030000              0.6214500        
P   1
  1      0.3444000              1.0000000        


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: H
data:
HYDROGEN
S   6
  1     35.52322122             0.00916359628    
  2      6.513143725            0.04936149294    
  3      1.822142904            0.16853830490    
  4      0.625955266            0.37056279970    
  5      0.243076747            0.41649152980    
  6      0.100112428            0.13033408410    


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: He
data:
HELIUM
S   6
  1     65.98456824             0.00916359628    
  2     12.09819836             0.04936149294    
  3      3.384639924            0.16853830490    
  4      1.162715163            0.37056279970    
  5      0.451516322            0.41649152980    
  6      0.185959356            0.13033408410    


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   6
  1    167.17584620             0.00916359628    
  2     30.651508400            0.04936149294    
  3      8.5751874770           0.16853830490    
  4      2.9458083370           0.37056279970    
  5      1.1439435810           0.41649152980    
  6      0.4711391391           0.13033408410    
L   6
  1      6.5975639810          -0.01325278809          0.0037596966     
  2      1.3058300920          -0.04699171014          0.0376793698     
  3      0.4058510193          -0.03378537151          0.1738967435     
  4      0.1561455158           0.25024178610          0.4180364347     
  5      0.0678141039           0.59511725260          0.4258595477     
  6      0.0310841655           0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   6
  1    312.87049370             0.00916359628    
  2     57.364462530            0.04936149294    
  3     16.048509400            0.16853830490    
  4      5.5130961190           0.37056279970    
  5      2.1408965530           0.41649152980    
  6      0.8817394283           0.13033408410    
L   6
  1     13.633247440           -0.01325278809          0.0037596966     
  2      2.6983754640          -0.04699171014          0.0376793698     
  3      0.8386530829          -0.03378537151          0.1738967435     
  4      0.3226600698           0.25024178610          0.4180364347     
  5      0.1401314882           0.59511725260          0.4258595477     
  6      0.0642325139           0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   6
  1    506.01114720             0.00916359628    
  2     92.776814208            0.04936149294    
  3     25.955658144            0.16853830490    
  4      8.9164451376           0.37056279970    
  5      3.4625066112           0.41649152980    
  6      1.4260543128           0.13033408410    
L   6
  1     23.194575000           -0.01325278809          0.00375969662    
  2      4.5908100000          -0.04699171014          0.03767936984    
  3      1.4268195000          -0.03378537151          0.17389674350    
  4      0.5489482500           0.25024178610          0.41803643470    
  5      0.2384100000           0.59511725260          0.42585954770    
  6      0.1092802500           0.24070617630          0.10170829550    


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   6
  1    742.7370491              0.00916359628    
  2    136.1800249              0.04936149294    
  3     38.09826352             0.16853830490    
  4     13.08778177             0.37056279970    
  5      5.082368648            0.41649152980    
  6      2.093200076            0.13033408410    
L   6
  1     30.49723950            -0.01325278809          0.0037596966     
  2      6.036199601           -0.04699171014          0.0376793698     
  3      1.876046337           -0.03378537151          0.1738967435     
  4      0.7217826470           0.25024178610          0.4180364347     
  5      0.3134706954           0.59511725260          0.4258595477     
  6      0.1436865550           0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   6
  1   1027.8284580              0.00916359628    
  2    188.4512226              0.04936149294    
  3     52.72186097             0.16853830490    
  4     18.11138217             0.37056279970    
  5      7.033179691            0.41649152980    
  6      2.896651794            0.13033408410    
L   6
  1     39.19880787            -0.01325278809          0.0037596966     
  2      7.758467071           -0.04699171014          0.0376793698     
  3      2.411325783           -0.03378537151          0.1738967435     
  4      0.9277239437           0.25024178610          0.4180364347     
  5      0.4029111410           0.59511725260          0.4258595477     
  6      0.1846836552           0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   6
  1   1355.5842340              0.00916359628    
  2    248.5448855              0.04936149294    
  3     69.53390229             0.16853830490    
  4     23.88677211             0.37056279970    
  5      9.275932609            0.41649152980    
  6      3.820341298            0.13033408410    
L   6
  1     52.18776196            -0.01325278809          0.0037596966     
  2     10.32932006            -0.04699171014          0.0376793698     
