# all_value

name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ca
data:
CALCIUM
S   18
  1 2402654.0000000             0.00000931       
  2 359789.8000000              0.00007239       
  3  81878.0900000              0.00038059       
  4  23190.8900000              0.00160453       
  5   7565.2120000              0.00580780       
  6   2730.7020000              0.01859566       
  7   1064.6400000              0.05287776       
  8    441.0605000              0.13015149       
  9    191.7269000              0.25931471       
 10     86.5377400              0.36149610       
 11     39.8992400              0.26411160       
 12     17.6406500              0.05709398       
 13      8.3599900             -0.00182200       
 14      3.9513300              0.00211164       
 15      1.7134000             -0.00097709       
 16      0.8108600              0.00045581       
 17      0.3602500             -0.00019146       
 18      0.0448400             -0.00007874       
S   18
  1 2402654.0000000            -0.00000270       
  2 359789.8000000             -0.00002102       
  3  81878.0900000             -0.00011052       
  4  23190.8900000             -0.00046666       
  5   7565.2120000             -0.00169513       
  6   2730.7020000             -0.00548346       
  7   1064.6400000             -0.01596597       
  8    441.0605000             -0.04151384       
  9    191.7269000             -0.09286387       
 10     86.5377400             -0.16531657       
 11     39.8992400             -0.17664074       
 12     17.6406500              0.06444422       
 13      8.3599900              0.51087962       
 14      3.9513300              0.49463804       
 15      1.7134000              0.08750094       
 16      0.8108600             -0.00359101       
 17      0.3602500              0.00249220       
 18      0.0448400              0.00064587       
S   18
  1 2402654.0000000             0.00000093       
  2 359789.8000000              0.00000725       
  3  81878.0900000              0.00003811       
  4  23190.8900000              0.00016101       
  5   7565.2120000              0.00058466       
  6   2730.7020000              0.00189504       
  7   1064.6400000              0.00552525       
  8    441.0605000              0.01447010       
  9    191.7269000              0.03271581       
 10     86.5377400              0.06003190       
 11     39.8992400              0.06701683       
 12     17.6406500             -0.02593660       
 13      8.3599900             -0.26747467       
 14      3.9513300             -0.42697256       
 15      1.7134000              0.06796405       
 16      0.8108600              0.71020539       
 17      0.3602500              0.44180057       
 18      0.0448400             -0.01186924       
S   18
  1 2402654.0000000            -0.00000022       
  2 359789.8000000             -0.00000173       
  3  81878.0900000             -0.00000910       
  4  23190.8900000             -0.00003844       
  5   7565.2120000             -0.00013965       
  6   2730.7020000             -0.00045251       
  7   1064.6400000             -0.00132038       
  8    441.0605000             -0.00345841       
  9    191.7269000             -0.00783686       
 10     86.5377400             -0.01441517       
 11     39.8992400             -0.01621648       
 12     17.6406500              0.00634420       
 13      8.3599900              0.06740626       
 14      3.9513300              0.11447396       
 15      1.7134000             -0.02634477       
 16      0.8108600             -0.23369885       
 17      0.3602500             -0.31607538       
 18      0.0448400              0.56111035       
S   1
  1      0.0810800              1.0000000        
S   1
  1      0.0214300              1.0000000        
P   12
  1   4061.2890000              0.00019799       
  2    962.2465000              0.00173208       
  3    312.1686000              0.00953379       
  4    118.7144000              0.03839012       
  5     49.8067000              0.11675881       
  6     22.2599800              0.25626874       
  7     10.2876400              0.37978080       
  8      4.8611540              0.30829326       
  9      2.2487730              0.08592090       
 10      1.0336620              0.00212067       
 11      0.4641320              0.00128880       
 12      0.0673900              0.00014728       
P   12
  1   4061.2890000             -0.00006455       
  2    962.2465000             -0.00056458       
  3    312.1686000             -0.00313125       
  4    118.7144000             -0.01274086       
  5     49.8067000             -0.03991403       
  6     22.2599800             -0.09050448       
  7     10.2876400             -0.14261898       
  8      4.8611540             -0.10980904       
  9      2.2487730              0.15162490       
 10      1.0336620              0.46176411       
 11      0.4641320              0.43260031       
 12      0.0673900              0.00252874       
P   12
  1   4061.2890000              0.00001336       
  2    962.2465000              0.00011852       
  3    312.1686000              0.00064872       
  4    118.7144000              0.00267993       
  5     49.8067000              0.00828513       
  6     22.2599800              0.01921235       
  7     10.2876400              0.02954984       
  8      4.8611540              0.02431232       
  9      2.2487730             -0.04111230       
 10      1.0336620             -0.10419758       
 11      0.4641320             -0.15036537       
 12      0.0673900              0.59861164       
P   1
  1      0.1987500              1.0000000        
P   1
  1      0.0254200              1.0000000        
D   4
  1     16.9462300              0.01547300       
  2      4.4721200              0.07887400       
  3      1.4380900              0.20878000       
  4      0.4669900              0.33021300       
D   1
  1      0.1415100              1.0000000        
D   1
  1      0.0416400              1.0000000        
F   1
  1      0.1509000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sc
data:
SCANDIUM
S   19
  1 2715278.0000000             8.147221E-06     
  2 406598.4000000              6.334788E-05     
  3  92530.0400000              0.0003330384     
  4  26207.9200000              0.001404055      
  5   8549.4290000              0.005081725      
  6   3085.9750000              0.01626926       
  7   1203.1720000              0.04624577       
  8    498.4869000              0.1137223        
  9    216.7360000              0.2257636        
 10     97.8747600              0.3106700        
 11     45.2043300              0.2191906        
 12     20.2118700              0.07215879       
 13      9.5747510              0.1187030        
 14      4.5403460              0.1220532        
 15      1.9956870              0.02136795       
 16      0.9422150             -0.0005357246     
 17      0.4178450              0.0002435774     
 18      0.0957610             -8.796617E-05     
 19      0.0513510              7.878246E-05     
S   19
  1 2715278.0000000            -4.722109E-06     
  2 406598.4000000             -3.671829E-05     
  3  92530.0400000             -0.0001930883     
  4  26207.9200000             -0.000814687      
  5   8549.4290000             -0.002955526      
  6   3085.9750000             -0.009520035      
  7   1203.1720000             -0.02746858       
  8    498.4869000             -0.06991528       
  9    216.7360000             -0.1499251        
 10     97.8747600             -0.2459153        
 11     45.2043300             -0.2401293        
 12     20.2118700              0.03567987       
 13      9.5747510              0.4915023        
 14      4.5403460              0.4911381        
 15      1.9956870              0.09120633       
 16      0.9422150             -0.005356723      
 17      0.4178450              0.0008812836     
 18      0.0957610             -0.0007605536     
 19      0.0513510              0.0006340116     
S   19
  1 2715278.0000000             9.139905E-07     
  2 406598.4000000              7.108513E-06     
  3  92530.0400000              3.738126E-05     
  4  26207.9200000              0.0001578828     
  5   8549.4290000              0.0005737686     
  6   3085.9750000              0.001859244      
  7   1203.1720000              0.005433182      
  8    498.4869000              0.01425387       
  9    216.7360000              0.03246144       
 10     97.8747600              0.06003454       
 11     45.2043300              0.06916105       
 12     20.2118700             -0.02113084       
 13      9.5747510             -0.2666832        
 14      4.5403460             -0.4367591        
 15      1.9956870              0.06498243       
 16      0.9422150              0.7009599        
 17      0.4178450              0.4515562        
 18      0.0957610              0.0301191        
 19      0.0513510             -0.0132948        
S   19
  1 2715278.0000000            -2.201951E-07     
  2 406598.4000000             -1.711419E-06     
  3  92530.0400000             -9.008469E-06     
  4  26207.9200000             -3.799997E-05     
  5   8549.4290000             -0.0001383227     
  6   3085.9750000             -0.0004473692     
  7   1203.1720000             -0.001310691      
  8    498.4869000             -0.00342986       
  9    216.7360000             -0.007847579      
 10     97.8747600             -0.01447189       
 11     45.2043300             -0.01690669       
 12     20.2118700              0.005396115      
 13      9.5747510              0.06671062       
 14      4.5403460              0.1178356        
 15      1.9956870             -0.02738134       
 16      0.9422150             -0.2260149        
 17      0.4178450             -0.3073539        
 18      0.0957610              0.2544054        
 19      0.0513510              0.5981590        
S   19
  1 2715278.0000000            -3.757238E-07     
  2 406598.4000000             -2.981907E-06     
  3  92530.0400000             -1.522586E-05     
  4  26207.9200000             -6.684686E-05     
  5   8549.4290000             -0.0002313129     
  6   3085.9750000             -0.0007959729     
  7   1203.1720000             -0.002161961      
  8    498.4869000             -0.006206459      
  9    216.7360000             -0.01261905       
 10     97.8747600             -0.02739459       
 11     45.2043300             -0.02336516       
 12     20.2118700             -0.005734627      
 13      9.5747510              0.1536025        
 14      4.5403460              0.1447100        
 15      1.9956870              0.09359699       
 16      0.9422150             -0.8687730        
 17      0.4178450              0.02114597       
 18      0.0957610              2.2754980        
 19      0.0513510             -1.1907700        
S   19
  1 2715278.0000000            -5.962768E-07     
  2 406598.4000000             -4.822853E-06     
  3  92530.0400000             -2.395005E-05     
  4  26207.9200000             -0.0001090335     
  5   8549.4290000             -0.0003601944     
  6   3085.9750000             -0.001311233      
  7   1203.1720000             -0.003322435      
  8    498.4869000             -0.0103752        
  9    216.7360000             -0.01892174       
 10     97.8747600             -0.04755287       
 11     45.2043300             -0.02931692       
 12     20.2118700             -0.03090088       
 13      9.5747510              0.3074597        
 14      4.5403460              0.1803100        
 15      1.9956870              0.2358178        
 16      0.9422150             -2.3885440        
 17      0.4178450              2.3294070        
 18      0.0957610              0.9918252        
 19      0.0513510             -3.5072400        
S   1
  1      0.0238780              1.0000000        
P   15
  1  10592.1900000              0.0000450        
  2   2507.5330000              0.0004010        
  3    814.4571000              0.0023020        
  4    311.5195000              0.0100370        
  5    131.9617000              0.0349540        
  6     59.9871800              0.0979090        
  7     28.6625000              0.2106800        
  8     14.1085100              0.3300930        
  9      7.1037060              0.3310270        
 10      3.6092000              0.1579600        
 11      1.7760700              0.0220990        
 12      0.8547600             -0.0016050        
 13      0.4022390             -0.0013260        
 14      0.1546650             -0.0002800        
 15      0.0649450              0.0000340        
P   15
  1  10592.1900000             -0.0000150        
  2   2507.5330000             -0.0001310        
  3    814.4571000             -0.0007570        
  4    311.5195000             -0.0033180        
  5    131.9617000             -0.0117060        
  6     59.9871800             -0.0336040        
  7     28.6625000             -0.0748790        
  8     14.1085100             -0.1225480        
  9      7.1037060             -0.1302760        
 10      3.6092000              0.0145960        
 11      1.7760700              0.3091840        
 12      0.8547600              0.4629980        
 13      0.4022390              0.3049570        
 14      0.1546650              0.0508780        
 15      0.0649450             -0.0044930        
P   15
  1  10592.1900000             -0.0000040        
  2   2507.5330000             -0.0000320        
  3    814.4571000             -0.0001850        
  4    311.5195000             -0.0008080        
  5    131.9617000             -0.0028700        
  6     59.9871800             -0.0082070        
  7     28.6625000             -0.0184730        
  8     14.1085100             -0.0301010        
  9      7.1037060             -0.0329430        
 10      3.6092000              0.0079580        
 11      1.7760700              0.0879930        
 12      0.8547600              0.1523770        
 13      0.4022390              0.0971700        
 14      0.1546650             -0.2569380        
 15      0.0649450             -0.5878150        
P   15
  1  10592.1900000              0.0000040        
  2   2507.5330000              0.0000390        
  3    814.4571000              0.0002210        
  4    311.5195000              0.0009840        
  5    131.9617000              0.0034230        
  6     59.9871800              0.0099930        
  7     28.6625000              0.0219160        
  8     14.1085100              0.0370080        
  9      7.1037060              0.0377940        
 10      3.6092000             -0.0043790        
 11      1.7760700             -0.1101640        
 12      0.8547600             -0.1610170        
 13      0.4022390             -0.1824820        
 14      0.1546650              0.3886110        
 15      0.0649450              0.6911000        
P   15
  1  10592.1900000              0.0000090        
  2   2507.5330000              0.0000740        
  3    814.4571000              0.0004790        
  4    311.5195000              0.0018690        
  5    131.9617000              0.0074240        
  6     59.9871800              0.0187630        
  7     28.6625000              0.0487170        
  8     14.1085100              0.0654400        
  9      7.1037060              0.1079480        
 10      3.6092000             -0.0587130        
 11      1.7760700             -0.1703060        
 12      0.8547600             -0.7549770        
 13      0.4022390              0.6201170        
 14      0.1546650              1.1675480        
 15      0.0649450             -1.0095310        
P   1
  1      0.0263590              1.0000000        
D   7
  1     50.5138000              0.0042660        
  2     14.7405000              0.0277080        
  3      5.1950000              0.1000010        
  4      2.0284600              0.2315810        
  5      0.8040860              0.3460330        
  6      0.3076890              0.3733740        
  7      0.1113920              0.2642880        
D   7
  1     50.5138000             -0.0043890        
  2     14.7405000             -0.0283630        
  3      5.1950000             -0.1051370        
  4      2.0284600             -0.2348540        
  5      0.8040860             -0.3246090        
  6      0.3076890             -0.0642890        
  7      0.1113920              0.6017490        
D   7
  1     50.5138000              0.0058590        
  2     14.7405000              0.0373230        
  3      5.1950000              0.1419240        
  4      2.0284600              0.3068960        
  5      0.8040860              0.3081890        
  6      0.3076890             -0.7607170        
  7      0.1113920             -0.2047750        
D   1
  1      0.0373520              1.0000000        
F   1
  1      0.7267000              1.0000000        
F   1
  1      0.1665000              1.0000000        
G   1
  1      0.4187000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   19
  1 3014643.0000000             8.060782E-06     
  2 451432.9000000              6.267518E-05     
  3 102733.8000000              0.0003295006     
  4  29098.1700000              0.001389203      
  5   9492.3300000              0.005028469      
  6   3426.3460000              0.01610419       
  7   1335.8960000              0.04581232       
  8    553.5026000              0.1128613        
  9    240.6925000              0.2248193        
 10    108.7293000              0.3114571        
 11     50.2645700              0.2224995        
 12     22.5800400              0.07293128       
 13     10.7143200              0.1160683        
 14      5.0935460              0.1194774        
 15      2.2441830              0.02097868       
 16      1.0595700             -0.0005091715     
 17      0.4688490              0.0002217859     
 18      0.1061430             -7.636896E-05     
 19      0.0552620              7.719539E-05     
S   19
  1 3014643.0000000            -4.630486E-06     
  2 451432.9000000             -3.600451E-05     
  3 102733.8000000             -0.000189342      
  4  29098.1700000             -0.0007988781     
  5   9492.3300000             -0.002898698      
  6   3426.3460000             -0.009339701      
  7   1335.8960000             -0.02697464       
  8    553.5026000             -0.06878913       
  9    240.6925000             -0.1481037        
 10    108.7293000             -0.2445253        
 11     50.2645700             -0.2419916        
 12     22.5800400              0.0318379        
 13     10.7143200              0.4932686        
 14      5.0935460              0.4939655        
 15      2.2441830              0.09196313       
 16      1.0595700             -0.005316992      
 17      0.4688490              0.0008085624     
 18      0.1061430             -0.0006918459     
 19      0.0552620              0.0006086512     
S   19
  1 3014643.0000000             9.230559E-07     
  2 451432.9000000              7.178974E-06     
  3 102733.8000000              3.775134E-05     
  4  29098.1700000              0.0001594532     
  5   9492.3300000              0.000579515      
  6   3426.3460000              0.001878414      
  7   1335.8960000              0.005492747      
  8    553.5026000              0.01443297       
  9    240.6925000              0.03296408       
 10    108.7293000              0.06125493       
 11     50.2645700              0.07134113       
 12     22.5800400             -0.0197315        
 13     10.7143200             -0.2741869        
 14      5.0935460             -0.4440977        
 15      2.2441830              0.07776084       
 16      1.0595700              0.7068444        
 17      0.4688490              0.4413892        
 18      0.1061430              0.02799769       
 19      0.0552620             -0.0121079        
S   19
  1 3014643.0000000            -2.180323E-07     
  2 451432.9000000             -1.69486E-06      
  3 102733.8000000             -8.919208E-06     
  4  29098.1700000             -3.763633E-05     
  5   9492.3300000             -0.0001369575     
  6   3426.3460000             -0.0004432894     
  7   1335.8960000             -0.001298868      
  8    553.5026000             -0.003406752      
  9    240.6925000             -0.007810829      
 10    108.7293000             -0.01449245       
 11     50.2645700             -0.01708136       
 12     22.5800400              0.004897666      
 13     10.7143200              0.06753108       
 14      5.0935460              0.1173318        
 15      2.2441830             -0.02985025       
 16      1.0595700             -0.2277634        
 17      0.4688490             -0.2928115        
 18      0.1061430              0.2665300        
 19      0.0552620              0.5912406        
S   19
  1 3014643.0000000            -3.975126E-07     
  2 451432.9000000             -3.16108E-06      
  3 102733.8000000             -1.609375E-05     
  4  29098.1700000             -7.092947E-05     
  5   9492.3300000             -0.000244271      
  6   3426.3460000             -0.0008457892     
  7   1335.8960000             -0.002282208      
  8    553.5026000             -0.006619873      
  9    240.6925000             -0.01335024       
 10    108.7293000             -0.0295583        
 11     50.2645700             -0.02477039       
 12     22.5800400             -0.008414624      
 13     10.7143200              0.1693855        
 14      5.0935460              0.1500787        
 15      2.2441830              0.09787777       
 16      1.0595700             -0.9653608        
 17      0.4688490              0.1489721        
 18      0.1061430              2.1911790        
 19      0.0552620             -1.2433250        
S   19
  1 3014643.0000000            -6.302483E-07     
  2 451432.9000000             -5.084585E-06     
  3 102733.8000000             -2.534482E-05     
  4  29098.1700000             -0.000114826      
  5   9492.3300000             -0.0003817497     
  6   3426.3460000             -0.001379645      
  7   1335.8960000             -0.003531666      
  8    553.5026000             -0.01092225       
  9    240.6925000             -0.02029554       
 10    108.7293000             -0.05024404       
 11     50.2645700             -0.03316309       
 12     22.5800400             -0.03098063       
 13     10.7143200              0.3244673        
 14      5.0935460              0.2155689        
 15      2.2441830              0.1499616        
 16      1.0595700             -2.4207410        
 17      0.4688490              2.5308740        
 18      0.1061430              0.3423600        
 19      0.0552620             -2.7337220        
S   1
  1      0.0254650              1.0000000        
P   15
  1  11912.0300000              0.0000440        
  2   2819.9470000              0.0003910        
  3    915.9479000              0.0022480        
  4    350.3842000              0.0098230        
  5    148.4825000              0.0343380        
  6     67.5394400              0.0966660        
  7     32.3033200              0.2094170        
  8     15.9278600              0.3301890        
  9      8.0380350              0.3319360        
 10      4.0939160              0.1584880        
 11      2.0223900              0.0223100        
 12      0.9761020             -0.0015660        
 13      0.4595950             -0.0013240        
 14      0.1771520             -0.0002710        
 15      0.0735170              0.0000320        
P   15
  1  11912.0300000             -0.0000150        
  2   2819.9470000             -0.0001310        
  3    915.9479000             -0.0007550        
  4    350.3842000             -0.0033190        
  5    148.4825000             -0.0117500        
  6     67.5394400             -0.0339220        
  7     32.3033200             -0.0761640        