  3      3.210344977           -0.03378537151          0.1738967435     
  4      1.235135428            0.25024178610          0.4180364347     
  5      0.536420158            0.59511725260          0.4258595477     
  6      0.245880606            0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   6
  1   1728.6265740              0.00916359628    
  2    316.9417900              0.04936149294    
  3     88.66889139             0.16853830490    
  4     30.46015731             0.37056279970    
  5     11.82857044             0.41649152980    
  6      4.871658522            0.13033408410    
L   6
  1     67.03228091            -0.01325278809          0.0037596966     
  2     13.26743777            -0.04699171014          0.0376793698     
  3      4.123509771           -0.03378537151          0.1738967435     
  4      1.586462839            0.25024178610          0.4180364347     
  5      0.689001892            0.59511725260          0.4258595477     
  6      0.315819978            0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Ne
data:
NEON
S   6
  1   2146.9554750              0.00916359628    
  2    393.6419362              0.04936149294    
  3    110.1268283              0.16853830490    
  4     37.83153777             0.37056279970    
  5     14.69109318             0.41649152980    
  6      6.050603466            0.13033408410    
L   6
  1     85.50442919            -0.01325278809          0.0037596966     
  2     16.92355799            -0.04699171014          0.0376793698     
  3      5.259829210           -0.03378537151          0.1738967435     
  4      2.023645885            0.25024178610          0.4180364347     
  5      0.878870787            0.59511725260          0.4258595477     
  6      0.402850785            0.24070617630          0.1017082955     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   6
  1   2600.7567710              0.00916359628    
  2    476.8459071              0.04936149294    
  3    133.4043010              0.16853830490    
  4     45.82797788             0.37056279970    
  5     17.79634487             0.41649152980    
  6      7.329517596            0.13033408410    
L   6
  1    124.8424044             -0.0132527881           0.0037596966     
  2     24.70956992            -0.0469917101           0.0376793698     
  3      7.679715913           -0.0337853715           0.1738967435     
  4      2.954663523            0.2502417861           0.4180364347     
  5      1.283212382            0.5951172526           0.4258595477     
  6      0.5881901217           0.2407061763           0.1017082955     
L   6
  1      9.433006047           -0.0079431264          -0.0071393589     
  2      2.526243756           -0.0710026417          -0.0182927707     
  3      0.947368250           -0.1785026925           0.0762162143     
  4      0.4240594435           0.1510635058           0.4145098597     
  5      0.2098454079           0.7354914767           0.4889621471     
  6      0.1081470943           0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   6
  1   2600.7567710              0.00916359628    
  2    476.8459071              0.04936149294    
  3    133.4043010              0.16853830490    
  4     45.82797788             0.37056279970    
  5     17.79634487             0.41649152980    
  6      7.329517596            0.13033408410    
L   6
  1    124.8424044             -0.0132527881           0.0037596966     
  2     24.70956992            -0.0469917101           0.0376793698     
  3      7.679715913           -0.0337853715           0.1738967435     
  4      2.954663523            0.2502417861           0.4180364347     
  5      1.283212382            0.5951172526           0.4258595477     
  6      0.5881901217           0.2407061763           0.1017082955     
L   6
  1      9.433006047           -0.0079431264          -0.0071393589     
  2      2.526243756           -0.0710026417          -0.0182927707     
  3      0.947368250           -0.1785026925           0.0762162143     
  4      0.4240594435           0.1510635058           0.4145098597     
  5      0.2098454079           0.7354914767           0.4889621471     
  6      0.1081470943           0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   6
  1      0.3644586388D+04       0.00916359628    
  2      0.6682309248D+03       0.04936149294    
  3      0.1869469321D+03       0.16853830490    
  4      0.6422131675D+02       0.37056279970    
  5      0.2493901660D+02       0.41649152980    
  6      0.1027126426D+02       0.13033408410    
L   6
  1      0.1959641441D+03      -0.0132527881           0.0037596966     
  2      0.3878641831D+02      -0.0469917101           0.0376793698     
  3      0.1205478990D+02      -0.0337853715           0.1738967435     
  4      0.4637912184D+01       0.2502417861           0.4180364347     
  5      0.2014248422D+01       0.5951172526           0.4258595477     
  6      0.9232774259D+00       0.2407061763           0.1017082955     
L   6
  1      0.8901677544D+01      -0.0079431264          -0.0071393589     
  2      0.2383949209D+01      -0.0710026417          -0.0182927707     
  3      0.8940062839D+00      -0.1785026925           0.0762162143     
  4      0.4001736462D+00       0.1510635058           0.4145098597     
  5      0.1980255441D+00       0.7354914767           0.4889621471     
  6      0.1020555436D+00       0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   6
  1      0.4229261737D+04       0.00916359628    
  2      0.7754305100D+03       0.04936149294    
  3      0.2169375129D+03       0.16853830490    
  4      0.7452389069D+02       0.37056279970    
  5      0.2893980755D+02       0.41649152980    
  6      0.1191901091D+02       0.13033408410    
L   6
  1      0.2404904849D+03      -0.0132527881           0.0037596966     
  2      0.4759934318D+02      -0.0469917101           0.0376793698     
  3      0.1479384038D+02      -0.0337853715           0.1738967435     
  4      0.5691723632D+01       0.2502417861           0.4180364347     
  5      0.2471919452D+01       0.5951172526           0.4258595477     
  6      0.1133061545D+01       0.2407061763           0.1017082955     
L   6
  1      0.9433006047D+01      -0.0079431264          -0.0071393589     
  2      0.2526243756D+01      -0.0710026417          -0.0182927707     
  3      0.9473682506D+00      -0.1785026925           0.0762162143     
  4      0.4240594435D+00       0.1510635058           0.4145098597     
  5      0.2098454079D+00       0.7354914767           0.4889621471     
  6      0.1081470943D+00       0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHOROUS
S   6
  1      0.4857412371D+04       0.00916359628    
  2      0.8906012410D+03       0.04936149294    
  3      0.2491581331D+03       0.16853830490    
  4      0.8559254335D+02       0.37056279970    
  5      0.3323808927D+02       0.41649152980    
  6      0.1368928069D+02       0.13033408410    
L   6
  1      0.2906649590D+03      -0.0132527881           0.0037596966     
  2      0.5753018103D+02      -0.0469917101           0.0376793698     
  3      0.1788033738D+02      -0.0337853715           0.1738967435     
  4      0.6879210280D+01       0.2502417861           0.4180364347     
  5      0.2987645712D+01       0.5951172526           0.4258595477     
  6      0.1369456623D+01       0.2407061763           0.1017082955     
L   6
  1      0.1111939652D+02      -0.0079431264          -0.00713935891    
  2      0.2977874272D+01      -0.0710026417          -0.01829277070    
  3      0.1116734493D+01      -0.1785026925           0.07621621428    
  4      0.4998708868D+00       0.1510635058           0.41450985970    
  5      0.2473606277D+00       0.7354914767           0.48896214710    
  6      0.1274811462D+00       0.2760593123           0.10588165210    


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   6
  1      0.5529038289D+04       0.00916359628    
  2      0.1013743118D+04       0.04936149294    
  3      0.2836087927D+03       0.16853830490    
  4      0.9742727471D+02       0.37056279970    
  5      0.3783386178D+02       0.41649152980    
  6      0.1558207360D+02       0.13033408410    
L   6
  1      0.3455896791D+03      -0.0132527881           0.0037596966     
  2      0.6840121655D+02      -0.0469917101           0.0376793698     
  3      0.2125904712D+02      -0.0337853715           0.1738967435     
  4      0.8179121699D+01       0.2502417861           0.4180364347     
  5      0.3552198128D+01       0.5951172526           0.4258595477     
  6      0.1628232301D+01       0.2407061763           0.1017082955     
L   6
  1      0.1294439442D+02      -0.0079431264          -0.0071393589     
  2      0.3466625105D+01      -0.0710026417          -0.0182927707     
  3      0.1300021248D+01      -0.1785026925           0.0762162143     
  4      0.5819134077D+00       0.1510635058           0.4145098597     
  5      0.2879592903D+00       0.7354914767           0.4889621471     
  6      0.1484042983D+00       0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   6
  1      0.6236545525D+04       0.00916359628    
  2      0.1143463795D+04       0.04936149294    
  3      0.3198999635D+03       0.16853830490    
  4      0.1098942714D+03       0.37056279970    
  5      0.4267516141D+02       0.41649152980    
  6      0.1757598814D+02       0.13033408410    
L   6
  1      0.4039729660D+03      -0.0132527881           0.0037596966     
  2      0.7995679269D+02      -0.0469917101           0.0376793698     
  3      0.2485051157D+02      -0.0337853715           0.1738967435     
  4      0.9560887526D+01       0.2502417861           0.4180364347     
  5      0.4152299968D+01       0.5951172526           0.4258595477     
  6      0.1903302881D+01       0.2407061763           0.1017082955     
L   6
  1      0.1358352871D+02      -0.0079431264          -0.0071393589     
  2      0.3637791008D+01      -0.0710026417          -0.0182927707     
  3      0.1364210281D+01      -0.1785026925           0.0762162143     
  4      0.6106455986D+00       0.1510635058           0.4145098597     
  5      0.3021773873D+00       0.7354914767           0.4889621471     
  6      0.1557318157D+00       0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Ar
data:
ARGON
S   6
  1      0.6994673814D+04       0.00916359628    
  2      0.1282465787D+04       0.04936149294    