  8     15.9278600             -0.1257020        
  9      8.0380350             -0.1330980        
 10      4.0939160              0.0174060        
 11      2.0223900              0.3151650        
 12      0.9761020              0.4618140        
 13      0.4595950              0.2998560        
 14      0.1771520              0.0500000        
 15      0.0735170             -0.0042300        
P   15
  1  11912.0300000              0.0000040        
  2   2819.9470000              0.0000310        
  3    915.9479000              0.0001820        
  4    350.3842000              0.0007950        
  5    148.4825000              0.0028330        
  6     67.5394400              0.0081540        
  7     32.3033200              0.0184720        
  8     15.9278600              0.0304000        
  9      8.0380350              0.0330470        
 10      4.0939160             -0.0082510        
 11      2.0223900             -0.0885540        
 12      0.9761020             -0.1496120        
 13      0.4595950             -0.0942270        
 14      0.1771520              0.2508460        
 15      0.0735170              0.5866430        
P   15
  1  11912.0300000              0.0000040        
  2   2819.9470000              0.0000390        
  3    915.9479000              0.0002230        
  4    350.3842000              0.0009920        
  5    148.4825000              0.0034760        
  6     67.5394400              0.0101720        
  7     32.3033200              0.0225760        
  8     15.9278600              0.0382380        
  9      8.0380350              0.0393370        
 10      4.0939160             -0.0061060        
 11      2.0223900             -0.1129620        
 12      0.9761020             -0.1681140        
 13      0.4595950             -0.1659320        
 14      0.1771520              0.3914030        
 15      0.0735170              0.6818400        
P   15
  1  11912.0300000              0.0000090        
  2   2819.9470000              0.0000730        
  3    915.9479000              0.0004680        
  4    350.3842000              0.0018560        
  5    148.4825000              0.0072930        
  6     67.5394400              0.0188560        
  7     32.3033200              0.0484050        
  8     15.9278600              0.0673780        
  9      8.0380350              0.1045410        
 10      4.0939160             -0.0537600        
 11      2.0223900             -0.1917490        
 12      0.9761020             -0.6947200        
 13      0.4595950              0.5601620        
 14      0.1771520              1.1813360        
 15      0.0735170             -0.9932720        
P   1
  1      0.0294010              1.0000000        
D   7
  1     64.0130000              0.0038870        
  2     18.8179000              0.0263990        
  3      6.7287000              0.0975110        
  4      2.6641300              0.2328480        
  5      1.0786800              0.3531520        
  6      0.4232090              0.3721860        
  7      0.1559990              0.2476720        
D   7
  1     64.0130000             -0.0039700        
  2     18.8179000             -0.0268730        
  3      6.7287000             -0.1022750        
  4      2.6641300             -0.2377280        
  5      1.0786800             -0.3121140        
  6      0.4232090             -0.0423780        
  7      0.1559990              0.5886580        
D   7
  1     64.0130000              0.0064180        
  2     18.8179000              0.0438090        
  3      6.7287000              0.1723250        
  4      2.6641300              0.3753320        
  5      1.0786800              0.2249470        
  6      0.4232090             -0.7919070        
  7      0.1559990             -0.1044280        
D   1
  1      0.0518840              1.0000000        
F   1
  1      1.2483000              1.0000000        
F   1
  1      0.2836000              1.0000000        
G   1
  1      0.7251000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: V
data:
VANADIUM
S   19
  1 3321857.0000000             8.039999E-06     
  2 497435.6000000              6.251402E-05     
  3 113202.7000000              0.0003286553     
  4  32063.3300000              0.001385697      
  5  10459.6200000              0.005016217      
  6   3775.5060000              0.01606931       
  7   1472.0400000              0.04574242       
  8    609.9331000              0.1128544        
  9    265.2634000              0.2254344        
 10    119.8607000              0.3140461        
 11     55.4489100              0.2267819        
 12     24.9837200              0.07334069       
 13     11.8805600              0.1102474        
 14      5.6603110              0.1131358        
 15      2.4957030              0.01971295       
 16      1.1778660             -0.0004719088     
 17      0.5200440              0.0001861606     
 18      0.1159650             -6.208598E-05     
 19      0.0589380              7.295314E-05     
S   19
  1 3321857.0000000            -4.503003E-06     
  2 497435.6000000             -3.501295E-05     
  3 113202.7000000             -0.0001841339     
  4  32063.3300000             -0.0007769216     
  5  10459.6200000             -0.002819505      
  6   3775.5060000             -0.009087486      
  7   1472.0400000             -0.02627134       
  8    609.9331000             -0.06712726       
  9    265.2634000             -0.1451130        
 10    119.8607000             -0.2412483        
 11     55.4489100             -0.2416314        
 12     24.9837200              0.03067362       
 13     11.8805600              0.4970415        
 14      5.6603110              0.4958875        
 15      2.4957030              0.09181868       
 16      1.1778660             -0.005392514      
 17      0.5200440              0.000710238      
 18      0.1159650             -0.0006363128     
 19      0.0589380              0.0005979932     
S   19
  1 3321857.0000000             9.320648E-07     
  2 497435.6000000              7.249306E-06     
  3 113202.7000000              3.811967E-05     
  4  32063.3300000              0.0001610238     
  5  10459.6200000              0.000585221      
  6   3775.5060000              0.001897502      
  7   1472.0400000              0.005550909      
  8    609.9331000              0.01460584       
  9    265.2634000              0.03342974       
 10    119.8607000              0.06235722       
 11     55.4489100              0.07312435       
 12     24.9837200             -0.01911472       
 13     11.8805600             -0.2817249        
 14      5.6603110             -0.4488151        
 15      2.4957030              0.09202696       
 16      1.1778660              0.7110117        
 17      0.5200440              0.4309274        
 18      0.1159650              0.02604589       
 19      0.0589380             -0.01101049       
S   19
  1 3321857.0000000            -2.158944E-07     
  2 497435.6000000             -1.678519E-06     
  3 113202.7000000             -8.831213E-06     
  4  32063.3300000             -3.727769E-05     
  5  10459.6200000             -0.0001356099     
  6   3775.5060000             -0.0004392351     
  7   1472.0400000             -0.001286948      
  8    609.9331000             -0.003382149      
  9    265.2634000             -0.007765646      
 10    119.8607000             -0.01447985       
 11     55.4489100             -0.01715502       
 12     24.9837200              0.004610101      
 13     11.8805600              0.06827831       
 14      5.6603110              0.1161368        
 15      2.4957030             -0.03277049       
 16      1.1778660             -0.2280000        
 17      0.5200440             -0.2793991        
 18      0.1159650              0.2771165        
 19      0.0589380              0.5852999        
S   19
  1 3321857.0000000            -4.093416E-07     
  2 497435.6000000             -3.258956E-06     
  3 113202.7000000             -1.65639E-05      
  4  32063.3300000             -7.316689E-05     
  5  10459.6200000             -0.0002512784     
  6   3775.5060000             -0.0008732657     
  7   1472.0400000             -0.002347654      
  8    609.9331000             -0.00685315       
  9    265.2634000             -0.0137642        
 10    119.8607000             -0.03084679       
 11     55.4489100             -0.02562208       
 12     24.9837200             -0.01005123       
 13     11.8805600              0.1795330        
 14      5.6603110              0.1522400        
 15      2.4957030              0.09483887       
 16      1.1778660             -1.0148760        
 17      0.5200440              0.2308810        
 18      0.1159650              2.1133210        
 19      0.0589380             -1.2530480        
S   19
  1 3321857.0000000            -6.539963E-07     
  2 497435.6000000             -5.267399E-06     
  3 113202.7000000             -2.632092E-05     
  4  32063.3300000             -0.0001188719     
  5  10459.6200000             -0.0003968552     
  6   3775.5060000             -0.00142746       
  7   1472.0400000             -0.003679181      
  8    609.9331000             -0.01130774       
  9    265.2634000             -0.02128221       
 10    119.8607000             -0.05218271       
 11     55.4489100             -0.03599014       
 12     24.9837200             -0.03088759       
 13     11.8805600              0.3380657        
 14      5.6603110              0.2389559        
 15      2.4957030              0.07609068       
 16      1.1778660             -2.4081130        
 17      0.5200440              2.6335920        
 18      0.1159650             -0.0535851        
 19      0.0589380             -2.2301350        
S   1
  1      0.0269460              1.0000000        
P   15
  1  13273.2000000              0.0000430        
  2   3142.1260000              0.0003840        
  3   1020.5880000              0.0022100        
  4    390.4407000              0.0096780        
  5    165.5043000              0.0339360        
  6     75.3200600              0.0959170        
  7     36.0550300              0.2088530        
  8     17.8043600              0.3306600        
  9      9.0029290              0.3323120        
 10      4.5945440              0.1581880        
 11      2.2767600              0.0222520        
 12      1.1011780             -0.0015650        
 13      0.5186380             -0.0013530        
 14      0.2005650             -0.0002650        
 15      0.0812910              0.0000290        
P   15
  1  13273.2000000             -0.0000150        
  2   3142.1260000             -0.0001310        
  3   1020.5880000             -0.0007550        
  4    390.4407000             -0.0033250        
  5    165.5043000             -0.0118110        
  6     75.3200600             -0.0342560        
  7     36.0550300             -0.0773630        
  8     17.8043600             -0.1284560        
  9      9.0029290             -0.1350780        
 10      4.5945440              0.0208380        
 11      2.2767600              0.3204990        
 12      1.1011780              0.4602600        
 13      0.5186380              0.2953460        
 14      0.2005650              0.0490460        
 15      0.0812910             -0.0038240        
P   15
  1  13273.2000000              0.0000040        
  2   3142.1260000              0.0000320        
  3   1020.5880000              0.0001830        
  4    390.4407000              0.0008020        
  5    165.5043000              0.0028620        
  6     75.3200600              0.0082870        
  7     36.0550300              0.0188700        
  8     17.8043600              0.0313070        
  9      9.0029290              0.0336600        
 10      4.5945440             -0.0094790        
 11      2.2767600             -0.0923130        
 12      1.1011780             -0.1489890        
 13      0.5186380             -0.0836440        
 14      0.2005650              0.2493390        
 15      0.0812910              0.5805150        
P   15
  1  13273.2000000              0.0000040        
  2   3142.1260000              0.0000390        
  3   1020.5880000              0.0002230        
  4    390.4407000              0.0009960        
  5    165.5043000              0.0034980        
  6     75.3200600              0.0102960        
  7     36.0550300              0.0229620        
  8     17.8043600              0.0392080        
  9      9.0029290              0.0399430        
 10      4.5945440             -0.0071210        
 11      2.2767600             -0.1162250        
 12      1.1011780             -0.1694960        
 13      0.5186380             -0.1553740        
 14      0.2005650              0.3950220        
 15      0.0812910              0.6789080        
P   15
  1  13273.2000000              0.0000090        
  2   3142.1260000              0.0000750        
  3   1020.5880000              0.0004790        
  4    390.4407000              0.0019060        
  5    165.5043000              0.0075120        
  6     75.3200600              0.0195300        
  7     36.0550300              0.0504020        
  8     17.8043600              0.0706850        
  9      9.0029290              0.1087750        
 10      4.5945440             -0.0585360        
 11      2.2767600             -0.2154480        
 12      1.1011780             -0.6773420        
 13      0.5186380              0.5859790        
 14      0.2005650              1.1291080        
 15      0.0812910             -0.9740510        
P   1
  1      0.0317950              1.0000000        
D   7
  1     77.6115000              0.0035950        
  2     22.9159000              0.0252100        
  3      8.2795400              0.0947860        
  4      3.3099300              0.2303630        
  5      1.3586300              0.3528940        
  6      0.5413500              0.3704140        
  7      0.2023560              0.2457180        
D   7
  1     77.6115000             -0.0038180        
  2     22.9159000             -0.0267170        
  3      8.2795400             -0.1036900        
  4      3.3099300             -0.2476890        
  5      1.3586300             -0.3115230        
  6      0.5413500             -0.0228270        
  7      0.2023560              0.5697260        
D   7
  1     77.6115000              0.0060010        
  2     22.9159000              0.0422060        
  3      8.2795400              0.1707510        
  4      3.3099300              0.3855180        
  5      1.3586300              0.2062040        
  6      0.5413500             -0.7786690        
  7      0.2023560             -0.1147210        
D   1
  1      0.0675680              1.0000000        
F   1
  1      1.7749000              1.0000000        
F   1
  1      0.4125000              1.0000000        
G   1
  1      1.1368000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cr
data:
CHROMIUM
S   19
  1 6177194.0000000             4.128667E-06     
  2 924929.5000000              3.210767E-05     
  3 210486.5000000              0.0001688416     
  4  59620.0500000              0.000712852      
  5  19450.7600000              0.002589325      
  6   7022.0560000              0.00837735       
  7   2738.7630000              0.02441725       
  8   1135.8140000              0.06365135       
  9    495.0923000              0.1427618        
 10    224.7487000              0.2541275        
 11    105.3836000              0.3009512        
 12     50.1935900              0.1766513        
 13     22.2495700              0.06936709       
 14     10.9826500              0.1179579        
 15      5.3836650              0.08916187       
 16      2.3436850              0.0110363        
 17      1.1052020             -0.0003546048     
 18      0.4878480              0.0001057311     
 19      0.0895990              1.11464E-05      
S   19
  1 6177194.0000000            -2.301772E-06     
  2 924929.5000000             -1.789536E-05     
  3 210486.5000000             -9.416174E-05     
  4  59620.0500000             -0.0003975074     
  5  19450.7600000             -0.001447025      
  6   7022.0560000             -0.004694622      
  7   2738.7630000             -0.01382387       
  8   1135.8140000             -0.03674643       
  9    495.0923000             -0.08647185       
 10    224.7487000             -0.1696735        
 11    105.3836000             -0.2507089        
 12     50.1935900             -0.1961156        
 13     22.2495700              0.1457244        
 14     10.9826500              0.5466706        
 15      5.3836650              0.3979434        
 16      2.3436850              0.05277007       
 17      1.1052020             -0.004374537      
 18      0.4878480              0.0003204035     
 19      0.0895990             -5.142077E-05     
S   19
  1 6177194.0000000             4.862957E-07     
  2 924929.5000000              3.776645E-06     
  3 210486.5000000              1.990664E-05     
  4  59620.0500000              8.389164E-05     
  5  19450.7600000              0.0003065706     
  6   7022.0560000              0.0009944107     
  7   2738.7630000              0.002961959      
  8   1135.8140000              0.007969473      
  9    495.0923000              0.01955017       
 10    224.7487000              0.04085035       
 11    105.3836000              0.06929003       
 12     50.1935900              0.06146984       
 13     22.2495700             -0.06981302       
 14     10.9826500             -0.3517597        
 15      5.3836650             -0.3828629        
 16      2.3436850              0.2676401        
 17      1.1052020              0.7175950        
 18      0.4878480              0.3020814        
 19      0.0895990              0.007749514      
S   19
  1 6177194.0000000            -1.102451E-07     
  2 924929.5000000             -8.530233E-07     
  3 210486.5000000             -4.520358E-06     
  4  59620.0500000             -1.891612E-05     
  5  19450.7600000             -6.974344E-05     
  6   7022.0560000             -0.0002237867     
  7   2738.7630000             -0.0006754503     
  8   1135.8140000             -0.001789346      
  9    495.0923000             -0.004477858      
 10    224.7487000             -0.009140144      
 11    105.3836000             -0.01610562       
 12     50.1935900             -0.0133487        
 13     22.2495700              0.01426027       
 14     10.9826500              0.0893169        
 15      5.3836650              0.08885279       
 16      2.3436850             -0.06368776       
 17      1.1052020             -0.2783262        
 18      0.4878480             -0.1830071        
 19      0.0895990              0.6790937        
S   19
  1 6177194.0000000             2.179893E-07     
  2 924929.5000000              1.61294E-06      
  3 210486.5000000              9.111842E-06     
  4  59620.0500000              3.500645E-05     
  5  19450.7600000              0.0001435315     
  6   7022.0560000              0.0004035896     
  7   2738.7630000              0.001425177      
  8   1135.8140000              0.003114009      
  9    495.0923000              0.009814449      
 10    224.7487000              0.01474698       
 11    105.3836000              0.03911512       
 12     50.1935900              0.009170888      
 13     22.2495700              0.01559878       
 14     10.9826500             -0.2816844        
 15      5.3836650             -0.006895261      
 16      2.3436850             -0.1769781        
 17      1.1052020              1.4430610        
 18      0.4878480             -1.0293180        
 19      0.0895990             -1.3076670        
S   19
  1 6177194.0000000            -3.669010E-07     
  2 924929.5000000             -2.768353E-06     
  3 210486.5000000             -1.521014E-05     
  4  59620.0500000             -6.066288E-05     
  5  19450.7600000             -0.0002374959     
  6   7022.0560000             -0.0007077071     
  7   2738.7630000             -0.002334389      
  8   1135.8140000             -0.005555062      
  9    495.0923000             -0.01585142       
 10    224.7487000             -0.02737888       
 11    105.3836000             -0.06106975       
 12     50.1935900             -0.02887227       
 13     22.2495700              0.006813714      
 14     10.9826500              0.4327670        
 15      5.3836650              0.1968410        
 16      2.3436850             -0.3764657        
 17      1.1052020             -2.0524730        
 18      0.4878480              2.9757410        
 19      0.0895990             -2.2117050        
S   1
  1      0.0334230              1.0000000        
P   15
  1  14454.2000000              0.0000440        
  2   3421.6760000              0.0003890        
  3   1111.3870000              0.0022410        
  4    425.1918000              0.0098210        
  5    180.2623000              0.0344710        
  6     82.0611700              0.0974600        
  7     39.2972600              0.2119850        
  8     19.4195900              0.3339900        
  9      9.8288990              0.3301370        
 10      5.0168100              0.1522270        
 11      2.4870910              0.0204250        
 12      1.1987800             -0.0013600        
 13      0.5586950             -0.0011950        
 14      0.2089240             -0.0001970        
 15      0.0846080              0.0000230        
P   15
  1  14454.2000000             -0.0000150        
  2   3421.6760000             -0.0001350        
  3   1111.3870000             -0.0007770        
  4    425.1918000             -0.0034270        
  5    180.2623000             -0.0121890        
  6     82.0611700             -0.0353880        
  7     39.2972600             -0.0799150        
  8     19.4195900             -0.1323350        
  9      9.8288990             -0.1354010        
 10      5.0168100              0.0320080        
 11      2.4870910              0.3338490        
 12      1.1987800              0.4617730        
 13      0.5586950              0.2812900        
 14      0.2089240              0.0418430        
 15      0.0846080             -0.0040020        
P   15
  1  14454.2000000              0.0000040        
  2   3421.6760000              0.0000320        
  3   1111.3870000              0.0001850        
  4    425.1918000              0.0008100        
  5    180.2623000              0.0029060        
  6     82.0611700              0.0083910        
  7     39.2972600              0.0191930        
  8     19.4195900              0.0315640        
  9      9.8288990              0.0334170        
 10      5.0168100             -0.0129070        
 11      2.4870910             -0.0936590        
 12      1.1987800             -0.1499770        
 13      0.5586950             -0.0672340        
 14      0.2089240              0.2707590        
 15      0.0846080              0.5758070        
P   15
  1  14454.2000000              0.0000040        
  2   3421.6760000              0.0000400        
  3   1111.3870000              0.0002290        
  4    425.1918000              0.0010190        
  5    180.2623000              0.0036020        
  6     82.0611700              0.0105500        
  7     39.2972600              0.0237020        
  8     19.4195900              0.0399880        
  9      9.8288990              0.0404370        
 10      5.0168100             -0.0120740        
 11      2.4870910             -0.1189390        
 12      1.1987800             -0.1781000        
 13      0.5586950             -0.1238650        
 14      0.2089240              0.4297220        
 15      0.0846080              0.6507860        
P   15
  1  14454.2000000              0.0000100        
  2   3421.6760000              0.0000790        
  3   1111.3870000              0.0005120        