  3      0.3587877117D+03       0.16853830490    
  4      0.1232532624D+03       0.37056279970    
  5      0.4786284856D+02       0.41649152980    
  6      0.1971256419D+02       0.13033408410    
L   6
  1      0.4682992148D+03      -0.0132527881           0.0037596966     
  2      0.9268863609D+02      -0.0469917101           0.0376793698     
  3      0.2880755901D+02      -0.0337853715           0.1738967435     
  4      0.1108330631D+02       0.2502417861           0.4180364347     
  5      0.4813487481D+01       0.5951172526           0.4258595477     
  6      0.2206373495D+01       0.2407061763           0.1017082955     
L   6
  1      0.1672190907D+02      -0.0079431264          -0.0071393589     
  2      0.4478277461D+01      -0.0710026417          -0.0182927707     
  3      0.1679401631D+01      -0.1785026925           0.0762162143     
  4      0.7517310408D+00       0.1510635058           0.4145098597     
  5      0.3719933828D+00       0.7354914767           0.4889621471     
  6      0.1917125747D+00       0.2760593123           0.1058816521     


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   6
  1      0.8001321412D+04       0.9163596280D-02 
  2      0.1467033522D+04       0.4936149294D-01 
  3      0.4104231128D+03       0.1685383049D+00 
  4      0.1409914163D+03       0.3705627997D+00 
  5      0.5475109279D+02       0.4164915298D+00 
  6      0.2254952356D+02       0.1303340841D+00 
L   6
  1      0.5433465051D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1075424534D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.3342411435D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.1285946155D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.5584872913D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.2559955878D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.2329374963D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.6238275397D+01      -0.7100264172D-01      -0.1829277070D-01 
  3      0.2339419558D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.1047167197D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.5181896807D+00       0.7354914767D+00       0.4889621471D+00 
  6      0.2670571103D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.2791996035D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.8983681264D+00      -0.5585965000D-01      -0.5259505000D-01 
  3      0.3838418398D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.1914081612D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1033137261D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.5744847995D-01       0.3406258000D+00       0.1221817000D+00 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   6
  1      0.8857157042D+04       0.9163596280D-02 
  2      0.1623950048D+04       0.4936149294D-01 
  3      0.4543227021D+03       0.1685383049D+00 
  4      0.1560721100D+03       0.3705627997D+00 
  5      0.6060736746D+02       0.4164915298D+00 
  6      0.2496146087D+02       0.1303340841D+00 
L   6
  1      0.6175690999D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1222330419D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.3798993832D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.1461609860D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.6347781583D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.2909652740D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.2790660509D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.7473639527D+01      -0.7100264172D-01      -0.1829277070D-01 
  3      0.2802694233D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.1254537458D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.6208066547D+00       0.7354914767D+00       0.4889621471D+00 
  6      0.3199423636D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.2525343962D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.8125686765D+00      -0.5585965000D-01      -0.5259505000D-01 
  3      0.3471826822D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.1731275539D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.9344665645D-01       0.9049199000D+00       0.5791672000D+00 
  6      0.5196181158D-01       0.3406258000D+00       0.1221817000D+00 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Sc
data:
SCANDIUM
S   6
  1      0.9765965612D+04       0.9163596280D-02 
  2      0.1790579105D+04       0.4936149294D-01 
  3      0.5009395073D+03       0.1685383049D+00 
  4      0.1720862408D+03       0.3705627997D+00 
  5      0.6682612307D+02       0.4164915298D+00 
  6      0.2752268785D+02       0.1303340841D+00 
L   6
  1      0.6965419408D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1378638281D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.4284797502D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.1648516043D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.7159516407D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.3281730201D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.2813541924D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.8101568293D+01      -0.7100264172D-01      -0.1829277070D-01 
  3      0.3186549647D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.1456361493D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.7247816118D+00       0.7354914767D+00       0.4889621471D+00 