  4    425.1918000              0.0020230        
  5    180.2623000              0.0080550        
  6     82.0611700              0.0207720        
  7     39.2972600              0.0542240        
  8     19.4195900              0.0746850        
  9      9.8288990              0.1159890        
 10      5.0168100             -0.0765840        
 11      2.4870910             -0.2439310        
 12      1.1987800             -0.6801810        
 13      0.5586950              0.7336640        
 14      0.2089240              0.9991200        
 15      0.0846080             -1.0170810        
P   1
  1      0.0332580              1.0000000        
D   7
  1     88.5768000              0.0036210        
  2     26.2045000              0.0257660        
  3      9.5174700              0.0975560        
  4      3.8224800              0.2363120        
  5      1.5751200              0.3582860        
  6      0.6289280              0.3685430        
  7      0.2344240              0.2354940        
D   7
  1     88.5768000             -0.0041220        
  2     26.2045000             -0.0293070        
  3      9.5174700             -0.1150620        
  4      3.8224800             -0.2730680        
  5      1.5751200             -0.3144230        
  6      0.6289280              0.0420970        
  7      0.2344240              0.5914030        
D   7
  1     88.5768000              0.0059540        
  2     26.2045000              0.0425320        
  3      9.5174700              0.1745110        
  4      3.8224800              0.3939000        
  5      1.5751200              0.1492790        
  6      0.6289280             -0.8102450        
  7      0.2344240              0.0109110        
D   1
  1      0.0768150              1.0000000        
F   1
  1      2.2510000              1.0000000        
F   1
  1      0.5315000              1.0000000        
G   1
  1      1.4459000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Mn
data:
MANGANESE
S   19
  1 3960805.0000000             8.242127E-06     
  2 593115.5000000              6.408587E-05     
  3 134976.8000000              0.0003369253     
  4  38230.6700000              0.001420648      
  5  12471.5400000              0.005143683      
  6   4501.7430000              0.01648569       
  7   1755.2120000              0.0469856        
  8    727.3039000              0.1162437        
  9    316.3678000              0.2335277        
 10    143.0098000              0.3292837        
 11     66.2180500              0.2440304        
 12     29.9189600              0.07219806       
 13     14.3031800              0.07687806       
 14      6.8394510              0.07852235       
 15      3.0123740              0.01294109       
 16      1.4188080             -0.0003784873     
 17      0.6236240             -2.503203E-05     
 18      0.1340980             -2.421517E-05     
 19      0.0655480              3.462071E-05     
S   19
  1 3960805.0000000            -3.936095E-06     
  2 593115.5000000             -3.060481E-05     
  3 134976.8000000             -0.0001609626     
  4  38230.6700000             -0.0006792348     
  5  12471.5400000             -0.002466182      
  6   4501.7430000             -0.007957629      
  7   1755.2120000             -0.02307248       
  8    727.3039000             -0.05932956       
  9    316.3678000             -0.1299451        
 10    143.0098000             -0.2212352        
 11     66.2180500             -0.2292550        
 12     29.9189600              0.03580733       
 13     14.3031800              0.5107602        
 14      6.8394510              0.5008307        
 15      3.0123740              0.0901183        
 16      1.4188080             -0.006909909      
 17      0.6236240             -0.0001912925     
 18      0.1340980             -0.0006032312     
 19      0.0655480              0.0005621608     
S   19
  1 3960805.0000000             9.462709E-07     
  2 593115.5000000              7.360584E-06     
  3 134976.8000000              3.869935E-05     
  4  38230.6700000              0.000163511      
  5  12471.5400000              0.0005941775     
  6   4501.7430000              0.001927737      
  7   1755.2120000              0.005641731      
  8    727.3039000              0.01487848       
  9    316.3678000              0.03414783       
 10    143.0098000              0.06405794       
 11     66.2180500              0.07557659       
 12     29.9189600             -0.0194607        
 13     14.3031800             -0.2957874        
 14      6.8394510             -0.4521170        
 15      3.0123740              0.1224531        
 16      1.4188080              0.7169756        
 17      0.6236240              0.4092712        
 18      0.1340980              0.02221969       
 19      0.0655480             -0.009011202      
S   19
  1 3960805.0000000            -2.095391E-07     
  2 593115.5000000             -1.629439E-06     
  3 134976.8000000             -8.570592E-06     
  4  38230.6700000             -3.619272E-05     
  5  12471.5400000             -0.0001316146     
  6   4501.7430000             -0.000426681      
  7   1755.2120000             -0.00125027       
  8    727.3039000             -0.003294665      
  9    316.3678000             -0.00758186       
 10    143.0098000             -0.01422864       
 11     66.2180500             -0.01693796       
 12     29.9189600              0.004454298      
 13     14.3031800              0.06867042       
 14      6.8394510              0.1113335        
 15      3.0123740             -0.0390082        
 16      1.4188080             -0.2215755        
 17      0.6236240             -0.2544359        
 18      0.1340980              0.2865866        
 19      0.0655480              0.5755741        
S   19
  1 3960805.0000000            -4.121231E-07     
  2 593115.5000000             -3.282099E-06     
  3 134976.8000000             -1.667433E-05     
  4  38230.6700000             -7.369999E-05     
  5  12471.5400000             -0.0002529495     
  6   4501.7430000             -0.0008801425     
  7   1755.2120000             -0.002365482      
  8    727.3039000             -0.006926354      
  9    316.3678000             -0.01393851       
 10    143.0098000             -0.0314384        
 11     66.2180500             -0.02625749       
 12     29.9189600             -0.01048313       
 13     14.3031800              0.1856472        
 14      6.8394510              0.1524839        
 15      3.0123740              0.07411368       
 16      1.4188080             -1.0180970        
 17      0.6236240              0.2980372        
 18      0.1340980              1.9719890        
 19      0.0655480             -1.1792530        
S   19
  1 3960805.0000000            -6.805493E-07     
  2 593115.5000000             -5.460516E-06     
  3 134976.8000000             -2.743893E-05     
  4  38230.6700000             -0.0001230291     
  5  12471.5400000             -0.0004146269     
  6   4501.7430000             -0.001475151      
  7   1755.2120000             -0.00385914       
  8    727.3039000             -0.01168405       
  9    316.3678000             -0.02257185       
 10    143.0098000             -0.05399759       
 11     66.2180500             -0.04032351       
 12     29.9189600             -0.02742526       
 13     14.3031800              0.3485593        
 14      6.8394510              0.2757818        
 15      3.0123740             -0.05499812       
 16      1.4188080             -2.2925450        
 17      0.6236240              2.6356440        
 18      0.1340980             -0.3379113        
 19      0.0655480             -1.7896070        
S   1
  1      0.0295840              1.0000000        
P   15
  1  16205.8600000              0.0000420        
  2   3836.2740000              0.0003730        
  3   1246.0480000              0.0021490        
  4    476.7535000              0.0094450        
  5    202.1895000              0.0332970        
  6     92.0948700              0.0947590        
  7     44.1472000              0.2081440        
  8     21.8546800              0.3318050        
  9     11.0859600              0.3331750        
 10      5.6741080              0.1576010        
 11      2.8231700              0.0214450        
 12      1.3686210             -0.0025580        
 13      0.6444310             -0.0020270        
 14      0.2483820             -0.0003600        
 15      0.0972550              0.0000340        
P   15
  1  16205.8600000             -0.0000150        
  2   3836.2740000             -0.0001290        
  3   1246.0480000             -0.0007480        
  4    476.7535000             -0.0033080        
  5    202.1895000             -0.0118110        
  6     92.0948700             -0.0345330        
  7     44.1472000             -0.0787850        
  8     21.8546800             -0.1321830        
  9     11.0859600             -0.1371950        
 10      5.6741080              0.0270750        
 11      2.8231700              0.3288910        
 12      1.3686210              0.4572800        
 13      0.6444310              0.2889080        
 14      0.2483820              0.0474330        
 15      0.0972550             -0.0035220        
P   15
  1  16205.8600000              0.0000030        
  2   3836.2740000              0.0000300        
  3   1246.0480000              0.0001720        
  4    476.7535000              0.0007620        
  5    202.1895000              0.0027260        
  6     92.0948700              0.0079760        
  7     44.1472000              0.0182870        
  8     21.8546800              0.0307760        
  9     11.0859600              0.0323730        
 10      5.6741080             -0.0099780        
 11      2.8231700             -0.0905290        
 12      1.3686210             -0.1380040        
 13      0.6444310             -0.0779650        
 14      0.2483820              0.2295600        
 15      0.0972550              0.5761220        
P   15
  1  16205.8600000              0.0000040        
  2   3836.2740000              0.0000400        
  3   1246.0480000              0.0002260        
  4    476.7535000              0.0010130        
  5    202.1895000              0.0035750        
  6     92.0948700              0.0106120        
  7     44.1472000              0.0239020        
  8     21.8546800              0.0412790        
  9     11.0859600              0.0414750        
 10      5.6741080             -0.0094580        
 11      2.8231700             -0.1236950        
 12      1.3686210             -0.1743920        
 13      0.6444310             -0.1291700        
 14      0.2483820              0.4003480        
 15      0.0972550              0.6696460        
P   15
  1  16205.8600000              0.0000100        
  2   3836.2740000              0.0000810        
  3   1246.0480000              0.0005120        
  4    476.7535000              0.0020710        
  5    202.1895000              0.0081110        
  6     92.0948700              0.0215570        
  7     44.1472000              0.0553160        
  8     21.8546800              0.0802630        
  9     11.0859600              0.1177300        
 10      5.6741080             -0.0650690        
 11      2.8231700             -0.2829140        
 12      1.3686210             -0.6491660        
 13      0.6444310              0.6925670        
 14      0.2483820              0.9789900        
 15      0.0972550             -0.9213570        
P   1
  1      0.0366330              1.0000000        
D   7
  1    100.6630000              0.0035790        
  2     29.8336000              0.0258270        
  3     10.8894000              0.0985590        
  4      4.3935800              0.2383270        
  5      1.8178200              0.3587070        
  6      0.7278270              0.3650920        
  7      0.2712950              0.2337380        
D   7
  1    100.6630000             -0.0034540        
  2     29.8336000             -0.0249250        
  3     10.8894000             -0.0976350        
  4      4.3935800             -0.2366920        
  5      1.8178200             -0.2923500        
  6      0.7278270             -0.0049730        
  7      0.2712950              0.5065880        
D   7
  1    100.6630000              0.0056850        
  2     29.8336000              0.0411710        
  3     10.8894000              0.1693220        
  4      4.3935800              0.3859120        
  5      1.8178200              0.1869090        
  6      0.7278270             -0.6781130        
  7      0.2712950             -0.2582600        
D   1
  1      0.0883090              1.0000000        
F   1
  1      2.7382000              1.0000000        
F   1
  1      0.6543000              1.0000000        
G   1
  1      1.7335000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   19
  1 4316265.0000000             8.048803E-06     
  2 646342.4000000              6.258306E-05     
  3 147089.7000000              0.0003290239     
  4  41661.5200000              0.001387355      
  5  13590.7700000              0.005023256      
  6   4905.7500000              0.0161014        
  7   1912.7460000              0.04590034       
  8    792.6043000              0.1136154        
  9    344.8065000              0.2283869        
 10    155.8999000              0.3221159        
 11     72.2309100              0.2383661        
 12     32.7250600              0.07404667       
 13     15.6676200              0.09214197       
 14      7.5034830              0.0933979        
 15      3.3122230              0.01573965       
 16      1.5584710             -0.0004186682     
 17      0.6839140              5.376318E-05     
 18      0.1467570             -3.816654E-05     
 19      0.0705830              4.319603E-05     
S   19
  1 4316265.0000000            -4.155954E-06     
  2 646342.4000000             -3.231401E-05     
  3 147089.7000000             -0.0001699525     
  4  41661.5200000             -0.0007171369     
  5  13590.7700000             -0.002603625      
  6   4905.7500000             -0.008399109      
  7   1912.7460000             -0.02434109       
  8    792.6043000             -0.06251948       
  9    344.8065000             -0.1365929        
 10    155.8999000             -0.2312707        
 11     72.2309100             -0.2383734        
 12     32.7250600              0.03123837       
 13     15.6676200              0.5086818        
 14      7.5034830              0.4987695        
 15      3.3122230              0.09033552       
 16      1.5584710             -0.006005337      
 17      0.6839140              0.0002312454     
 18      0.1467570             -0.000564368      
 19      0.0705830              0.000499226      
S   19
  1 4316265.0000000             9.532178E-07     
  2 646342.4000000              7.414605E-06     
  3 147089.7000000              3.898393E-05     
  4  41661.5200000              0.0001647152     
  5  13590.7700000              0.000598598      
  6   4905.7500000              0.00194239       
  7   1912.7460000              0.005687237      
  8    792.6043000              0.01501329       
  9    344.8065000              0.03452455       
 10    155.8999000              0.0649582        
 11     72.2309100              0.07716194       
 12     32.7250600             -0.01873411       
 13     15.6676200             -0.3009185        
 14      7.5034830             -0.4554661        
 15      3.3122230              0.1286463        
 16      1.5584710              0.7183316        
 17      0.6839140              0.4051743        
 18      0.1467570              0.02168227       
 19      0.0705830             -0.008343566      
S   19
  1 4316265.0000000            -2.063008E-07     
  2 646342.4000000             -1.604169E-06     
  3 147089.7000000             -8.438437E-06     
  4  41661.5200000             -3.563151E-05     
  5  13590.7700000             -0.0001295998     
  6   4905.7500000             -0.0004201534     
  7   1912.7460000             -0.001231954      
  8    792.6043000             -0.003248922      
  9    344.8065000             -0.007493717      
 10    155.8999000             -0.01410102       
 11     72.2309100             -0.0169160        
 12     32.7250600              0.004218996      
 13     15.6676200              0.0683381        
 14      7.5034830              0.1098201        
 15      3.3122230             -0.04009005       
 16      1.5584710             -0.2174739        
 17      0.6839140             -0.2465135        
 18      0.1467570              0.2731435        
 19      0.0705830              0.5748321        
S   19
  1 4316265.0000000            -4.009367E-07     
  2 646342.4000000             -3.189255E-06     
  3 147089.7000000             -1.623079E-05     
  4  41661.5200000             -7.15792E-05      
  5  13590.7700000             -0.0002463958     
  6   4905.7500000             -0.0008544907     
  7   1912.7460000             -0.002307593      
  8    792.6043000             -0.006728292      
  9    344.8065000             -0.01366165       
 10    155.8999000             -0.0306224        
 11     72.2309100             -0.02631137       
 12     32.7250600             -0.009760183      
 13     15.6676200              0.1801906        
 14      7.5034830              0.1529634        
 15      3.3122230              0.05505413       
 16      1.5584710             -0.9551364        
 17      0.6839140              0.2586813        
 18      0.1467570              1.8340490        
 19      0.0705830             -0.9333240        
S   19
  1 4316265.0000000            -6.966042E-07     
  2 646342.4000000             -5.568036E-06     
  3 147089.7000000             -2.813684E-05     
  4  41661.5200000             -0.0001252418     
  5  13590.7700000             -0.0004260787     
  6   4905.7500000             -0.00149906       
  7   1912.7460000             -0.003979103      
  8    792.6043000             -0.01185686       
  9    344.8065000             -0.02346734       
 10    155.8999000             -0.05467736       
 11     72.2309100             -0.0439382        
 12     32.7250600             -0.02376103       
 13     15.6676200              0.3435928        
 14      7.5034830              0.3192960        
 15      3.3122230             -0.1343207        
 16      1.5584710             -2.2210200        
 17      0.6839140              2.5711420        
 18      0.1467570             -0.2292404        
 19      0.0705830             -1.8324520        
S   1
  1      0.0314490              1.0000000        
P   15
  1  17745.6900000              0.0000410        
  2   4200.7210000              0.0003690        
  3   1364.4290000              0.0021290        
  4    522.0806000              0.0093690        
  5    221.4595000              0.0330970        
  6    100.9096000              0.0944310        
  7     48.4011500              0.2080770        
  8     23.9853600              0.3323330        
  9     12.1825000              0.3329870        
 10      6.2422980              0.1568430        
 11      3.1109440              0.0215490        
 12      1.5099580             -0.0020950        
 13      0.7108450             -0.0017390        
 14      0.2731900             -0.0003000        
 15      0.1042330              0.0000290        
P   15
  1  17745.6900000             -0.0000150        
  2   4200.7210000             -0.0001300        
  3   1364.4290000             -0.0007510        
  4    522.0806000             -0.0033290        
  5    221.4595000             -0.0119120        
  6    100.9096000             -0.0349330        
  7     48.4011500             -0.0799890        
  8     23.9853600             -0.1346360        
  9     12.1825000             -0.1385980        
 10      6.2422980              0.0302780        
 11      3.1109440              0.3332160        
 12      1.5099580              0.4561530        
 13      0.7108450              0.2850510        
 14      0.2731900              0.0461440        
 15      0.1042330             -0.0032490        
P   15
  1  17745.6900000              0.0000030        
  2   4200.7210000              0.0000290        
  3   1364.4290000              0.0001650        
  4    522.0806000              0.0007340        
  5    221.4595000              0.0026260        
  6    100.9096000              0.0077250        
  7     48.4011500              0.0177330        
  8     23.9853600              0.0300550        
  9     12.1825000              0.0310940        
 10      6.2422980             -0.0100480        
 11      3.1109440             -0.0883060        
 12      1.5099580             -0.1298240        
 13      0.7108450             -0.0769370        
 14      0.2731900              0.2126610        
 15      0.1042330              0.5730610        
P   15
  1  17745.6900000              0.0000050        
  2   4200.7210000              0.0000420        
  3   1364.4290000              0.0002410        
  4    522.0806000              0.0010850        
  5    221.4595000              0.0038310        
  6    100.9096000              0.0114230        
  7     48.4011500              0.0257920        
  8     23.9853600              0.0448180        
  9     12.1825000              0.0445980        
 10      6.2422980             -0.0111770        
 11      3.1109440             -0.1381340        
 12      1.5099580             -0.1882850        
 13      0.7108450             -0.1073990        
 14      0.2731900              0.4448630        
 15      0.1042330              0.6402390        
P   15
  1  17745.6900000              0.0000110        
  2   4200.7210000              0.0000870        
  3   1364.4290000              0.0005410        
  4    522.0806000              0.0022260        
  5    221.4595000              0.0085930        
  6    100.9096000              0.0233390        
  7     48.4011500              0.0588440        
  8     23.9853600              0.0882890        
  9     12.1825000              0.1231920        
 10      6.2422980             -0.0631860        
 11      3.1109440             -0.3549020        
 12      1.5099580             -0.6197080        
 13      0.7108450              0.8129860        
 14      0.2731900              0.8191180        
 15      0.1042330             -0.9017050        
P   1
  1      0.0382910              1.0000000        
D   7
  1    113.3440000              0.0035300        
  2     33.6414000              0.0257840        
  3     12.3310000              0.0991190        
  4      4.9947800              0.2390730        
  5      2.0728000              0.3571990        
  6      0.8307530              0.3621880        
  7      0.3091780              0.2364610        
D   7
  1    113.3440000             -0.0038900        
  2     33.6414000             -0.0284420        
  3     12.3310000             -0.1124290        
  4      4.9947800             -0.2742570        
  5      2.0728000             -0.3155460        
  6      0.8307530              0.0571090        
  7      0.3091780              0.5636040        
D   7
  1    113.3440000              0.0056950        
  2     33.6414000              0.0420010        
  3     12.3310000              0.1735400        
  4      4.9947800              0.4101570        
  5      2.0728000              0.1132520        
  6      0.8307530             -0.7696800        
  7      0.3091780             -0.0316430        
D   1
  1      0.1001300              1.0000000        
F   1
  1      3.2758000              1.0000000        
F   1
  1      0.7920000              1.0000000        
G   1
  1      2.0897000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Co
data:
COBALT
S   19
  1 4675675.0000000             7.979026E-06     
  2 700161.5000000              6.204071E-05     
  3 159337.3000000              0.0003261735     
  4  45130.4600000              0.00137536       
  5  14722.3800000              0.004979997      
  6   5314.2220000              0.01596434       
  7   2072.0180000              0.04552086       
  8    858.6188000              0.1127385        
  9    373.5497000              0.2268262        
 10    168.9229000              0.3203074        
 11     78.2963900              0.2374021        
 12     35.5212300              0.07477686       
 13     17.0414400              0.09581872       
 14      8.1730000              0.09649911       
 15      3.6103180              0.01623362       
 16      1.6970470             -0.0004535497     
 17      0.7435320              5.113519E-05     
 18      0.1583440             -4.174508E-05     
 19      0.0750360              4.027577E-05     
S   19
  1 4675675.0000000            -4.20024E-06      
  2 700161.5000000             -3.265831E-05     
  3 159337.3000000             -0.0001717644     
  4  45130.4600000             -0.0007247853     
  5  14722.3800000             -0.002631462      
  6   5314.2220000             -0.008489272      
  7   2072.0180000             -0.02460619       
  8    858.6188000             -0.06322059       
  9    373.5497000             -0.1381957        
 10    168.9229000             -0.2340680        
 11     78.2963900             -0.2415002        
 12     35.5212300              0.03035312       
 13     17.0414400              0.5101341        
 14      8.1730000              0.4974939        
 15      3.6103180              0.08970746       
 16      1.6970470             -0.005941034      
 17      0.7435320              0.0002175362     
 18      0.1583440             -0.0005480155     
 19      0.0750360              0.0004525804     
S   19
  1 4675675.0000000             9.592692E-07     
  2 700161.5000000              7.461851E-06     
  3 159337.3000000              3.923137E-05     
  4  45130.4600000              0.0001657706     
  5  14722.3800000              0.0006024335     
  6   5314.2220000              0.001955217      
  7   2072.0180000              0.005726326      
  8    858.6188000              0.01512984       
  9    373.5497000              0.03483973       
 10    168.9229000              0.06570351       
 11     78.2963900              0.07831503       
 12     35.5212300             -0.01877037       
 13     17.0414400             -0.3062663        
 14      8.1730000             -0.4566429        
 15      3.6103180              0.1378169        
 16      1.6970470              0.7193676        
 17      0.7435320              0.3992579        
 18      0.1583440              0.02079933       
 19      0.0750360             -0.007820663      
S   19
  1 4675675.0000000            -2.02884E-07      
  2 700161.5000000             -1.57758E-06      
  3 159337.3000000             -8.298813E-06     
  4  45130.4600000             -3.504154E-05     
  5  14722.3800000             -0.0001274655     
  6   5314.2220000             -0.0004132695     
  7   2072.0180000             -0.001212261      
  8    858.6188000             -0.003199318      
  9    373.5497000             -0.007390972      
 10    168.9229000             -0.01393649       
 11     78.2963900             -0.01678575       
 12     35.5212300              0.004149856      
 13     17.0414400              0.06797646       
 14      8.1730000              0.1075807        
 15      3.6103180             -0.04166022       
 16      1.6970470             -0.2128044        
 17      0.7435320             -0.2381360        
 18      0.1583440              0.2650788        
 19      0.0750360              0.5722774        
S   19
  1 4675675.0000000            -3.863053E-07     
  2 700161.5000000             -3.068788E-06     
  3 159337.3000000             -1.564826E-05     
  4  45130.4600000             -6.883588E-05     
  5  14722.3800000             -0.0002377367     
  6   5314.2220000             -0.0008213173     
  7   2072.0180000             -0.00222963       
  8    858.6188000             -0.006467841      
  9    373.5497000             -0.01325463       
 10    168.9229000             -0.02946686       
 11     78.2963900             -0.02599066       
 12     35.5212300             -0.008499807      
 13     17.0414400              0.1727316        
 14      8.1730000              0.1512189        
 15      3.6103180              0.03554509       
 16      1.6970470             -0.8829353        
 17      0.7435320              0.2143530        
 18      0.1583440              1.7118650        
 19      0.0750360             -0.7140037        
S   19
  1 4675675.0000000            -7.174687E-07     
  2 700161.5000000             -5.722157E-06     
  3 159337.3000000             -2.90097E-05      
  4  45130.4600000             -0.0001285845     
  5  14722.3800000             -0.0004398434     
  6   5314.2220000             -0.001537586      
  7   2072.0180000             -0.004116022      
  8    858.6188000             -0.01215514       
  9    373.5497000             -0.02440441       
 10    168.9229000             -0.05601976       
 11     78.2963900             -0.04689449       
 12     35.5212300             -0.02168828       
 13     17.0414400              0.3477789        
 14      8.1730000              0.3500597        
 15      3.6103180             -0.2048551        
 16      1.6970470             -2.1632110        
 17      0.7435320              2.5240910        
 18      0.1583440             -0.1590011        
 19      0.0750360             -1.8252670        
S   1
  1      0.0330910              1.0000000        
P   15
  1  19267.7800000              0.0000410        
  2   4560.9860000              0.0003690        
  3   1481.4360000              0.0021280        
  4    566.8671000              0.0093720        
  5    240.4910000              0.0331550        
  6    109.6105000              0.0947520        
  7     52.5949100              0.2090930        
  8     26.0836100              0.3337220        
  9     13.2614300              0.3322080        
 10      6.7997780              0.1546130        
 11      3.3934140              0.0209020        
 12      1.6487660             -0.0020240        
 13      0.7762820             -0.0016970        
 14      0.2980030             -0.0002800        
 15      0.1136180              0.0000260        
P   15
  1  19267.7800000             -0.0000150        
  2   4560.9860000             -0.0001310        
  3   1481.4360000             -0.0007580        
  4    566.8671000             -0.0033630        
  5    240.4910000             -0.0120540        
  6    109.6105000             -0.0354240        
  7     52.5949100             -0.0812870        
  8     26.0836100             -0.1369080        
  9     13.2614300             -0.1390190        
 10      6.7997780              0.0354680        
 11      3.3934140              0.3384980        
 12      1.6487660              0.4544330        
 13      0.7762820              0.2797930        
 14      0.2980030              0.0447760        
 15      0.1136180             -0.0031510        
P   15
  1  19267.7800000             -0.0000030        
  2   4560.9860000             -0.0000290        
  3   1481.4360000             -0.0001670        
  4    566.8671000             -0.0007420        
  5    240.4910000             -0.0026620        
  6    109.6105000             -0.0078410        
  7     52.5949100             -0.0180510        
  8     26.0836100             -0.0305800        
  9     13.2614300             -0.0313120        
 10      6.7997780              0.0113110        
 11      3.3934140              0.0899900        
 12      1.6487660              0.1307330        
 13      0.7762820              0.0718080        
 14      0.2980030             -0.2216580        
 15      0.1136180             -0.5710250        
P   15
  1  19267.7800000              0.0000050        
  2   4560.9860000              0.0000450        
  3   1481.4360000              0.0002550        
  4    566.8671000              0.0011440        
  5    240.4910000              0.0040610        
  6    109.6105000              0.0120950        
  7     52.5949100              0.0274760        
  8     26.0836100              0.0475570        
  9     13.2614300              0.0473020        
 10      6.7997780             -0.0144180        
 11      3.3934140             -0.1500620        
 12      1.6487660             -0.1990920        
 13      0.7762820             -0.0797830        
 14      0.2980030              0.4590350        
 15      0.1136180              0.6174950        
P   15
  1  19267.7800000              0.0000110        
  2   4560.9860000              0.0000920        
  3   1481.4360000              0.0005630        
  4    566.8671000              0.0023540        
  5    240.4910000              0.0089760        
  6    109.6105000              0.0248100        
  7     52.5949100              0.0615800        
  8     26.0836100              0.0947770        
  9     13.2614300              0.1266930        
 10      6.7997780             -0.0637540        
 11      3.3934140             -0.4185660        
 12      1.6487660             -0.5678650        
 13      0.7762820              0.8754060        
 14      0.2980030              0.7182630        
 15      0.1136180             -0.8747220        
P   1
  1      0.0416240              1.0000000        
D   7
  1    126.2640000              0.0035100        
  2     37.5226000              0.0258840        
  3     13.8021000              0.1000580        
  4      5.6092700              0.2405470        
  5      2.3336900              0.3568430        
  6      0.9364150              0.3595790        
  7      0.3482370              0.2366290        
D   7
  1    126.2640000             -0.0040670        
  2     37.5226000             -0.0300530        
  3     13.8021000             -0.1196200        
  4      5.6092700             -0.2915130        
  5      2.3336900             -0.3180480        
  6      0.9364150              0.0916980        
  7      0.3482370              0.5608230        
D   7
  1    126.2640000              0.0054700        
  2     37.5226000              0.0408130        
  3     13.8021000              0.1689780        
  4      5.6092700              0.4093590        
  5      2.3336900              0.0863160        
  6      0.9364150             -0.7690080        
  7      0.3482370              0.0033550        
D   1
  1      0.1123530              1.0000000        
F   1
  1      3.8137000              1.0000000        
F   1
  1      0.9309000              1.0000000        
G   1
  1      2.4709000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ni
data:
NICKEL
S   19
  1 5045991.0000000             8.208996E-06     
  2 755614.2000000              6.382884E-05     
  3 171956.8000000              0.00033558       
  4  48704.7900000              0.001415075      
  5  15888.4100000              0.005124444      
  6   5735.1230000              0.01643256       
  7   2236.1370000              0.04689398       
  8    926.6468000              0.1163534        
  9    403.1743000              0.2350511        
 10    182.3476000              0.3350184        
 11     84.5488500              0.2534779        
 12     38.3963400              0.07300901       
 13     18.4585900              0.06184244       
 14      8.8635480              0.06302956       
 15      3.9162270              0.01008063       
 16      1.8388700             -0.0002244528     
 17      0.8043620             -5.932767E-05     
 18      0.1697970             -1.158562E-05     
 19      0.0793060              8.115109E-06     
S   19
  1 5045991.0000000            -3.657849E-06     
  2 755614.2000000             -2.844094E-05     
  3 171956.8000000             -0.0001495928     
  4  48704.7900000             -0.0006313009     
  5  15888.4100000             -0.002293052      
  6   5735.1230000             -0.007405123      
  7   2236.1370000             -0.02152032       
  8    926.6468000             -0.05560974       
  9    403.1743000             -0.1230176        
 10    182.3476000             -0.2130104        
 11     84.5488500             -0.2265837        
 12     38.3963400              0.03546796       
 13     18.4585900              0.5181697        
 14      8.8635480              0.5025630        
 15      3.9162270              0.08955674       
 16      1.8388700             -0.007031311      
 17      0.8043620             -0.0004339167     
 18      0.1697970             -0.0005831711     
 19      0.0793060              0.0004228788     
S   19
  1 5045991.0000000             9.594149E-07     
  2 755614.2000000              7.462614E-06     
  3 171956.8000000              3.923843E-05     
  4  48704.7900000              0.0001657868     
  5  15888.4100000              0.0006025905     
  6   5735.1230000              0.001955662      
  7   2236.1370000              0.005730391      
  8    926.6468000              0.01514756       
  9    403.1743000              0.03493499       
 10    182.3476000              0.06598072       
 11     84.5488500              0.07893083       
 12     38.3963400             -0.01906249       
 13     18.4585900             -0.3095921        
 14      8.8635480             -0.4558610        
 15      3.9162270              0.1482931        
 16      1.8388700              0.7134039        
 17      0.8043620              0.3976063        
 18      0.1697970              0.02295523       
 19      0.0793060             -0.009151758      
S   19
  1 5045991.0000000            -2.013753E-07     
  2 755614.2000000             -1.565832E-06     
  3 171956.8000000             -8.237182E-06     
  4  48704.7900000             -3.478105E-05     
  5  15888.4100000             -0.0001265265     
  6   5735.1230000             -0.0004102589     
  7   2236.1370000             -0.001203834      
  8    926.6468000             -0.003179062      
  9    403.1743000             -0.007353828      
 10    182.3476000             -0.01389022       
 11     84.5488500             -0.01677875       
 12     38.3963400              0.004163378      
 13     18.4585900              0.06814703       
 14      8.8635480              0.1061029        
 15      3.9162270             -0.0433998        
 16      1.8388700             -0.2094950        
 17      0.8043620             -0.2310271        
 18      0.1697970              0.2590532        
 19      0.0793060              0.5691426        
S   19
  1 5045991.0000000            -3.924245E-07     
  2 755614.2000000             -3.113909E-06     
  3 171956.8000000             -1.590447E-05     
  4  48704.7900000             -6.981394E-05     
  5  15888.4100000             -0.0002417848     
  6   5735.1230000             -0.0008326195     
  7   2236.1370000             -0.002270294      
  8    926.6468000             -0.006557427      
  9    403.1743000             -0.01354288       
 10    182.3476000             -0.02989768       
 11     84.5488500             -0.02693106       
 12     38.3963400             -0.007827693      
 13     18.4585900              0.1741667        
 14      8.8635480              0.1595468        
 15      3.9162270              0.0199555        
 16      1.8388700             -0.8897000        
 17      0.8043620              0.2486892        
 18      0.1697970              1.6130120        
 19      0.0793060             -0.5990277        
S   19
  1 5045991.0000000            -7.303633E-07     
  2 755614.2000000             -5.802013E-06     
  3 171956.8000000             -2.958547E-05     
  4  48704.7900000             -0.0001301499     
  5  15888.4100000             -0.0004495332     
  6   5735.1230000             -0.001553314      
  7   2236.1370000             -0.004219884      
  8    926.6468000             -0.01225419       
  9    403.1743000             -0.02519707       
 10    182.3476000             -0.05621717       
 11     84.5488500             -0.05022229       
 12     38.3963400             -0.01677412       
 13     18.4585900              0.3388021        
 14      8.8635480              0.3984975        
 15      3.9162270             -0.3032053        
 16      1.8388700             -2.0796190        
 17      0.8043620              2.5005420        
 18      0.1697970             -0.2169002        
 19      0.0793060             -1.7091780        
S   1
  1      0.0346770              1.0000000        
P   15
  1  21027.9200000              0.0000410        
  2   4977.5600000              0.0003630        
  3   1616.7400000              0.0020970        
  4    618.6718000              0.0092500        
  5    262.5183000              0.0327960        
  6    119.6907000              0.0940040        
  7     57.4658500              0.2082800        
  8     28.5282900              0.3336540        
  9     14.5214800              0.3329040        
 10      7.4538500              0.1553720        
 11      3.7235530              0.0208590        
 12      1.8098130             -0.0024400        
 13      0.8513360             -0.0019980        
 14      0.3248140             -0.0003380        
 15      0.1195220              0.0000350        
P   15
  1  21027.9200000             -0.0000150        
  2   4977.5600000             -0.0001290        
  3   1616.7400000             -0.0007490        
  4    618.6718000             -0.0033280        
  5    262.5183000             -0.0119470        
  6    119.6907000             -0.0352420        
  7     57.4658500             -0.0812040        
  8     28.5282900             -0.1374930        
  9     14.5214800             -0.1392260        
 10      7.4538500              0.0360160        
 11      3.7235530              0.3391280        
 12      1.8098130              0.4504720        
 13      0.8513360              0.2817830        
 14      0.3248140              0.0478980        
 15      0.1195220             -0.0029870        
P   15
  1  21027.9200000              0.0000030        
  2   4977.5600000              0.0000260        
  3   1616.7400000              0.0001520        
  4    618.6718000              0.0006780        
  5    262.5183000              0.0024270        
  6    119.6907000              0.0072010        
  7     57.4658500              0.0165780        
  8     28.5282900              0.0283920        
  9     14.5214800              0.0285990        
 10      7.4538500             -0.0101320        
 11      3.7235530             -0.0829120        
 12      1.8098130             -0.1159980        
 13      0.8513360             -0.0727950        
 14      0.3248140              0.1956400        
 15      0.1195220              0.5670990        
P   15
  1  21027.9200000              0.0000060        
  2   4977.5600000              0.0000530        
  3   1616.7400000              0.0003050        
  4    618.6718000              0.0013640        
  5    262.5183000              0.0048760        
  6    119.6907000              0.0145030        
  7     57.4658500              0.0332960        
  8     28.5282900              0.0574820        
  9     14.5214800              0.0587020        
 10      7.4538500             -0.0199040        
 11      3.7235530             -0.1946950        
 12      1.8098130             -0.2396130        
 13      0.8513360             -0.0022320        
 14      0.3248140              0.5214350        
 15      0.1195220              0.5455400        
P   15
  1  21027.9200000              0.0000110        
  2   4977.5600000              0.0000950        
  3   1616.7400000              0.0005800        
  4    618.6718000              0.0024510        
  5    262.5183000              0.0092820        
  6    119.6907000              0.0260090        
  7     57.4658500              0.0640960        
  8     28.5282900              0.1007100        
  9     14.5214800              0.1325390        
 10      7.4538500             -0.0650890        
 11      3.7235530             -0.4897560        
 12      1.8098130             -0.4984550        
 13      0.8513360              0.9663570        
 14      0.3248140              0.5283790        
 15      0.1195220             -0.8676760        
P   1
  1      0.0423660              1.0000000        
D   7
  1    140.2527000              0.0033760        
  2     41.7261000              0.0251410        
  3     15.3981000              0.0977460        
  4      6.2771000              0.2347090        
  5      2.6185000              0.3469450        
  6      1.0526000              0.3510680        
  7      0.3916000              0.2502550        
D   7
  1    140.2527000             -0.0034950        
  2     41.7261000             -0.0260150        
  3     15.3981000             -0.1038760        
  4      6.2771000             -0.2520700        
  5      2.6185000             -0.2945800        
  6      1.0526000              0.0011520        
  7      0.3916000              0.4385890        
D   7
  1    140.2527000              0.0050520        
  2     41.7261000              0.0380870        
  3     15.3981000              0.1561130        
  4      6.2771000              0.3861560        
  5      2.6185000              0.1756050        
  6      1.0526000             -0.6268070        
  7      0.3916000             -0.3427750        
D   1
  1      0.1262000              1.0000000        
F   1
  1      4.5046000              1.0000000        
F   1
  1      1.1286000              1.0000000        
G   1
  1      2.9771000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cu
data:
COPPER
S   19
  1 5430321.0000000             7.801026E-06     
  2 813166.5000000              6.065666E-05     
  3 185054.4000000              0.0003188964     
  4  52414.6600000              0.001344687      
  5  17098.6800000              0.00486905       
  6   6171.9940000              0.01561013       
  7   2406.4810000              0.04452077       
  8    997.2584000              0.1103111        
  9    433.9289000              0.2220342        
 10    196.2869000              0.3133739        
 11     91.0428000              0.2315121        
 12     41.3842500              0.0764092        
 13     19.9327800              0.1103818        
 14      9.5818910              0.1094372        
 15      4.2345160              0.01836311       
 16      1.9858140             -0.0006043084     
 17      0.8670830              5.092245E-05     
 18      0.1813390             -5.54073E-05      
 19      0.0836570              3.969482E-05     
S   19
  1 5430321.0000000            -4.404706E-06     
  2 813166.5000000             -3.424801E-05     
  3 185054.4000000             -0.0001801238     
  4  52414.6600000             -0.0007600455     
  5  17098.6800000             -0.002759348      
  6   6171.9940000             -0.00890097       
  7   2406.4810000             -0.02579378       
  8    997.2584000             -0.06623861       
  9    433.9289000             -0.1445927        
 10    196.2869000             -0.2440110        
 11     91.0428000             -0.2504837        
 12     41.3842500              0.02852577       
 13     19.9327800              0.5115874        
 14      9.5818910              0.4928061        
 15      4.2345160              0.08788437       
 16      1.9858140             -0.005820281      
 17      0.8670830              0.0002013508     
 18      0.1813390             -0.0005182553     
 19      0.0836570              0.0003731503     
S   19
  1 5430321.0000000             9.704682E-07     
  2 813166.5000000              7.549245E-06     
  3 185054.4000000              3.968892E-05     
  4  52414.6600000              0.00016772       
  5  17098.6800000              0.0006095101     