  6      0.3722203375D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3495285760D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1124662528D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.4805296640D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2396229120D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1293379328D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.7191946240D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.3303913712D+01       0.6633434386D-02 
  2      0.9513589381D+00       0.5958177963D-01 
  3      0.3741932894D+00       0.2401949582D+00 
  4      0.1710190513D+00       0.4648114679D+00 
  5      0.8511036872D-01       0.3434092326D+00 
  6      0.4370945627D-01       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Ti
data:
TITANIUM
S   6
  1      0.1071915049D+05       0.9163596280D-02 
  2      0.1965344508D+04       0.4936149294D-01 
  3      0.5498325692D+03       0.1685383049D+00 
  4      0.1888823272D+03       0.3705627997D+00 
  5      0.7334853490D+02       0.4164915298D+00 
  6      0.3020897724D+02       0.1303340841D+00 
L   6
  1      0.7802650277D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1544348120D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.4799822446D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.1846664702D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.8020077386D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.3676188261D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.3231173000D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.9304133165D+01      -0.7100264172D-01      -0.1829277070D-01 
  3      0.3659548520D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.1672538054D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.8323653382D+00       0.7354914767D+00       0.4889621471D+00 
  6      0.4274712576D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3945849940D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1269638557D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.5424729410D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2705118030D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1460104007D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.8119033060D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.9857130992D+01       0.6633434386D-02 
  2      0.2838351873D+01       0.5958177963D-01 
  3      0.1116394855D+01       0.2401949582D+00 
  4      0.5102303926D+00       0.4648114679D+00 
  5      0.2539243232D+00       0.3434092326D+00 
  6      0.1304058985D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: V
data:
VANADIUM
S   6
  1      0.1172711958D+05       0.9163596280D-02 
  2      0.2150154537D+04       0.4936149294D-01 
  3      0.6015357556D+03       0.1685383049D+00 
  4      0.2066437671D+03       0.3705627997D+00 
  5      0.8024582178D+02       0.4164915298D+00 
  6      0.3304966087D+02       0.1303340841D+00 
L   6
  1      0.8687383606D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1719459935D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.5344068663D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.2056055839D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.8929464520D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.4093026920D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.3677692843D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1058988298D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.4165266112D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.1903668182D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.9473909465D+00       0.7354914767D+00       0.4889621471D+00 
  6      0.4865440459D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3945849940D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1269638557D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.5424729410D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2705118030D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1460104007D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.8119033060D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.1775512307D+02       0.6633434386D-02 
  2      0.5112571484D+01       0.5958177963D-01 
  3      0.2010902367D+01       0.2401949582D+00 
  4      0.9190507280D+00       0.4648114679D+00 
  5      0.4573803079D+00       0.3434092326D+00 
  6      0.2348931731D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Cr
data:
CHROMIUM
S   6
  1      0.1278037523D+05       0.9163596280D-02 
  2      0.2343267809D+04       0.4936149294D-01 
  3      0.6555618898D+03       0.1685383049D+00 
  4      0.2252032023D+03       0.3705627997D+00 
  5      0.8745299358D+02       0.4164915298D+00 
  6      0.3601797222D+02       0.1303340841D+00 
L   6
  1      0.9619619397D+03      -0.1325278809D-01       0.3759696623D-02 
  2      0.1903973727D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.5917536153D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.2276689453D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.9887677808D+01       0.5951172526D+00       0.4258595477D+00 