  6   6171.9940000              0.001978846      
  7   2406.4810000              0.005798049      
  8    997.2584000              0.01534158       
  9    433.9289000              0.03540484       
 10    196.2869000              0.06702098       
 11     91.0428000              0.08026945       
 12     41.3842500             -0.01927231       
 13     19.9327800             -0.3160129        
 14      9.5818910             -0.4573162        
 15      4.2345160              0.1550841        
 16      1.9858140              0.7202872        
 17      0.8670830              0.3885122        
 18      0.1813390              0.01924326       
 19      0.0836570             -0.007103807      
S   19
  1 5430321.0000000            -1.959354E-07     
  2 813166.5000000             -1.523472E-06     
  3 185054.4000000             -8.014808E-06     
  4  52414.6600000             -3.383992E-05     
  5  17098.6800000             -0.0001231191     
  6   6171.9940000             -0.0003992085     
  7   2406.4810000             -0.0011719        
  8    997.2584000             -0.003096141      
  9    433.9289000             -0.007171993      
 10    196.2869000             -0.01356621       
 11     91.0428000             -0.01643989       
 12     41.3842500              0.004107628      
 13     19.9327800              0.06693964       
 14      9.5818910              0.1028221        
 15      4.2345160             -0.04422945       
 16      1.9858140             -0.2031191        
 17      0.8670830             -0.2230022        
 18      0.1813390              0.2517975        
 19      0.0836570              0.5650091        
S   19
  1 5430321.0000000            -3.532229E-07     
  2 813166.5000000             -2.798812E-06     
  3 185054.4000000             -1.432517E-05     
  4  52414.6600000             -6.270946E-05     
  5  17098.6800000             -0.000217949      
  6   6171.9940000             -0.0007474316     
  7   2406.4810000             -0.002049271      
  8    997.2584000             -0.005885203      
  9    433.9289000             -0.01226885       
 10    196.2869000             -0.02683147       
 11     91.0428000             -0.02479261       
 12     41.3842500             -0.005984746      
 13     19.9327800              0.1557124        
 14      9.5818910              0.1436683        
 15      4.2345160              0.008374103      
 16      1.9858140             -0.7460711        
 17      0.8670830              0.1244367        
 18      0.1813390              1.5101100        
 19      0.0836570             -0.3477122        
S   19
  1 5430321.0000000            -7.508267E-07     
  2 813166.5000000             -5.972018E-06     
  3 185054.4000000             -3.039682E-05     
  4  52414.6600000             -0.0001340405     
  5  17098.6800000             -0.0004615778     
  6   6171.9940000             -0.001601064      
  7   2406.4810000             -0.004330942      
  8    997.2584000             -0.01265434       
  9    433.9289000             -0.02586864       
 10    196.2869000             -0.05835428       
 11     91.0428000             -0.05132322       
 12     41.3842500             -0.01908953       
 13     19.9327800              0.3586116        
 14      9.5818910              0.3885818        
 15      4.2345160             -0.3057106        
 16      1.9858140             -2.0698960        
 17      0.8670830              2.4317740        
 18      0.1813390             -0.02121974       
 19      0.0836570             -1.8202510        
S   1
  1      0.0362670              1.0000000        
P   15
  1  22760.5700000              0.0000400        
  2   5387.6790000              0.0003610        
  3   1749.9450000              0.0020830        
  4    669.6653000              0.0091970        
  5    284.1948000              0.0326600        
  6    129.6077000              0.0937950        
  7     62.2541500              0.2082740        
  8     30.9296400              0.3339930        
  9     15.7582700              0.3324930        
 10      8.0942110              0.1547280        
 11      4.0469210              0.0212710        
 12      1.9678690             -0.0016900        
 13      0.9252950             -0.0015160        
 14      0.3529920             -0.0002420        
 15      0.1273070              0.0000230        
P   15
  1  22760.5700000             -0.0000150        
  2   5387.6790000             -0.0001310        
  3   1749.9450000             -0.0007550        
  4    669.6653000             -0.0033590        
  5    284.1948000             -0.0120810        
  6    129.6077000             -0.0357030        
  7     62.2541500             -0.0825020        
  8     30.9296400             -0.1398900        
  9     15.7582700             -0.1407290        
 10      8.0942110              0.0387660        
 11      4.0469210              0.3426950        
 12      1.9678690              0.4523100        
 13      0.9252950              0.2770540        
 14      0.3529920              0.0438850        
 15      0.1273070             -0.0028020        
P   15
  1  22760.5700000              0.0000030        
  2   5387.6790000              0.0000250        
  3   1749.9450000              0.0001470        
  4    669.6653000              0.0006560        
  5    284.1948000              0.0023510        
  6    129.6077000              0.0070040        
  7     62.2541500              0.0161310        
  8     30.9296400              0.0277700        
  9     15.7582700              0.0275670        
 10      8.0942110             -0.0101150        
 11      4.0469210             -0.0810090        
 12      1.9678690             -0.1104090        
 13      0.9252950             -0.0717320        
 14      0.3529920              0.1879300        
 15      0.1273070              0.5646290        
P   15
  1  22760.5700000              0.0000050        
  2   5387.6790000              0.0000490        
  3   1749.9450000              0.0002780        
  4    669.6653000              0.0012530        
  5    284.1948000              0.0044470        
  6    129.6077000              0.0133700        
  7     62.2541500              0.0304690        
  8     30.9296400              0.0534470        
  9     15.7582700              0.0526390        
 10      8.0942110             -0.0168810        
 11      4.0469210             -0.1794480        
 12      1.9678690             -0.2095880        
 13      0.9252950             -0.0396330        
 14      0.3529920              0.5021300        
 15      0.1273070              0.5811110        
P   15
  1  22760.5700000              0.0000110        
  2   5387.6790000              0.0000960        
  3   1749.9450000              0.0005900        
  4    669.6653000              0.0024840        
  5    284.1948000              0.0094630        
  6    129.6077000              0.0264530        
  7     62.2541500              0.0656890        
  8     30.9296400              0.1027320        
  9     15.7582700              0.1370410        
 10      8.0942110             -0.0709610        
 11      4.0469210             -0.5047080        
 12      1.9678690             -0.4780560        
 13      0.9252950              0.9428920        
 14      0.3529920              0.5446990        
 15      0.1273070             -0.8327660        
P   1
  1      0.0443560              1.0000000        
D   7
  1    173.8970000              0.0027000        
  2     51.8869000              0.0209090        
  3     19.3419000              0.0844080        
  4      7.9757200              0.2139990        
  5      3.3982300              0.3359800        
  6      1.4093200              0.3573010        
  7      0.5488580              0.2645780        
D   7
  1    173.8970000             -0.0033630        
  2     51.8869000             -0.0260790        
  3     19.3419000             -0.1082310        
  4      7.9757200             -0.2822170        
  5      3.3982300             -0.3471900        
  6      1.4093200              0.0267110        
  7      0.5488580              0.4920470        
D   7
  1    173.8970000              0.0041330        
  2     51.8869000              0.0330850        
  3     19.3419000              0.1383360        
  4      7.9757200              0.3901660        
  5      3.3982300              0.1698420        
  6      1.4093200             -0.6830180        
  7      0.5488580             -0.2657970        
D   1
  1      0.1901990              1.0000000        
F   1
  1      5.0821000              1.0000000        
F   1
  1      1.2797000              1.0000000        
G   1
  1      3.4835000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Zn
data:
ZINC
S   19
  1 5820021.0000000             8.549241E-06     
  2 871523.4000000              6.64741E-05      
  3 198335.0000000              0.0003494962     
  4  56176.3100000              0.001473832      
  5  18325.8200000              0.00533833       
  6   6614.9550000              0.01712708       
  7   2579.1990000              0.04894085       
  8   1068.8490000              0.1217934        
  9    465.1045000              0.2476589        
 10    210.4130000              0.3582431        
 11     97.6162900              0.2798174        
 12     44.3802000              0.06857491       
 13     21.4230800             -0.001311092      
 14     10.3089100              0.001914001      
 15      4.5536450             -0.000875922      
 16      2.1328210              0.0003740096     
 17      0.9296970             -0.0001401399     
 18      0.1921470              4.757132E-05     
 19      0.0875950             -3.642711E-05     
S   19
  1 5820021.0000000            -2.640069E-06     
  2 871523.4000000             -2.05272E-05      
  3 198335.0000000             -0.0001079859     
  4  56176.3100000             -0.0004558577     
  5  18325.8200000             -0.001657758      
  6   6614.9550000             -0.005368492      
  7   2579.1990000             -0.01571249       
  8   1068.8490000             -0.04122558       
  9    465.1045000             -0.09406459       
 10    210.4130000             -0.1719954        
 11     97.6162900             -0.1958523        
 12     44.3802000              0.04532907       
 13     21.4230800              0.5244442        
 14     10.3089100              0.5006142        
 15      4.5536450              0.08945527       
 16      2.1328210             -0.002146262      
 17      0.9296970              0.002112113      
 18      0.1921470             -0.000413398      
 19      0.0875950              0.0003209752     
S   19
  1 5820021.0000000             9.967103E-07     
  2 871523.4000000              7.754163E-06     
  3 198335.0000000              4.076019E-05     
  4  56176.3100000              0.0001722811     
  5  18325.8200000              0.000625937      
  6   6614.9550000              0.002032855      
  7   2579.1990000              0.005954646      
  8   1068.8490000              0.0157664        
  9    465.1045000              0.03637638       
 10    210.4130000              0.06892343       
 11     97.6162900              0.08238093       
 12     44.3802000             -0.0201136        
 13     21.4230800             -0.3252526        
 14     10.3089100             -0.4602899        
 15      4.5536450              0.1635546        
 16      2.1328210              0.7297118        
 17      0.9296970              0.3769751        
 18      0.1921470              0.01433224       
 19      0.0875950             -0.00667121       
S   19
  1 5820021.0000000             1.995818E-07     
  2 871523.4000000              1.552973E-06     
  3 198335.0000000              8.161259E-06     
  4  56176.3100000              3.450747E-05     
  5  18325.8200000              0.0001253275     
  6   6614.9550000              0.000407299      
  7   2579.1990000              0.001192734      
  8   1068.8490000              0.00316314       
  9    465.1045000              0.007303942      
 10    210.4130000              0.01391279       
 11     97.6162900              0.0167062        
 12     44.3802000             -0.004035586      
 13     21.4230800             -0.06968861       
 14     10.3089100             -0.1030105        
 15      4.5536450              0.04471442       
 16      2.1328210              0.2150027        
 17      0.9296970              0.2220163        
 18      0.1921470             -0.3114776        
 19      0.0875950             -0.5693429        
S   19
  1 5820021.0000000            -5.43591E-07      
  2 871523.4000000             -4.336894E-06     
  3 198335.0000000             -2.197572E-05     
  4  56176.3100000             -9.747392E-05     
  5  18325.8200000             -0.0003331615     
  6   6614.9550000             -0.001166192      
  7   2579.1990000             -0.003119308      
  8   1068.8490000             -0.009239504      
  9    465.1045000             -0.01855471       
 10    210.4130000             -0.04281189       
 11     97.6162900             -0.03571095       
 12     44.3802000             -0.0163835        
 13     21.4230800              0.2644664        
 14     10.3089100              0.2086588        
 15      4.5536450             -0.01774382       
 16      2.1328210             -1.3538730        
 17      0.9296970              0.8182926        
 18      0.1921470              1.6950360        
 19      0.0875950             -1.3886560        
S   19
  1 5820021.0000000             8.040791E-07     
  2 871523.4000000              6.282936E-06     
  3 198335.0000000              3.281868E-05     
  4  56176.3100000              0.0001398858     
  5  18325.8200000              0.0005029836     
  6   6614.9550000              0.001655419      
  7   2579.1990000              0.004778677      
  8   1068.8490000              0.01292479       
  9    465.1045000              0.02925831       
 10    210.4130000              0.05791816       
 11     97.6162900              0.06640681       
 12     44.3802000             -0.007388966      
 13     21.4230800             -0.3329989        
 14     10.3089100             -0.5917865        
 15      4.5536450              0.9011406        
 16      2.1328210              1.5859510        
 17      0.9296970             -2.7880080        
 18      0.1921470              2.0718840        
 19      0.0875950             -0.6012025        
S   1
  1      0.0377020              1.0000000        
P   15
  1  24411.9800000              0.0000410        
  2   5778.5180000              0.0003610        
  3   1876.8620000              0.0020880        
  4    718.2361000              0.0092210        
  5    304.8327000              0.0327730        
  6    139.0453000              0.0941790        
  7     66.8041700              0.2091320        
  8     33.2069900              0.3345690        
  9     16.9281600              0.3303590        
 10      8.6962290              0.1523470        
 11      4.3505100              0.0229840        
 12      2.1165230              0.0016070        
 13      0.9953870              0.0004680        
 14      0.3781120              0.0000660        
 15      0.1345790             -0.0000020        
P   15
  1  24411.9800000             -0.0000150        
  2   5778.5180000             -0.0001350        
  3   1876.8620000             -0.0007820        
  4    718.2361000             -0.0034780        
  5    304.8327000             -0.0125200        
  6    139.0453000             -0.0370160        
  7     66.8041700             -0.0855590        
  8     33.2069900             -0.1447180        
  9     16.9281600             -0.1434420        
 10      8.6962290              0.0435950        
 11      4.3505100              0.3488880        
 12      2.1165230              0.4538650        
 13      0.9953870              0.2685940        
 14      0.3781120              0.0388680        
 15      0.1345790             -0.0024920        
P   15
  1  24411.9800000              0.0000030        
  2   5778.5180000              0.0000250        
  3   1876.8620000              0.0001440        
  4    718.2361000              0.0006450        
  5    304.8327000              0.0023110        
  6    139.0453000              0.0068980        
  7     66.8041700              0.0158820        
  8     33.2069900              0.0273500        
  9     16.9281600              0.0266210        
 10      8.6962290             -0.0108580        
 11      4.3505100             -0.0798530        
 12      2.1165230             -0.1061270        
 13      0.9953870             -0.0688830        
 14      0.3781120              0.1843850        
 15      0.1345790              0.5617880        
P   15
  1  24411.9800000              0.0000050        
  2   5778.5180000              0.0000420        
  3   1876.8620000              0.0002380        
  4    718.2361000              0.0010880        
  5    304.8327000              0.0038210        
  6    139.0453000              0.0116440        
  7     66.8041700              0.0261670        
  8     33.2069900              0.0467500        
  9     16.9281600              0.0433090        
 10      8.6962290             -0.0134290        
 11      4.3505100             -0.1538970        
 12      2.1165230             -0.1674130        
 13      0.9953870             -0.0849950        
 14      0.3781120              0.4508130        
 15      0.1345790              0.6408690        
P   15
  1  24411.9800000              0.0000120        
  2   5778.5180000              0.0000960        
  3   1876.8620000              0.0005940        
  4    718.2361000              0.0024840        
  5    304.8327000              0.0095370        
  6    139.0453000              0.0264790        
  7     66.8041700              0.0663660        
  8     33.2069900              0.1024580        
  9     16.9281600              0.1386830        
 10      8.6962290             -0.0801400        
 11      4.3505100             -0.4960690        
 12      2.1165230             -0.4635100        
 13      0.9953870              0.8745310        
 14      0.3781120              0.6297900        
 15      0.1345790             -0.8116860        
P   1
  1      0.0462820              1.0000000        
D   7
  1    205.6177000              0.0023420        
  2     61.4498100              0.0186060        
  3     23.0568900              0.0771020        
  4      9.5777390              0.2020260        
  5      4.1337340              0.3294540        
  6      1.7475180              0.3609760        
  7      0.6995600              0.2716570        
D   7
  1    205.6177000              0.0032790        
  2     61.4498100              0.0261760        
  3     23.0568900              0.1113670        
  4      9.5777390              0.3045810        
  5      4.1337340              0.3862990        
  6      1.7475180             -0.0583750        
  7      0.6995600             -0.5388760        
D   7
  1    205.6177000              0.0037400        
  2     61.4498100              0.0318250        
  3     23.0568900              0.1322290        
  4      9.5777390              0.4245500        
  5      4.1337340              0.1203700        
  6      1.7475180             -0.7626610        
  7      0.6995600             -0.1128230        
D   1
  1      0.2516080              1.0000000        
F   1
  1      5.7922000              1.0000000        
F   1
  1      1.4851000              1.0000000        
G   1
  1      4.1144000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   18
  1 6558157.3000000             0.0000080        
  2 982025.3400000              0.0000622        
  3 223467.6900000              0.0003270        
  4  63288.2910000              0.0013794        
  5  20642.9400000              0.0049993        
  6   7450.5224000              0.0160605        
  7   2905.0744000              0.0460124        
  8   1204.2100000              0.1152224        
  9    524.3045400              0.2373921        
 10    237.4656300              0.3531989        
 11    110.5786600              0.2915500        
 12     51.3746240              0.0812129        
 13     24.4408460              0.0007655        
 14     11.7685910              0.0016124        
 15      5.3421190             -0.0007530        
 16      2.4950360              0.0003134        
 17      1.0987730             -0.0001306        
 18      0.2601800              0.0000513        
S   18
  1 6558157.3000000            -0.0000025        
  2 982025.3400000             -0.0000193        
  3 223467.6900000             -0.0001014        
  4  63288.2910000             -0.0004281        
  5  20642.9400000             -0.0015582        
  6   7450.5224000             -0.0050469        
  7   2905.0744000             -0.0148056        
  8   1204.2100000             -0.0389482        
  9    524.3045400             -0.0896832        
 10    237.4656300             -0.1664076        
 11    110.5786600             -0.2004010        
 12     51.3746240              0.0114943        
 13     24.4408460              0.4958134        
 14     11.7685910              0.5295550        
 15      5.3421190              0.1110185        
 16      2.4950360             -0.0007000        
 17      1.0987730              0.0022283        
 18      0.2601800             -0.0005014        
S   18
  1 6558157.3000000             0.0000009        
  2 982025.3400000              0.0000074        
  3 223467.6900000              0.0000387        
  4  63288.2910000              0.0001633        
  5  20642.9400000              0.0005944        
  6   7450.5224000              0.0019292        
  7   2905.0744000              0.0056689        
  8   1204.2100000              0.0150282        
  9    524.3045400              0.0350222        
 10    237.4656300              0.0671135        
 11    110.5786600              0.0850156        
 12     51.3746240             -0.0047212        
 13     24.4408460             -0.3016737        
 14     11.7685910             -0.4825489        
 15      5.3421190              0.0891695        
 16      2.4950360              0.7287830        
 17      1.0987730              0.4288542        
 18      0.2601800              0.0207249        
S   18
  1 6558157.3000000             0.0000002        
  2 982025.3400000              0.0000017        
  3 223467.6900000              0.0000090        
  4  63288.2910000              0.0000380        
  5  20642.9400000              0.0001382        
  6   7450.5224000              0.0004489        
  7   2905.0744000              0.0013188        
  8   1204.2100000              0.0035016        
  9    524.3045400              0.0081673        
 10    237.4656300              0.0157338        
 11    110.5786600              0.0200284        
 12     51.3746240             -0.0010136        
 13     24.4408460             -0.0750162        
 14     11.7685910             -0.1257980        
 15      5.3421190              0.0300857        
 16      2.4950360              0.2488169        
 17      1.0987730              0.2843706        
 18      0.2601800             -0.3110594        
S   1
  1      0.1270790              1.0000000        
S   1
  1      0.0544080              1.0000000        
P   11
  1   8050.1674000              0.0003169        
  2   1907.5361000              0.0027648        
  3    618.6274600              0.0151204        
  4    235.3241700              0.0599583        
  5     98.8996460              0.1733120        
  6     44.2482150              0.3410820        
  7     20.6174290              0.3896967        
  8      9.7805160              0.1839817        
  9      4.4412380              0.0218896        
 10      1.9640450              0.0011608        
 11      0.8335780              0.0002735        
P   11
  1   8050.1674000             -0.0001203        
  2   1907.5361000             -0.0010492        
  3    618.6274600             -0.0058102        
  4    235.3241700             -0.0234345        
  5     98.8996460             -0.0708270        
  6     44.2482150             -0.1465511        
  7     20.6174290             -0.1769660        
  8      9.7805160              0.0363821        
  9      4.4412380              0.4232848        
 10      1.9640450              0.4952586        
 11      0.8335780              0.1797428        
P   11
  1   8050.1674000              0.0000200        
  2   1907.5361000              0.0001689        
  3    618.6274600              0.0009668        
  4    235.3241700              0.0037797        
  5     98.8996460              0.0119082        
  6     44.2482150              0.0235693        
  7     20.6174290              0.0314233        
  8      9.7805160             -0.0136188        
  9      4.4412380             -0.0734003        
 10      1.9640450             -0.1264785        
 11      0.8335780              0.0158579        
P   1
  1      0.1934450              1.0000000        
P   1
  1      0.0561170              1.0000000        
D   7
  1    244.1474100              0.0020270        
  2     73.0675950              0.0165088        
  3     27.5920810              0.0703823        
  4     11.5465180              0.1911430        
  5      5.0486280              0.3254092        
  6      2.1784650              0.3678199        
  7      0.9002530              0.2744685        
D   1
  1      0.3373270              1.0000000        
D   1
  1      0.1169000              1.0000000        
F   1
  1      0.2881000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   18
  1 7447966.8000000             0.0000074        
  2 1115318.2000000             0.0000574        
  3 253842.6500000              0.0003019        
  4  71915.2850000              0.0012733        
  5  23470.1810000              0.0046123        
  6   8477.4918000              0.0148214        
  7   3308.3908000              0.0425536        
  8   1372.6054000              0.1073055        
  9    598.2200700              0.2245178        
 10    271.3860200              0.3453131        
 11    126.9779500              0.3045261        
 12     60.2220650              0.0990670        
 13     28.0185820              0.0041317        
 14     13.5175220              0.0010347        
 15      6.3094060             -0.0004856        
 16      2.9045340              0.0001805        
 17      1.2875560             -0.0000912        
 18      0.1677320             -0.0000266        
S   18
  1 7447966.8000000            -0.0000023        
  2 1115318.2000000            -0.0000179        
  3 253842.6500000             -0.0000940        
  4  71915.2850000             -0.0003964        
  5  23470.1810000             -0.0014425        
  6   8477.4918000             -0.0046675        
  7   3308.3908000             -0.0137153        
  8   1372.6054000             -0.0361797        
  9    598.2200700             -0.0841679        
 10    271.3860200             -0.1588767        
 11    126.9779500             -0.2033807        
 12     60.2220650             -0.0251410        
 13     28.0185820              0.4575152        
 14     13.5175220              0.5571939        
 15      6.3094060              0.1397055        
 16      2.9045340              0.0022645        
 17      1.2875560              0.0020927        
 18      0.1677320              0.0003281        
S   18
  1 7447966.8000000             0.0000009        
  2 1115318.2000000             0.0000069        
  3 253842.6500000              0.0000362        
  4  71915.2850000              0.0001528        
  5  23470.1810000              0.0005563        
  6   8477.4918000              0.0018018        
  7   3308.3908000              0.0053085        
  8   1372.6054000              0.0140877        
  9    598.2200700              0.0332013        
 10    271.3860200              0.0644621        
 11    126.9779500              0.0869540        
 12     60.2220650              0.0118745        
 13     28.0185820             -0.2724534        
 14     13.5175220             -0.5001452        
 15      6.3094060              0.0108554        
 16      2.9045340              0.7216469        
 17      1.2875560              0.4805213        
 18      0.1677320             -0.0102297        
S   18
  1 7447966.8000000            -0.0000002        
  2 1115318.2000000            -0.0000018        
  3 253842.6500000             -0.0000093        
  4  71915.2850000             -0.0000392        
  5  23470.1810000             -0.0001426        
  6   8477.4918000             -0.0004621        
  7   3308.3908000             -0.0013614        
  8   1372.6054000             -0.0036175        
  9    598.2200700             -0.0085359        
 10    271.3860200             -0.0166506        
 11    126.9779500             -0.0225911        
 12     60.2220650             -0.0032147        
 13     28.0185820              0.0744998        
 14     13.5175220              0.1440333        
 15      6.3094060             -0.0080815        
 16      2.9045340             -0.2704163        
 17      1.2875560             -0.3401607        
 18      0.1677320              0.6190657        
S   1
  1      0.3365520              1.0000000        
S   1
  1      0.0710690              1.0000000        
P   11
  1   6979.5982000              0.0004569        
  2   1654.1648000              0.0039562        
  3    536.0286500              0.0213143        
  4    203.5371300              0.0818715        
  5     85.2375300              0.2223732        
  6     37.8419620              0.3905659        
  7     17.4065120              0.3560415        
  8      7.8814920              0.1070312        
  9      3.5332130              0.0036941        
 10      1.5214730              0.0019219        
 11      0.1990930              0.0001917        
P   11
  1   6979.5982000             -0.0001756        
  2   1654.1648000             -0.0015305        
  3    536.0286500             -0.0083145        
  4    203.5371300             -0.0328718        
  5     85.2375300             -0.0931661        
  6     37.8419620             -0.1755542        
  7     17.4065120             -0.1467912        
  8      7.8814920              0.1862934        
  9      3.5332130              0.5264862        
 10      1.5214730              0.3970859        
 11      0.1990930             -0.0033478        
P   11
  1   6979.5982000              0.0000348        
  2   1654.1648000              0.0003014        
  3    536.0286500              0.0016487        
  4    203.5371300              0.0064982        
  5     85.2375300              0.0186383        
  6     37.8419620              0.0350613        
  7     17.4065120              0.0295892        
  8      7.8814920             -0.0472458        
  9      3.5332130             -0.1249847        
 10      1.5214730             -0.1210801        
 11      0.1990930              0.5754730        
P   1
  1      0.5627040              1.0000000        
P   1
  1      0.0670310              1.0000000        
D   7
  1    282.2391100              0.0018275        
  2     84.5499570              0.0151545        
  3     32.0736560              0.0660460        
  4     13.4974950              0.1839470        
  5      5.9585500              0.3227872        
  6      2.6107880              0.3729459        
  7      1.1039870              0.2751730        
D   1
  1      0.4240490              1.0000000        
D   1
  1      0.1520000              1.0000000        
F   1
  1      0.3458000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   18
  1 8482339.6000000             0.0000068        
  2 1270150.9000000             0.0000528        
  3 289056.9600000              0.0002774        
  4  81879.8490000              0.0011702        
  5  26716.5640000              0.0042421        
  6   9647.5842000              0.0136557        
  7   3764.1195000              0.0393399        
  8   1561.5656000              0.0999292        
  9    680.8146700              0.2121555        
 10    309.2411900              0.3363866        
 11    145.2573600              0.3155125        
 12     69.7390480              0.1181312        
 13     31.7703250              0.0080076        
 14     15.3917570              0.0003293        
 15      7.3415260             -0.0001523        
 16      3.3237160              0.0000247        
 17      1.4858670             -0.0000366        
 18      0.2115000             -0.0000094        
S   18
  1 8482339.6000000            -0.0000021        
  2 1270150.9000000            -0.0000165        
  3 289056.9600000             -0.0000866        
  4  81879.8490000             -0.0003653        
  5  26716.5640000             -0.0013309        
  6   9647.5842000             -0.0043093        
  7   3764.1195000             -0.0126973        
  8   1561.5656000             -0.0336160        
  9    680.8146700             -0.0789470        
 10    309.2411900             -0.1514458        
 11    145.2573600             -0.2042014        
 12     69.7390480             -0.0557367        
 13     31.7703250              0.4187607        
 14     15.3917570              0.5758762        
 15      7.3415260              0.1696842        
 16      3.3237160              0.0060662        
 17      1.4858670              0.0017605        
 18      0.2115000              0.0002316        
S   18
  1 8482339.6000000             0.0000008        
  2 1270150.9000000             0.0000064        
  3 289056.9600000              0.0000337        
  4  81879.8490000              0.0001423        
  5  26716.5640000              0.0005188        
  6   9647.5842000              0.0016802        
  7   3764.1195000              0.0049677        
  8   1561.5656000              0.0132115        
  9    680.8146700              0.0314566        
 10    309.2411900              0.0618446        
 11    145.2573600              0.0879566        
 12     69.7390480              0.0257548        
 13     31.7703250             -0.2455459        
 14     15.3917570             -0.5090572        
 15      7.3415260             -0.0555749        
 16      3.3237160              0.7083796        
 17      1.4858670              0.5231027        
 18      0.2115000             -0.0111176        
S   18
  1 8482339.6000000            -0.0000002        
  2 1270150.9000000            -0.0000018        
  3 289056.9600000             -0.0000093        
  4  81879.8490000             -0.0000392        
  5  26716.5640000             -0.0001429        
  6   9647.5842000             -0.0004629        
  7   3764.1195000             -0.0013687        
  8   1561.5656000             -0.0036440        
  9    680.8146700             -0.0086884        
 10    309.2411900             -0.0171556        
 11    145.2573600             -0.0245514        
 12     69.7390480             -0.0073524        
 13     31.7703250              0.0720087        
 14     15.3917570              0.1576254        
 15      7.3415260              0.0142074        
 16      3.3237160             -0.2851593        
 17      1.4858670             -0.3885347        
 18      0.2115000              0.6495337        
S   1
  1      0.4210860              1.0000000        
S   1
  1      0.0889740              1.0000000        
P   11
  1   7423.8614000              0.0004599        
  2   1759.5166000              0.0039823        
  3    570.2291600              0.0214638        
  4    216.5799700              0.0824617        
  5     90.7342520              0.2238902        
  6     40.3087910              0.3920704        
  7     18.5555020              0.3542238        
  8      8.3965430              0.1048641        
  9      3.7673670              0.0033664        
 10      1.6297010              0.0018495        
 11      0.2225030              0.0002297        
P   11
  1   7423.8614000             -0.0001794        
  2   1759.5166000             -0.0015641        
  3    570.2291600             -0.0084999        
  4    216.5799700             -0.0336327        
  5     90.7342520             -0.0953228        
  6     40.3087910             -0.1793626        
  7     18.5555020             -0.1466682        
  8      8.3965430              0.1966016        
  9      3.7673670              0.5372088        
 10      1.6297010              0.3857361        
 11      0.2225030             -0.0054006        
P   11
  1   7423.8614000              0.0000399        
  2   1759.5166000              0.0003488        
  3    570.2291600              0.0018953        
  4    216.5799700              0.0075325        
  5     90.7342520              0.0214315        
  6     40.3087910              0.0407807        
  7     18.5555020              0.0325249        
  8      8.3965430             -0.0548832        
  9      3.7673670             -0.1511922        
 10      1.6297010             -0.1249011        
 11      0.2225030              0.5855293        
P   1
  1      0.5682630              1.0000000        
P   1
  1      0.0804050              1.0000000        
D   7
  1    321.0196100              0.0016840        
  2     96.2493050              0.0141586        
  3     36.6449630              0.0628259        
  4     15.4939650              0.1784993        
  5      6.8911380              0.3209452        
  6      3.0548310              0.3773515        
  7      1.3142410              0.2750231        
D   1
  1      0.5134300              1.0000000        
D   1
  1      0.1877000              1.0000000        
F   1
  1      0.4158000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   18
  1 9563600.0000000             0.0000063        
  2 1432100.0000000             0.0000489        
  3 325910.0000000              0.0002574        
  4  92312.0000000              0.0010861        
  5  30116.0000000              0.0039399        
  6  10872.0000000              0.0127041        
  7   4240.1000000              0.0367156        
  8   1758.4000000              0.0938672        
  9    766.5900000              0.2017677        
 10    348.4300000              0.3280540        
 11    164.0300000              0.3238334        
 12     79.1420000              0.1352337        
 13     35.5240000              0.0117075        
 14     17.3050000             -0.0003436        
 15      8.3784000              0.0001665        
 16      3.7405000             -0.0001188        
 17      1.6890000              0.0000204        
 18      0.2552000              0.0000083        
S   18
  1 9563600.0000000            -0.0000020        
  2 1432100.0000000            -0.0000153        
  3 325910.0000000             -0.0000806        
  4  92312.0000000             -0.0003400        
  5  30116.0000000             -0.0012397        
  6  10872.0000000             -0.0040177        
  7   4240.1000000             -0.0118672        
  8   1758.4000000             -0.0315340        
  9    766.5900000             -0.0746439        
 10    348.4300000             -0.1452179        
 11    164.0300000             -0.2038441        
 12     79.1420000             -0.0788711        
 13     35.5240000              0.3845825        
 14     17.3050000              0.5865270        
 15      8.3784000              0.1973591        
 16      3.7405000              0.0100102        
 17      1.6890000              0.0013160        
 18      0.2552000              0.0001109        
S   18
  1 9563600.0000000             0.0000008        
  2 1432100.0000000             0.0000060        
  3 325910.0000000              0.0000317        
  4  92312.0000000              0.0001337        
  5  30116.0000000              0.0004883        
  6  10872.0000000              0.0015821        
  7   4240.1000000              0.0046919        
  8   1758.4000000              0.0125098        
  9    766.5900000              0.0300381        
 10    348.4300000              0.0597271        
 11    164.0300000              0.0884696        
 12     79.1420000              0.0363920        
 13     35.5240000             -0.2235329        
 14     17.3050000             -0.5122462        
 15      8.3784000             -0.1084224        
 16      3.7405000              0.6936372        
 17      1.6890000              0.5558711        
 18      0.2552000             -0.0113832        
S   18
  1 9563600.0000000            -0.0000002        
  2 1432100.0000000            -0.0000018        
  3 325910.0000000             -0.0000093        
  4  92312.0000000             -0.0000391        
  5  30116.0000000             -0.0001428        
  6  10872.0000000             -0.0004627        
  7   4240.1000000             -0.0013722        
  8   1758.4000000             -0.0036628        
  9    766.5900000             -0.0088061        
 10    348.4300000             -0.0175867        
 11    164.0300000             -0.0262074        
 12     79.1420000             -0.0109964        
 13     35.5240000              0.0695697        
 14     17.3050000              0.1683947        
 15      8.3784000              0.0346160        
 16      3.7405000             -0.2978702        
 17      1.6890000             -0.4322569        
 18      0.2552000              0.6757217        
S   1
  1      0.5092700              1.0000000        
S   1
  1      0.1065100              1.0000000        
P   11
  1   8004.3000000              0.0004505        
  2   1896.9000000              0.0039049        
  3    614.7100000              0.0210901        
  4    233.5000000              0.0812920        
  5     97.8560000              0.2217841        
  6     43.5140000              0.3907270        
  7     20.0630000              0.3559714        
  8      9.1127000              0.1073272        
  9      4.1063000              0.0036985        
 10      1.7949000              0.0018032        
 11      0.2461500              0.0002208        
P   11
  1   8004.3000000             -0.0001783        
  2   1896.9000000             -0.0015554        
  3    614.7100000             -0.0084727        
  4    233.5000000             -0.0336245        
  5     97.8560000             -0.0958267        
  6     43.5140000             -0.1813907        
  7     20.0630000             -0.1503152        
  8      9.1127000              0.1948263        
  9      4.1063000              0.5415554        
 10      1.7949000              0.3837299        
 11      0.2461500             -0.0050132        
P   11
  1   8004.3000000              0.0000430        
  2   1896.9000000              0.0003770        
  3    614.7100000              0.0020465        
  4    233.5000000              0.0081899        
  5     97.8560000              0.0233356        
  6     43.5140000              0.0449813        
  7     20.0630000              0.0357475        
  8      9.1127000             -0.0586866        
  9      4.1063000             -0.1709573        
 10      1.7949000             -0.1293583        
 11      0.2461500              0.5778069        
P   1
  1      0.6243200              1.0000000        
P   1
  1      0.0889170              1.0000000        
D   7
  1    361.8500000              0.0015655        
  2    108.5500000              0.0133262        
  3     41.4330000              0.0601527        
  4     17.5790000              0.1740293        
  5      7.8627000              0.3195690        
  6      3.5180000              0.3812029        
  7      1.5348000              0.2746086        
D   1
  1      0.6081300              1.0000000        
D   1
  1      0.2220000              1.0000000        
F   1
  1      0.4620000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   18
  1 10639000.0000000            0.0000059        
  2 1593400.0000000             0.0000461        
  3 362610.0000000              0.0002422        
  4 102700.0000000              0.0010226        
  5  33501.0000000              0.0037113        
  6  12093.0000000              0.0119785        
  7   4715.9000000              0.0346927        
  8   1955.6000000              0.0891239        
  9    852.6100000              0.1934557        
 10    387.6700000              0.3209019        
 11    182.6800000              0.3299233        
 12     88.2450000              0.1494121        
 13     39.2630000              0.0149938        
 14     19.2340000             -0.0009165        
 15      9.4057000              0.0004380        
 16      4.1601000             -0.0002398        
 17      1.8995000              0.0000736        
 18      0.3011400              0.0000239        
S   18
  1 10639000.0000000           -0.0000019        
  2 1593400.0000000            -0.0000145        
  3 362610.0000000             -0.0000761        
  4 102700.0000000             -0.0003210        
  5  33501.0000000             -0.0011709        
  6  12093.0000000             -0.0037968        
  7   4715.9000000             -0.0112307        
  8   1955.6000000             -0.0299277        
  9    852.6100000             -0.0712706        
 10    387.6700000             -0.1403136        
 11    182.6800000             -0.2030763        
 12     88.2450000             -0.0960985        
 13     39.2630000              0.3558086        
 14     19.2340000              0.5921792        
 15      9.4057000              0.2215977        
 16      4.1601000              0.0137648        
 17      1.8995000              0.0008395        
 18      0.3011400             -0.0000085        
S   18
  1 10639000.0000000            0.0000007        
  2 1593400.0000000             0.0000057        
  3 362610.0000000              0.0000303        
  4 102700.0000000              0.0001275        
  5  33501.0000000              0.0004659        
  6  12093.0000000              0.0015096        
  7   4715.9000000              0.0044852        
  8   1955.6000000              0.0119835        
  9    852.6100000              0.0289571        
 10    387.6700000              0.0581566        
 11    182.6800000              0.0888133        
 12     88.2450000              0.0445244        
 13     39.2630000             -0.2060387        
 14     19.2340000             -0.5127017        
 15      9.4057000             -0.1509349        
 16      4.1601000              0.6789203        
 17      1.8995000              0.5817697        
 18      0.3011400             -0.0111825        
S   18
  1 10639000.0000000           -0.0000002        
  2 1593400.0000000            -0.0000018        
  3 362610.0000000             -0.0000093        
  4 102700.0000000             -0.0000391        
  5  33501.0000000             -0.0001428        
  6  12093.0000000             -0.0004628        
  7   4715.9000000             -0.0013750        
  8   1955.6000000             -0.0036784        
  9    852.6100000             -0.0088981        
 10    387.6700000             -0.0179529        
 11    182.6800000             -0.0275732        
 12     88.2450000             -0.0140953        
 13     39.2630000              0.0672561        
 14     19.2340000              0.1766928        
 15      9.4057000              0.0528861        
 16      4.1601000             -0.3075955        
 17      1.8995000             -0.4700658        
 18      0.3011400              0.6980341        
S   1
  1      0.6047200              1.0000000        
S   1
  1      0.1251500              1.0000000        
P   11
  1   8676.5000000              0.0004357        
  2   2055.9000000              0.0037815        
  3    666.2300000              0.0204782        
  4    253.1000000              0.0792834        
  5    106.1200000              0.2178473        