  6      0.4532246179D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.4131830800D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1189756908D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.4679611797D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.2138741641D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1064379017D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.5466246804D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.4181372125D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1345421481D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.5748523813D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2866582688D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1547255544D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.8603646625D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.2540054323D+02       0.6633434386D-02 
  2      0.7314063241D+01       0.5958177963D-01 
  3      0.2876804194D+01       0.2401949582D+00 
  4      0.1314797293D+01       0.4648114679D+00 
  5      0.6543299215D+00       0.3434092326D+00 
  6      0.3360390223D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Mn
data:
MANGANESE
S   6
  1      0.1386759465D+05       0.9163596280D-02 
  2      0.2542608299D+04       0.4936149294D-01 
  3      0.7113301755D+03       0.1685383049D+00 
  4      0.2443611136D+03       0.3705627997D+00 
  5      0.9489257116D+02       0.4164915298D+00 
  6      0.3908200111D+02       0.1303340841D+00 
L   6
  1      0.1057846193D+04      -0.1325278809D-01       0.3759696623D-02 
  2      0.2093753687D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.6507370854D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.2503620123D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.1087323925D+02       0.5951172526D+00       0.4258595477D+00 
  6      0.4984001099D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.4612400067D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1328136390D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.5223892945D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.2387496625D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1188175917D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.6102020713D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3717154485D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1196052239D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.5110320352D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2548333507D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1375478602D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.7648466265D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.3249986195D+02       0.6633434386D-02 
  2      0.9358305588D+01       0.5958177963D-01 
  3      0.3680855890D+01       0.2401949582D+00 
  4      0.1682276246D+01       0.4648114679D+00 
  5      0.8372117055D+00       0.3434092326D+00 
  6      0.4299601680D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Fe
data:
IRON
S   6
  1      0.1501096599D+05       0.9163596280D-02 
  2      0.2752244183D+04       0.4936149294D-01 
  3      0.7699787412D+03       0.1685383049D+00 
  4      0.2645084788D+03       0.3705627997D+00 
  5      0.1027163826D+03       0.4164915298D+00 
  6      0.4230427873D+02       0.1303340841D+00 
L   6
  1      0.1160471300D+04      -0.1325278809D-01       0.3759696623D-02 
  2      0.2296875558D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.7138672115D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.2746504472D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.1192808764D+02       0.5951172526D+00       0.4258595477D+00 
  6      0.5467515293D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.5119400644D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1474126743D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.5798109557D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.2649933133D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1318781646D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.6772762188D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3280243765D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1055469423D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.4509658273D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2248804868D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1213806186D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.6749472985D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.3839775750D+02       0.6633434386D-02 
  2      0.1105659923D+02       0.5958177963D-01 
  3      0.4348837299D+01       0.2401949582D+00 
  4      0.1987566453D+01       0.4648114679D+00 
  5      0.9891442645D+00       0.3434092326D+00 
  6      0.5079869660D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Co
data:
COBALT
S   6
  1      0.1615071939D+05       0.9163596280D-02 
  2      0.2961216722D+04       0.4936149294D-01 
  3      0.8284417269D+03       0.1685383049D+00 
  4      0.2845920923D+03       0.3705627997D+00 
  5      0.1105154375D+03       0.4164915298D+00 
  6      0.4551636020D+02       0.1303340841D+00 
L   6
  1      0.1263277841D+04      -0.1325278809D-01       0.3759696623D-02 