  6     47.2420000              0.3878585        
  7     21.8250000              0.3594350        
  8      9.9684000              0.1121995        
  9      4.5171000              0.0043874        
 10      1.9982000              0.0017809        
 11      0.2814500              0.0002122        
P   11
  1   8676.5000000             -0.0001748        
  2   2055.9000000             -0.0015263        
  3    666.2300000             -0.0083399        
  4    253.1000000             -0.0332203        
  5    106.1200000             -0.0954180        
  6     47.2420000             -0.1824026        
  7     21.8250000             -0.1558308        
  8      9.9684000              0.1867899        
  9      4.5171000              0.5427733        
 10      1.9982000              0.3873309        
 11      0.2814500             -0.0043784        
P   11
  1   8676.5000000              0.0000451        
  2   2055.9000000              0.0003964        
  3    666.2300000              0.0021555        
  4    253.1000000              0.0086720        
  5    106.1200000              0.0248680        
  6     47.2420000              0.0485472        
  7     21.8250000              0.0396156        
  8      9.9684000             -0.0605749        
  9      4.5171000             -0.1871699        
 10      1.9982000             -0.1377757        
 11      0.2814500              0.5760896        
P   1
  1      0.7098800              1.0000000        
P   1
  1      0.1020400              1.0000000        
D   7
  1    403.8300000              0.0014732        
  2    121.1700000              0.0126725        
  3     46.3450000              0.0580451        
  4     19.7210000              0.1705103        
  5      8.8624000              0.3185958        
  6      3.9962000              0.3845023        
  7      1.7636000              0.2737737        
D   1
  1      0.7061900              1.0000000        
D   1
  1      0.2639000              1.0000000        
F   1
  1      0.5515000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Kr
data:
KRYPTON
S   18
  1 11718113.0000000            0.0000056        
  2 1754604.4000000             0.0000438        
  3 399281.3200000              0.0002305        
  4 113084.5700000              0.0009733        
  5  36885.9250000              0.0035337        
  6  13312.2090000              0.0114167        
  7   5189.9883000              0.0331325        
  8   2151.6597000              0.0854464        
  9    938.0325100              0.1869124        
 10    426.5573200              0.3149761        
 11    201.0666000              0.3343334        
 12     97.0976050              0.1608810        
 13     42.9987240              0.0178435        
 14     21.1770750             -0.0013793        
 15     10.4267520              0.0006572        
 16      4.5850080             -0.0003388        
 17      2.1176030              0.0001211        
 18      0.3492250              0.0000366        
S   18
  1 11718113.0000000           -0.0000018        
  2 1754604.4000000            -0.0000138        
  3 399281.3200000             -0.0000726        
  4 113084.5700000             -0.0003063        
  5  36885.9250000             -0.0011177        
  6  13312.2090000             -0.0036270        
  7   5189.9883000             -0.0107432        
  8   2151.6597000             -0.0286992        
  9    938.0325100             -0.0686679        
 10    426.5573200             -0.1365155        
 11    201.0666000             -0.2022458        
 12     97.0976050             -0.1090569        
 13     42.9987240              0.3318768        
 14     21.1770750              0.5948250        
 15     10.4267520              0.2424825        
 16      4.5850080              0.0172241        
 17      2.1176030              0.0003685        
 18      0.3492250             -0.0001153        
S   18
  1 11718113.0000000            0.0000007        
  2 1754604.4000000             0.0000055        
  3 399281.3200000              0.0000292        
  4 113084.5700000              0.0001228        
  5  36885.9250000              0.0004491        
  6  13312.2090000              0.0014557        
  7   5189.9883000              0.0043319        
  8   2151.6597000              0.0115965        
  9    938.0325100              0.0281585        
 10    426.5573200              0.0570339        
 11    201.0666000              0.0891356        
 12     97.0976050              0.0508421        
 13     42.9987240             -0.1921030        
 14     21.1770750             -0.5121040        
 15     10.4267520             -0.1857007        
 16      4.5850080              0.6654119        
 17      2.1176030              0.6023925        
 18      0.3492250             -0.0106453        
S   18
  1 11718113.0000000           -0.0000002        
  2 1754604.4000000            -0.0000018        
  3 399281.3200000             -0.0000093        
  4 113084.5700000             -0.0000391        
  5  36885.9250000             -0.0001430        
  6  13312.2090000             -0.0004639        
  7   5189.9883000             -0.0013801        
  8   2151.6597000             -0.0037001        
  9    938.0325100             -0.0089921        
 10    426.5573200             -0.0183021        
 11    201.0666000             -0.0287559        
 12     97.0976050             -0.0167324        
 13     42.9987240              0.0652410        
 14     21.1770750              0.1834422        
 15     10.4267520              0.0692183        
 16      4.5850080             -0.3156034        
 17      2.1176030             -0.5031501        
 18      0.3492250              0.7171571        
S   1
  1      0.7070570              1.0000000        
S   1
  1      0.1448210              1.0000000        
P   11
  1   9366.3090000              0.0004231        
  2   2219.5543000              0.0036743        
  3    719.4528800              0.0199312        
  4    273.4644600              0.0774222        
  5    114.7522500              0.2140386        
  6     51.1555690              0.3848556        
  7     23.6826760              0.3626340        
  8     10.8754840              0.1170818        
  9      4.9551310              0.0051210        
 10      2.2172670              0.0017539        
 11      0.3221540              0.0002199        
P   11
  1   9366.3090000             -0.0001720        
  2   2219.5543000             -0.0015025        
  3    719.4528800             -0.0082269        
  4    273.4644600             -0.0328566        
  5    114.7522500             -0.0950135        
  6     51.1555690             -0.1833106        
  7     23.6826760             -0.1612161        
  8     10.8754840              0.1787644        
  9      4.9551310              0.5437885        
 10      2.2172670              0.3913387        
 11      0.3221540             -0.0047800        
P   11
  1   9366.3090000              0.0000466        
  2   2219.5543000              0.0004100        
  3    719.4528800              0.0022328        
  4    273.4644600              0.0090144        
  5    114.7522500              0.0260115        
  6     51.1555690              0.0513340        
  7     23.6826760              0.0430929        
  8     10.8754840             -0.0615040        
  9      4.9551310             -0.2003424        
 10      2.2172670             -0.1457364        
 11      0.3221540              0.5764581        
P   1
  1      0.8064100              1.0000000        
P   1
  1      0.1176190              1.0000000        
D   7
  1    446.1613300              0.0014044        
  2    133.9647700              0.0121715        
  3     51.3459070              0.0563919        
  4     21.9169060              0.1676430        
  5      9.8937250              0.3177368        
  6      4.4925270              0.3872647        
  7      2.0022930              0.2728006        
D   1
  1      0.8084090              1.0000000        
D   1
  1      0.3006000              1.0000000        
F   1
  1      0.6622000              1.0000000        
$


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: H
data:
HYDROGEN
S   3
  1      3.3870000E+01          6.06858578175E-03      
  2      5.0950000E+00          4.53098963937E-02      
  3      1.1590000E+00          2.02826206238E-01      
S   1
  1      3.2580000E-01          1.0000000        
S   1
  1      1.0270000E-01          1.0000000        
P   1
  1      1.4070000E+00          1.0000000        
P   1
  1      3.8800000E-01          1.0000000        
D   1
  1      1.0570000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      2.3400000E+02          2.58822428627E-03      
  2      3.5160000E+01          1.95369501625E-02      
  3      7.9890000E+00          9.10073398223E-02      
  4      2.2120000E+00          2.72056504873E-01      
S   1
  1      6.6690000E-01          1.0000000        
S   1
  1      2.0890000E-01          1.0000000        
P   1
  1      3.0440000E+00          1.0000000        
P   1
  1      7.5800000E-01          1.0000000        
D   1
  1      1.9650000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: B
data:
BORON
S   8
  1      5.4730000E+03          5.56840543166E-04      
  2      8.2090000E+02          4.29915221247E-03      
  3      1.8680000E+02          2.19792002257E-02      
  4      5.2830000E+01          8.45083185597E-02      
  5      1.7080000E+01          2.38623444450E-01      
  6      5.9990000E+00          4.34998759230E-01      
  7      2.2080000E+00          3.41735928025E-01      
  8      2.4150000E-01         -9.53190049923E-03      
S   8
  1      5.4730000E+03         -1.12578715702E-04      
  2      8.2090000E+02         -8.70401416444E-04      
  3      1.8680000E+02         -4.49146693533E-03      
  4      5.2830000E+01         -1.77053591354E-02      
  5      1.7080000E+01         -5.36694059110E-02      
  6      5.9990000E+00         -1.19039280420E-01      
  7      2.2080000E+00         -1.65662367116E-01      
  8      2.4150000E-01          5.95993880415E-01      
S   1
  1      5.8790000E-01          1.0000000        
S   1
  1      8.6100000E-02          1.0000000        
P   3
  1      1.2050000E+01          1.31199702432E-02      
  2      2.6130000E+00          7.98844759937E-02      
  3      7.4750000E-01          2.77211679860E-01      
P   1
  1      2.3850000E-01          1.0000000        
P   1
  1      7.6980000E-02          1.0000000        
D   1
  1      6.6100000E-01          1.0000000        
D   1
  1      1.9900000E-01          1.0000000        
F   1
  1      4.9000000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: C
data:
CARBON
S   8
  1      8.2360000E+03          5.33271384833E-04      
  2      1.2350000E+03          4.11949600363E-03      
  3      2.8080000E+02          2.11304425554E-02      
  4      7.9270000E+01          8.19540345674E-02      
  5      2.5590000E+01          2.34924544074E-01      
  6      8.9970000E+00          4.34340228406E-01      
  7      3.3190000E+00          3.45805583573E-01      
  8      3.6430000E-01         -8.96210182151E-03      
S   8
  1      8.2360000E+03         -1.13985535470E-04      
  2      1.2350000E+03         -8.83150608252E-04      
  3      2.8080000E+02         -4.56263231877E-03      
  4      7.9270000E+01         -1.82109821701E-02      
  5      2.5590000E+01         -5.59477774227E-02      
  6      8.9970000E+00         -1.27284984585E-01      
  7      3.3190000E+00         -1.70625450332E-01      
  8      3.6430000E-01          6.00776776546E-01      
S   1
  1      9.0590000E-01          1.0000000        
S   1
  1      1.2850000E-01          1.0000000        
P   3
  1      1.8710000E+01          1.39361105679E-02      
  2      4.1330000E+00          8.64105577371E-02      
  3      1.2000000E+00          2.87303152155E-01      
P   1
  1      3.8270000E-01          1.0000000        
P   1
  1      1.2090000E-01          1.0000000        
D   1
  1      1.0970000E+00          1.0000000        
D   1
  1      3.1800000E-01          1.0000000        
F   1
  1      7.6100000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: N
data:
NITROGEN
S   8
  1      1.1420000E+04          5.25678840525E-04      
  2      1.7120000E+03          4.06098857814E-03      
  3      3.8930000E+02          2.08339586406E-02      
  4      1.1000000E+02          8.08684966142E-02      
  5      3.5570000E+01          2.33231152255E-01      
  6      1.2540000E+01          4.33448702831E-01      
  7      4.6440000E+00          3.47027839386E-01      
  8      5.1180000E-01         -8.48169322889E-03      
S   8
  1      1.1420000E+04         -1.16469295076E-04      
  2      1.7120000E+03         -9.03184014115E-04      
  3      3.8930000E+02         -4.66232724402E-03      
  4      1.1000000E+02         -1.86654491227E-02      
  5      3.5570000E+01         -5.76941361251E-02      
  6      1.2540000E+01         -1.32848081328E-01      
  7      4.6440000E+00         -1.73194123952E-01      
  8      5.1180000E-01          6.03926083646E-01      
S   1
  1      1.2930000E+00          1.0000000        
S   1
  1      1.7870000E-01          1.0000000        
P   3
  1      2.6630000E+01          1.45411606540E-02      
  2      5.9480000E+00          9.11823770332E-02      
  3      1.7420000E+00          2.94410631843E-01      
P   1
  1      5.5500000E-01          1.0000000        
P   1
  1      1.7250000E-01          1.0000000        
D   1
  1      1.6540000E+00          1.0000000        
D   1
  1      4.6900000E-01          1.0000000        
F   1
  1      1.0930000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: O
data:
OXYGEN
S   8
  1      1.5330000E+04          5.11456078860E-04      
  2      2.2990000E+03          3.94954193247E-03      
  3      5.2240000E+02          2.03171149924E-02      
  4      1.4730000E+02          7.93584706831E-02      
  5      4.7550000E+01          2.30885630333E-01      
  6      1.6760000E+01          4.32962239871E-01      
  7      6.2070000E+00          3.49671748127E-01      
  8      6.8820000E-01         -8.12469717454E-03      
S   8
  1      1.5330000E+04         -1.16265395666E-04      
  2      2.2990000E+03         -9.01791122169E-04      
  3      5.2240000E+02         -4.66372853756E-03      
  4      1.4730000E+02         -1.88147121064E-02      
  5      4.7550000E+01         -5.86417647212E-02      
  6      1.6760000E+01         -1.36757280123E-01      
  7      6.2070000E+00         -1.75491020166E-01      
  8      6.8820000E-01          6.04381539350E-01      
S   1
  1      1.7520000E+00          1.0000000        
S   1
  1      2.3840000E-01          1.0000000        
P   3
  1      3.4460000E+01          1.59236028938E-02      
  2      7.7490000E+00          9.96609974827E-02      
  3      2.2800000E+00          3.09522336730E-01      
P   1
  1      7.1560000E-01          1.0000000        
P   1
  1      2.1400000E-01          1.0000000        
D   1
  1      2.3140000E+00          1.0000000        
D   1
  1      6.4500000E-01          1.0000000        
F   1
  1      1.4280000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: F
data:
FLUORINE
S   8
  1      1.9500000E+04          5.11437345512E-04      
  2      2.9230000E+03          3.94842471311E-03      
  3      6.6450000E+02          2.02938394240E-02      
  4      1.8750000E+02          7.92336934939E-02      
  5      6.0620000E+01          2.30690092293E-01      
  6      2.1420000E+01          4.32647988484E-01      
  7      7.9500000E+00          3.49213427350E-01      
  8      8.8150000E-01         -7.85492107597E-03      
S   8
  1      1.9500000E+04         -1.18492651650E-04      
  2      2.9230000E+03         -9.19446444724E-04      
  3      6.6450000E+02         -4.74728081864E-03      
  4      1.8750000E+02         -1.91769092662E-02      
  5      6.0620000E+01         -5.98028529462E-02      
  6      2.1420000E+01         -1.40177076477E-01      
  7      7.9500000E+00         -1.76108068338E-01      
  8      8.8150000E-01          6.05031208978E-01      
S   1
  1      2.2570000E+00          1.0000000        
S   1
  1      3.0410000E-01          1.0000000        
P   3
  1      4.3880000E+01          1.67000435590E-02      
  2      9.9260000E+00          1.04528517551E-01      
  3      2.9300000E+00          3.17193902488E-01      
P   1
  1      9.1320000E-01          1.0000000        
P   1
  1      2.6720000E-01          1.0000000        
D   1
  1      3.1070000E+00          1.0000000        
D   1
  1      8.5500000E-01          1.0000000        
F   1
  1      1.9170000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ne
data:
NEON
S   8
  1      2.4350000E+04          5.06819061574E-04      
  2      3.6500000E+03          3.91247387416E-03      
  3      8.2960000E+02          2.01126029649E-02      
  4      2.3400000E+02          7.86954432773E-02      
  5      7.5610000E+01          2.29991480024E-01      
  6      2.6730000E+01          4.32444841235E-01      
  7      9.9270000E+00          3.49709909401E-01      
  8      1.1020000E+00         -7.60035586687E-03      
S   8
  1      2.4350000E+04         -1.19175591674E-04      
  2      3.6500000E+03         -9.25066889471E-04      
  3      8.2960000E+02         -4.77455972838E-03      
  4      2.3400000E+02         -1.93485746214E-02      
  5      7.5610000E+01         -6.05594964763E-02      
  6      2.6730000E+01         -1.42720676778E-01      
  7      9.9270000E+00         -1.76851814612E-01      
  8      1.1020000E+00          6.05804528843E-01      
S   1
  1      2.8360000E+00          1.0000000        
S   1
  1      3.7820000E-01          1.0000000        
P   3
  1      5.4700000E+01          1.71989474479E-02      
  2      1.2430000E+01          1.07739970797E-01      
  3      3.6790000E+00          3.21608847882E-01      
P   1
  1      1.1430000E+00          1.0000000        
P   1
  1      3.3000000E-01          1.0000000        
D   1
  1      4.0140000E+00          1.0000000        
D   1
  1      1.0960000E+00          1.0000000        
F   1
  1      2.5440000E+00          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   13
  1      2.0550000E+05          6.92979400776E-05      
  2      3.0780000E+04          5.36560323924E-04      
  3      7.0060000E+03          2.80127478624E-03      
  4      1.9850000E+03          1.15976944763E-02      
  5      6.4910000E+02          4.01218350490E-02      
  6      2.3500000E+02          1.15542240268E-01      
  7      9.1620000E+01          2.61210023400E-01      
  8      3.7670000E+01          3.95671587284E-01      
  9      1.5910000E+01          2.83229604826E-01      
 10      5.8500000E+00          4.41134594579E-02      
 11      2.5420000E+00         -4.85117292291E-03      
 12      1.0570000E+00          2.58815640596E-03      
 13      1.4550000E-01          7.14698308880E-04      
S   13
  1      2.0550000E+05         -1.80689271547E-05      
  2      3.0780000E+04         -1.40155775628E-04      
  3      7.0060000E+03         -7.31731990741E-04      
  4      1.9850000E+03         -3.05586967797E-03      
  5      6.4910000E+02         -1.07202759444E-02      
  6      2.3500000E+02         -3.23975912390E-02      
  7      9.1620000E+01         -8.06511943830E-02      
  8      3.7670000E+01         -1.56929807416E-01      
  9      1.5910000E+01         -1.66786145824E-01      
 10      5.8500000E+00          1.29951432505E-01      
 11      2.5420000E+00          5.61985498789E-01      
 12      1.0570000E+00          4.33726071895E-01      
 13      1.4550000E-01         -1.10710335717E-02      
S   13
  1      2.0550000E+05          4.17292306360E-06      
  2      3.0780000E+04          3.23456903688E-05      
  3      7.0060000E+03          1.69077480896E-04      
  4      1.9850000E+03          7.05415926286E-04      
  5      6.4910000E+02          2.48249154555E-03      
  6      2.3500000E+02          7.50948555100E-03      
  7      9.1620000E+01          1.89007382591E-02      
  8      3.7670000E+01          3.73295507248E-02      
  9      1.5910000E+01          4.15094009102E-02      
 10      5.8500000E+00         -3.62245077363E-02      
 11      2.5420000E+00         -1.75946507399E-01      
 12      1.0570000E+00         -2.74768537951E-01      
 13      1.4550000E-01          6.52081589279E-01      
S   1
  1      2.9310000E-01          1.0000000        
S   1
  1      5.6500000E-02          1.0000000        
P   7
  1      4.4440000E+02          1.64938711276E-03      
  2      1.0510000E+02          1.31525651219E-02      
  3      3.3470000E+01          6.14135081375E-02      
  4      1.2330000E+01          1.88015043156E-01      
  5      4.8690000E+00          3.60274642045E-01      
  6      1.9610000E+00          4.07999003993E-01      
  7      1.8880000E-01          9.72383594651E-03      
P   7
  1      4.4440000E+02         -2.90018095558E-04      
  2      1.0510000E+02         -2.43660232367E-03      
  3      3.3470000E+01         -1.08904790795E-02      
  4      1.2330000E+01         -3.64266099674E-02      
  5      4.8690000E+00         -6.40031986775E-02      
  6      1.9610000E+00         -9.70445599996E-02      
  7      1.8880000E-01          5.02695021850E-01      
P   1
  1      7.8340000E-01          1.0000000        
P   1
  1      5.5570000E-02          1.0000000        
D   1
  1      3.3300000E-01          1.0000000        
D   1
  1      1.0900000E-01          1.0000000        
F   1
  1      2.4400000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Si
data:
SILICON
S   13
  1      2.5490000E+05          6.40310571755E-05      
  2      3.8190000E+04          4.95719126745E-04      
  3      8.6900000E+03          2.58770021115E-03      
  4      2.4620000E+03          1.07238379925E-02      
  5      8.0480000E+02          3.72138234069E-02      
  6      2.9130000E+02          1.08052273602E-01      
  7      1.1360000E+02          2.48357660782E-01      
  8      4.6750000E+01          3.90206553658E-01      
  9      1.9820000E+01          3.00417759430E-01      
 10      7.7080000E+00          5.54363472109E-02      
 11      3.3400000E+00         -3.97962884418E-03      
 12      1.4020000E+00          2.55228136964E-03      
 13      2.0700000E-01          6.00820288534E-04      
S   13
  1      2.5490000E+05         -1.71124467179E-05      
  2      3.8190000E+04         -1.32580661538E-04      
  3      8.6900000E+03         -6.93072696258E-04      
  4      2.4620000E+03         -2.89046744169E-03      
  5      8.0480000E+02         -1.01894674996E-02      
  6      2.9130000E+02         -3.08756449420E-02      
  7      1.1360000E+02         -7.81370437326E-02      
  8      4.6750000E+01         -1.54420139682E-01      
  9      1.9820000E+01         -1.78730193011E-01      
 10      7.7080000E+00          8.33554845234E-02      
 11      3.3400000E+00          5.48630157110E-01      
 12      1.4020000E+00          4.76681351724E-01      
 13      2.0700000E-01         -1.03328154101E-02      
S   13
  1      2.5490000E+05          4.39138704847E-06      
  2      3.8190000E+04          3.40018634141E-05      
  3      8.6900000E+03          1.77942794365E-04      
  4      2.4620000E+03          7.41516041689E-04      
  5      8.0480000E+02          2.62181379126E-03      
  6      2.9130000E+02          7.95503957996E-03      
  7      1.1360000E+02          2.03516051053E-02      
  8      4.6750000E+01          4.08638074927E-02      
  9      1.9820000E+01          4.95162874109E-02      
 10      7.7080000E+00         -2.60205436396E-02      
 11      3.3400000E+00         -1.91811988916E-01      
 12      1.4020000E+00         -3.17412819572E-01      
 13      2.0700000E-01          6.81679600748E-01      
S   1
  1      4.3870000E-01          1.0000000        
S   1
  1      7.9440000E-02          1.0000000        