  2      0.2500356532D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.7771089465D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.2989818223D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.1298480091D+02       0.5951172526D+00       0.4258595477D+00 
  6      0.5951884302D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.5677707451D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1634890679D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.6430434366D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.2938927062D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1462604102D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.7511379752D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3280243765D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1055469423D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.4509658273D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2248804868D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1213806186D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.6749472985D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.4589982603D+02       0.6633434386D-02 
  2      0.1321681302D+02       0.5958177963D-01 
  3      0.5198503467D+01       0.2401949582D+00 
  4      0.2375892770D+01       0.4648114679D+00 
  5      0.1182401073D+01       0.3434092326D+00 
  6      0.6072363305D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Ni
data:
NICKEL
S   6
  1      0.1742087786D+05       0.9163596280D-02 
  2      0.3194098886D+04       0.4936149294D-01 
  3      0.8935937642D+03       0.1685383049D+00 
  4      0.3069735755D+03       0.3705627997D+00 
  5      0.1192068223D+03       0.4164915298D+00 
  6      0.4909595247D+02       0.1303340841D+00 
L   6
  1      0.1377587853D+04      -0.1325278809D-01       0.3759696623D-02 
  2      0.2726605878D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.8474270746D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.3260357407D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.1415975444D+02       0.5951172526D+00       0.4258595477D+00 
  6      0.6490451468D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.6186673993D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1781447130D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.7006877582D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.3202381203D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1593716273D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.8184722119D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3495285760D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1124662528D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.4805296640D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2396229120D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1293379328D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.7191946240D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.5166802249D+02       0.6633434386D-02 
  2      0.1487775992D+02       0.5958177963D-01 
  3      0.5851795470D+01       0.2401949582D+00 
  4      0.2674469420D+01       0.4648114679D+00 
  5      0.1330992522D+01       0.3434092326D+00 
  6      0.6835472614D+00       0.5389056980D-01 


name: STO-6G
description: MB Minimal Basis: 1 Function/AO
elt: Cu
data:
COPPER
S   6
  1      0.1868650813D+05       0.9163596280D-02 
  2      0.3426150811D+04       0.4936149294D-01 
  3      0.9585135305D+03       0.1685383049D+00 
  4      0.3292752674D+03       0.3705627997D+00 
  5      0.1278672219D+03       0.4164915298D+00 
  6      0.5266278326D+02       0.1303340841D+00 
L   6
  1      0.1494364736D+04      -0.1325278809D-01       0.3759696623D-02 
  2      0.2957737804D+03      -0.4699171014D-01       0.3767936984D-01 
  3      0.9192627051D+02      -0.3378537151D-01       0.1738967435D+00 
  4      0.3536734970D+02       0.2502417861D+00       0.4180364347D+00 
  5      0.1536006408D+02       0.5951172526D+00       0.4258595477D+00 
  6      0.7040641197D+01       0.2407061763D+00       0.1017082955D+00 
L   6
  1      0.6771767076D+02      -0.7943126362D-02      -0.7139358907D-02 
  2      0.1949924150D+02      -0.7100264172D-01      -0.1829277070D-01 
  3      0.7669539880D+01      -0.1785026925D+00       0.7621621428D-01 
  4      0.3505240396D+01       0.1510635058D+00       0.4145098597D+00 
  5      0.1744438999D+01       0.7354914767D+00       0.4889621471D+00 
  6      0.8958776854D+00       0.2760593123D+00       0.1058816521D+00 
L   6
  1      0.3495285760D+01       0.3775056000D-02      -0.7052075000D-02 
  2      0.1124662528D+01      -0.5585965000D-01      -0.5259505000D-01 
  3      0.4805296640D+00      -0.3192946000D+00      -0.3773450000D-01 
  4      0.2396229120D+00      -0.2764780000D-01       0.3874773000D+00 
  5      0.1293379328D+00       0.9049199000D+00       0.5791672000D+00 
  6      0.7191946240D-01       0.3406258000D+00       0.1221817000D+00 
D   6
  1      0.5777753235D+02       0.6633434386D-02 
  2      0.1663698771D+02       0.5958177963D-01 
  3      0.6543743805D+01       0.2401949582D+00 
  4      0.2990713326D+01       0.4648114679D+00 
  5      0.1488376365D+01       0.3434092326D+00 
  6      0.7643736320D+00       0.5389056980D-01 