P   7
  1      4.8150000E+02          1.94934514640E-03      
  2      1.1390000E+02          1.54680610739E-02      
  3      3.6230000E+01          7.16366427869E-02      
  4      1.3340000E+01          2.13223995964E-01      
  5      5.2520000E+00          3.90089187384E-01      
  6      2.1200000E+00          3.93107701703E-01      
  7      2.5280000E-01          3.99330597303E-03      
P   7
  1      4.8150000E+02         -4.08558493130E-04      
  2      1.1390000E+02         -3.36860516837E-03      
  3      3.6230000E+01         -1.52262624744E-02      
  4      1.3340000E+01         -4.87707839625E-02      
  5      5.2520000E+00         -8.45898041870E-02      
  6      2.1200000E+00         -1.12360121085E-01      
  7      2.5280000E-01          5.35327024196E-01      
P   1
  1      8.5610000E-01          1.0000000        
P   1
  1      7.8890000E-02          1.0000000        
D   1
  1      4.8100000E-01          1.0000000        
D   1
  1      1.5900000E-01          1.0000000        
F   1
  1      3.3600000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: P
data:
PHOSPHORUS
S   13
  1      3.1240000E+05          5.93155570841E-05      
  2      4.6800000E+04          4.59186886048E-04      
  3      1.0650000E+04          2.39509780499E-03      
  4      3.0180000E+03          9.92978445280E-03      
  5      9.8680000E+02          3.45130936715E-02      
  6      3.5740000E+02          1.00847773108E-01      
  7      1.3960000E+02          2.34902458985E-01      
  8      5.7630000E+01          3.81741473447E-01      
  9      2.4600000E+01          3.16245564553E-01      
 10      1.0120000E+01          7.00978012806E-02      
 11      4.2830000E+00         -1.79477974432E-03      
 12      1.8050000E+00          2.13472249906E-03      
 13      2.7820000E-01          4.26885136012E-04      
S   13
  1      3.1240000E+05         -1.61885700615E-05      
  2      4.6800000E+04         -1.25295921518E-04      
  3      1.0650000E+04         -6.55314622189E-04      
  4      3.0180000E+03         -2.72830583263E-03      
  5      9.8680000E+02         -9.64807339216E-03      
  6      3.5740000E+02         -2.92677080787E-02      
  7      1.3960000E+02         -7.50062390536E-02      
  8      5.7630000E+01         -1.50183545997E-01      
  9      2.4600000E+01         -1.87886174226E-01      
 10      1.0120000E+01          4.03169446187E-02      
 11      4.2830000E+00          5.30954659738E-01      
 12      1.8050000E+00          5.15107816451E-01      
 13      2.7820000E-01         -8.95838183528E-03      
S   13
  1      3.1240000E+05          4.46321904290E-06      
  2      4.6800000E+04          3.45156965276E-05      
  3      1.0650000E+04          1.80778115275E-04      
  4      3.0180000E+03          7.51724576065E-04      
  5      9.8680000E+02          2.66775567540E-03      
  6      3.5740000E+02          8.09804371585E-03      
  7      1.3960000E+02          2.10005377687E-02      
  8      5.7630000E+01          4.26634751178E-02      
  9      2.4600000E+01          5.60374813649E-02      
 10      1.0120000E+01         -1.41157105713E-02      
 11      4.2830000E+00         -1.98651116810E-01      
 12      1.8050000E+00         -3.53654610143E-01      
 13      2.7820000E-01          7.02974743910E-01      
S   1
  1      6.1580000E-01          1.0000000        
S   1
  1      1.0550000E-01          1.0000000        
P   7
  1      5.0490000E+02          2.37617678354E-03      
  2      1.1940000E+02          1.86914010018E-02      
  3      3.7960000E+01          8.52700213359E-02      
  4      1.3950000E+01          2.44780258637E-01      
  5      5.4570000E+00          4.22308485343E-01      
  6      2.1770000E+00          3.67577590647E-01      
  7      2.8770000E-01         -3.40187271633E-03      
P   7
  1      5.0490000E+02         -5.61185112953E-04      
  2      1.1940000E+02         -4.47246701533E-03      
  3      3.7960000E+01         -2.05850420859E-02      
  4      1.3950000E+01         -6.14809867952E-02      
  5      5.4570000E+00         -1.08088416694E-01      
  6      2.1770000E+00         -1.04741754487E-01      
  7      2.8770000E-01          5.46207952080E-01      
P   1
  1      8.0100000E-01          1.0000000        
P   1
  1      9.7140000E-02          1.0000000        
D   1
  1      6.5200000E-01          1.0000000        
D   1
  1      2.1600000E-01          1.0000000        
F   1
  1      4.5200000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: S
data:
SULFUR
S   13
  1      3.7410000E+05          5.59542992429E-05      
  2      5.6050000E+04          4.32593264285E-04      
  3      1.2760000E+04          2.25636460237E-03      
  4      3.6150000E+03          9.35217241080E-03      
  5      1.1830000E+03          3.25127946542E-02      
  6      4.2880000E+02          9.53871903282E-02      
  7      1.6780000E+02          2.24269232805E-01      
  8      6.9470000E+01          3.73724405669E-01      
  9      2.9840000E+01          3.27036511168E-01      
 10      1.2720000E+01          8.38132457426E-02      
 11      5.2440000E+00          4.36978143209E-04      
 12      2.2190000E+00          1.62509950145E-03      
 13      3.4900000E-01          2.96714323399E-04      
S   13
  1      3.7410000E+05         -1.55489651430E-05      
  2      5.6050000E+04         -1.20101539262E-04      
  3      1.2760000E+04         -6.28741728339E-04      
  4      3.6150000E+03         -2.61287835168E-03      
  5      1.1830000E+03         -9.25264706507E-03      
  6      4.2880000E+02         -2.80722994810E-02      
  7      1.6780000E+02         -7.25729883321E-02      
  8      6.9470000E+01         -1.46733141115E-01      
  9      2.9840000E+01         -1.93583086978E-01      
 10      1.2720000E+01          1.26823840038E-02      
 11      5.2440000E+00          5.19531260411E-01      
 12      2.2190000E+00          5.37531251687E-01      
 13      3.4900000E-01         -8.84812166442E-03      
S   13
  1      3.7410000E+05          4.51913367714E-06      
  2      5.6050000E+04          3.48843898327E-05      
  3      1.2760000E+04          1.82828047487E-04      
  4      3.6150000E+03          7.59162092326E-04      
  5      1.1830000E+03          2.69652200593E-03      
  6      4.2880000E+02          8.19217778131E-03      
  7      1.6780000E+02          2.14134818391E-02      
  8      6.9470000E+01          4.39812877976E-02      
  9      2.9840000E+01          6.07884425119E-02      
 10      1.2720000E+01         -5.13773027553E-03      
 11      5.2440000E+00         -2.06795808486E-01      
 12      2.2190000E+00         -3.80124386789E-01      
 13      3.4900000E-01          7.14474885371E-01      
S   1
  1      7.7670000E-01          1.0000000        
S   1
  1      1.3220000E-01          1.0000000        
P   7
  1      5.7440000E+02          2.46920564044E-03      
  2      1.3580000E+02          1.94626227004E-02      
  3      4.3190000E+01          8.89132019562E-02      
  4      1.5870000E+01          2.54870446431E-01      
  5      6.2080000E+00          4.33455972776E-01      
  6      2.4830000E+00          3.53972732842E-01      
  7      3.2290000E-01         -4.85004576175E-03      
P   7
  1      5.7440000E+02         -6.32013855397E-04      
  2      1.3580000E+02         -4.98459970745E-03      
  3      4.3190000E+01         -2.33614333314E-02      
  4      1.5870000E+01         -6.85178132045E-02      
  5      6.2080000E+00         -1.23719008937E-01      
  6      2.4830000E+00         -9.60920157211E-02      
  7      3.2290000E-01          5.62512855488E-01      
P   1
  1      8.6880000E-01          1.0000000        
P   1
  1      1.0980000E-01          1.0000000        
D   1
  1      8.1900000E-01          1.0000000        
D   1
  1      2.6900000E-01          1.0000000        
F   1
  1      5.5700000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   13
  1      4.5610000E+05          5.10925626738E-05      
  2      6.8330000E+04          3.95234631817E-04      
  3      1.5550000E+04          2.06005265478E-03      
  4      4.4050000E+03          8.55324671904E-03      
  5      1.4390000E+03          2.98974526612E-02      
  6      5.2040000E+02          8.86226295818E-02      
  7      2.0310000E+02          2.12241018840E-01      
  8      8.3960000E+01          3.64767513811E-01      
  9      3.6200000E+01          3.38593326523E-01      
 10      1.5830000E+01          1.00968372063E-01      
 11      6.3340000E+00          3.07175863864E-03      
 12      2.6940000E+00          1.04129249835E-03      
 13      4.3130000E-01          1.53456755392E-04      
S   13
  1      4.5610000E+05         -1.44224997858E-05      
  2      6.8330000E+04         -1.11389319433E-04      
  3      1.5550000E+04         -5.83225672175E-04      
  4      4.4050000E+03         -2.42399964131E-03      
  5      1.4390000E+03         -8.63700218947E-03      
  6      5.2040000E+02         -2.63628213272E-02      
  7      2.0310000E+02         -6.92911058007E-02      
  8      8.3960000E+01         -1.42242877842E-01      
  9      3.6200000E+01         -1.97853139732E-01      
 10      1.5830000E+01         -1.45217454035E-02      
 11      6.3340000E+00          5.03653107897E-01      
 12      2.6940000E+00          5.58439504511E-01      
 13      4.3130000E-01         -8.03598768819E-03      
S   13
  1      4.5610000E+05          4.36553065921E-06      
  2      6.8330000E+04          3.36941709082E-05      
  3      1.5550000E+04          1.76626101125E-04      
  4      4.4050000E+03          7.33439539770E-04      
  5      1.4390000E+03          2.62141366224E-03      
  6      5.2040000E+02          8.01097106068E-03      
  7      2.0310000E+02          2.12885629923E-02      
  8      8.3960000E+01          4.43729332038E-02      
  9      3.6200000E+01          6.46416404122E-02      
 10      1.5830000E+01          4.26876597736E-03      
 11      6.3340000E+00         -2.09222928012E-01      
 12      2.6940000E+00         -4.03259683116E-01      
 13      4.3130000E-01          7.25636942062E-01      
S   1
  1      9.7680000E-01          1.0000000        
S   1
  1      1.6250000E-01          1.0000000        
P   7
  1      6.6330000E+02          2.45796918157E-03      
  2      1.5680000E+02          1.94292121169E-02      
  3      4.9980000E+01          8.89601716849E-02      
  4      1.8420000E+01          2.56320743055E-01      
  5      7.2400000E+00          4.36372815323E-01      
  6      2.9220000E+00          3.49203494356E-01      
  7      3.8180000E-01         -4.62436268941E-03      
P   7
  1      6.6330000E+02         -6.66744240765E-04      
  2      1.5680000E+02         -5.25301386234E-03      
  3      4.9980000E+01         -2.48210348361E-02      
  4      1.8420000E+01         -7.28649554322E-02      
  5      7.2400000E+00         -1.33795043701E-01      
  6      2.9220000E+00         -9.39974357131E-02      
  7      3.8180000E-01          5.64054024796E-01      
P   1
  1      1.0220000E+00          1.0000000        
P   1
  1      1.3010000E-01          1.0000000        
D   1
  1      1.0460000E+00          1.0000000        
D   1
  1      3.4400000E-01          1.0000000        
F   1
  1      7.0600000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ar
data:
ARGON
S   13
  1      5.4500000E+05          4.74479533323E-05      
  2      8.1640000E+04          3.66891432997E-04      
  3      1.8580000E+04          1.91207781498E-03      
  4      5.2610000E+03          7.94561106755E-03      
  5      1.7170000E+03          2.78795770038E-02      
  6      6.1990000E+02          8.32476367269E-02      
  7      2.4160000E+02          2.02128638961E-01      
  8      9.9790000E+01          3.56261093470E-01      
  9      4.3150000E+01          3.47057837623E-01      
 10      1.9140000E+01          1.16799804395E-01      
 11      7.4880000E+00          5.50902172368E-03      
 12      3.2050000E+00          4.75981201281E-04      
 13      5.2040000E-01          2.87131604718E-05      
S   13
  1      5.4500000E+05         -1.35789455214E-05      
  2      8.1640000E+04         -1.04783688121E-04      
  3      1.8580000E+04         -5.48882464567E-04      
  4      5.2610000E+03         -2.28067523598E-03      
  5      1.7170000E+03         -8.16052120527E-03      
  6      6.1990000E+02         -2.50135649585E-02      
  7      2.4160000E+02         -6.65221449974E-02      
  8      9.9790000E+01         -1.38396555636E-01      
  9      4.3150000E+01         -2.00259962148E-01      
 10      1.9140000E+01         -3.56228016324E-02      
 11      7.4880000E+00          4.89614224144E-01      
 12      3.2050000E+00          5.73246586605E-01      
 13      5.2040000E-01         -7.00315102570E-03      
S   13
  1      5.4500000E+05          4.24586082664E-06      
  2      8.1640000E+04          3.27418150904E-05      
  3      1.8580000E+04          1.71712610585E-04      
  4      5.2610000E+03          7.12831043935E-04      
  5      1.7170000E+03          2.55848105147E-03      
  6      6.1990000E+02          7.85105677545E-03      
  7      2.4160000E+02          2.11083889174E-02      
  8      9.9790000E+01          4.45750735939E-02      
  9      4.3150000E+01          6.75174393917E-02      
 10      1.9140000E+01          1.20811266180E-02      
 11      7.4880000E+00         -2.10837189585E-01      
 12      3.2050000E+00         -4.22084747429E-01      
 13      5.2040000E-01          7.33771821446E-01      
S   1
  1      1.1960000E+00          1.0000000        
S   1
  1      1.9540000E-01          1.0000000        
P   7
  1      7.6180000E+02          2.43010017186E-03      
  2      1.8020000E+02          1.92652354327E-02      
  3      5.7500000E+01          8.86066865603E-02      
  4      2.1240000E+01          2.56752876091E-01      
  5      8.3880000E+00          4.38087520657E-01      
  6      3.4160000E+00          3.46226147630E-01      
  7      4.5230000E-01         -5.28648214450E-03      
P   7
  1      7.6180000E+02         -6.84368147537E-04      
  2      1.8020000E+02         -5.39726368677E-03      
  3      5.7500000E+01         -2.57066087661E-02      
  4      2.1240000E+01         -7.57947045760E-02      
  5      8.3880000E+00         -1.40865114413E-01      
  6      3.4160000E+00         -9.22961298297E-02      
  7      4.5230000E-01          5.61760631739E-01      
P   1
  1      1.2060000E+00          1.0000000        
P   1
  1      1.5450000E-01          1.0000000        
D   1
  1      1.2540000E+00          1.0000000        
D   1
  1      4.1000000E-01          1.0000000        
F   1
  1      8.9000000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   18
  1      6.5581573E+06          8.89136538633E-06      
  2      9.8202534E+05          7.03002358623E-05      
  3      2.2346769E+05          3.62902184232E-04      
  4      6.3288291E+04          1.50621836298E-03      
  5      2.0642940E+04          5.37041885767E-03      
  6      7.4505224E+03          1.69805763033E-02      
  7      2.9050744E+03          4.78734714889E-02      
  8      1.2042100E+03          1.17941429507E-01      
  9      5.2430454E+02          2.39044728991E-01      
 10      2.3746563E+02          3.49813448075E-01      
 11      1.1057866E+02          2.84132863229E-01      
 12      5.1374624E+01          7.79526867990E-02      
 13      2.4440846E+01          7.11168134324E-04      
 14      1.1768591E+01          1.52425366095E-03      
 15      5.3421190E+00         -7.13594564654E-04      
 16      2.4950360E+00          2.94715007475E-04      
 17      1.0987730E+00         -1.23266735342E-04      
 18      2.6018000E-01          4.85655314857E-05      
S   18
  1      6.5581573E+06         -2.81636696584E-06      
  2      9.8202534E+05         -2.22656350565E-05      
  3      2.2346769E+05         -1.15047055231E-04      
  4      6.3288291E+04         -4.77925834075E-04      
  5      2.0642940E+04         -1.71174445504E-03      
  6      7.4505224E+03         -5.45904784181E-03      
  7      2.9050744E+03         -1.57564549640E-02      
  8      1.2042100E+03         -4.07555660816E-02      
  9      5.2430454E+02         -9.20657630787E-02      
 10      2.3746563E+02         -1.66871543250E-01      
 11      1.1057866E+02         -1.92267802042E-01      
 12      5.1374624E+01          3.11719510490E-02      
 13      2.4440846E+01          5.06627143401E-01      
 14      1.1768591E+01          5.12296210628E-01      
 15      5.3421190E+00          1.01367417928E-01      
 16      2.4950360E+00         -5.19515282036E-04      
 17      1.0987730E+00          1.95156288220E-03      
 18      2.6018000E-01         -4.12828798181E-04      
S   18
  1      6.5581573E+06          1.07773465753E-06      
  2      9.8202534E+05          8.52380093158E-06      
  3      2.2346769E+05          4.40212176721E-05      
  4      6.3288291E+04          1.83041004125E-04      
  5      2.0642940E+04          6.55271499263E-04      
  6      7.4505224E+03          2.09476109009E-03      
  7      2.9050744E+03          6.05431580024E-03      
  8      1.2042100E+03          1.57892976483E-02      
  9      5.2430454E+02          3.60760799698E-02      
 10      2.3746563E+02          6.75806612608E-02      
 11      1.1057866E+02          8.15642871375E-02      
 12      5.1374624E+01         -1.48337315478E-02      
 13      2.4440846E+01         -3.14070093832E-01      
 14      1.1768591E+01         -4.70569407547E-01      
 15      5.3421190E+00          1.20634827128E-01      
 16      2.4950360E+00          7.33545029457E-01      
 17      1.0987730E+00          4.04727225787E-01      
 18      2.6018000E-01          1.69394811440E-02      
S   18
  1      6.5581573E+06         -2.52620888752E-07      
  2      9.8202534E+05         -1.99943913344E-06      
  3      2.2346769E+05         -1.03152928083E-05      
  4      6.3288291E+04         -4.29530870368E-05      
  5      2.0642940E+04         -1.53499095238E-04      
  6      7.4505224E+03         -4.91895162533E-04      
  7      2.9050744E+03         -1.41824118249E-03      
  8      1.2042100E+03         -3.71473356977E-03      
  9      5.2430454E+02         -8.46512083582E-03      
 10      2.3746563E+02         -1.60210261669E-02      
 11      1.1057866E+02         -1.92478395231E-02      
 12      5.1374624E+01          3.20134582527E-03      
 13      2.4440846E+01          7.96096984793E-02      
 14      1.1768591E+01          1.22532892996E-01      
 15      5.3421190E+00         -3.71713546905E-02      
 16      2.4950360E+00         -2.62289044527E-01      
 17      1.0987730E+00         -2.68298837840E-01      
 18      2.6018000E-01          3.44844714243E-01      
S   1
  1      1.2707900E-01          1.0000000        
S   1
  1      5.4408000E-02          1.0000000        
P   11
  1      8.0501674E+03          3.60727420555E-04      
  2      1.9075361E+03          2.98254474555E-03      
  3      6.1862746E+02          1.58283291847E-02      
  4      2.3532417E+02          6.15707021829E-02      
  5      9.8899646E+01          1.75352491867E-01      
  6      4.4248215E+01          3.41231856709E-01      
  7      2.0617429E+01          3.85746795637E-01      
  8      9.7805160E+00          1.79882676722E-01      
  9      4.4412380E+00          2.07710803183E-02      
 10      1.9640450E+00          8.19679624061E-04      
 11      8.3357800E-01         -1.71289567207E-04      
P   11
  1      8.0501674E+03         -1.37659950328E-04      
  2      1.9075361E+03         -1.13826782495E-03      
  3      6.1862746E+02         -6.11436525406E-03      
  4      2.3532417E+02         -2.41915735551E-02      
  5      9.8899646E+01         -7.19395376633E-02      
  6      4.4248215E+01         -1.46953556729E-01      
  7      2.0617429E+01         -1.74392617060E-01      
  8      9.7805160E+00          4.26231650783E-02      
  9      4.4412380E+00          4.27362340494E-01      
 10      1.9640450E+00          4.91533337004E-01      
 11      8.3357800E-01          1.75205348023E-01      
P   11
  1      8.0501674E+03          2.27959825085E-05      
  2      1.9075361E+03          1.83085644281E-04      
  3      6.1862746E+02          1.01526572039E-03      
  4      2.3532417E+02          3.89447680328E-03      
  5      9.8899646E+01          1.20760799667E-02      
  6      4.4248215E+01          2.35618516938E-02      
  7      2.0617429E+01          3.09677658785E-02      
  8      9.7805160E+00         -1.49071599019E-02      
  9      4.4412380E+00         -7.37737821112E-02      
 10      1.9640450E+00         -1.26371275866E-01      
 11      8.3357800E-01          2.02377750357E-02      
P   1
  1      1.9344500E-01          1.0000000        
P   1
  1      5.6117000E-02          1.0000000        
D   7
  1      2.4414741E+02          2.05165315642E-03      
  2      7.3067595E+01          1.64840692181E-02      
  3      2.7592081E+01          6.99279003196E-02      
  4      1.1546518E+01          1.89733436759E-01      
  5      5.0486280E+00          3.23814971397E-01      
  6      2.1784650E+00          3.66632949984E-01      
  7      9.0025300E-01          2.77252320558E-01      
D   1
  1      3.3732700E-01          1.0000000        
D   1
  1      1.1690000E-01          1.0000000        
F   1
  1      2.8810000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   18
  1      7.4479668E+06          8.24159366150E-06      
  2      1.1153182E+06          6.55059902603E-05      
  3      2.5384265E+05          3.37704308032E-04      
  4      7.1915285E+04          1.39980349660E-03      
  5      2.3470181E+04          4.98339797195E-03      
  6      8.4774918E+03          1.57461288525E-02      
  7      3.3083908E+03          4.44471205585E-02      
  8      1.3726054E+03          1.10157494411E-01      
  9      5.9822007E+02          2.26515945529E-01      
 10      2.7138602E+02          3.42311118886E-01      
 11      1.2697795E+02          2.96742804078E-01      
 12      6.0222065E+01          9.49991466990E-02      
 13      2.8018582E+01          3.89221649670E-03      
 14      1.3517522E+01          9.76077226159E-04      
 15      6.3094060E+00         -4.60560462090E-04      
 16      2.9045340E+00          1.68789205384E-04      
 17      1.2875560E+00         -8.59157143298E-05      
 18      1.6773200E-01         -2.54008257666E-05      
S   18
  1      7.4479668E+06         -2.62369420951E-06      
  2      1.1153182E+06         -2.08453285517E-05      
  3      2.5384265E+05         -1.07610402010E-04      
  4      7.1915285E+04         -4.46157999640E-04      
  5      2.3470181E+04         -1.59642004874E-03      
  6      8.4774918E+03         -5.08023083947E-03      
  7      3.3083908E+03         -1.46785884162E-02      
  8      1.3726054E+03         -3.80218890959E-02      
  9      5.9822007E+02         -8.67418011857E-02      
 10      2.7138602E+02         -1.59677057080E-01      
 11      1.2697795E+02         -1.96221839493E-01      
 12      6.0222065E+01         -4.91999977526E-03      
 13      2.8018582E+01          4.72226211481E-01      
 14      1.3517522E+01          5.40029872895E-01      
 15      6.3094060E+00          1.27933584586E-01      
 16      2.9045340E+00          1.90822824454E-03      
 17      1.2875560E+00          1.88571058898E-03      
 18      1.6773200E-01          2.80225010543E-04      
S   18
  1      7.4479668E+06          1.01461948054E-06      
  2      1.1153182E+06          8.06182962048E-06      
  3      2.5384265E+05          4.16170415554E-05      
  4      7.1915285E+04          1.72595762069E-04      
  5      2.3470181E+04          6.17767937877E-04      
  6      8.4774918E+03          1.96849584831E-03      
  7      3.3083908E+03          5.70169905846E-03      
  8      1.3726054E+03          1.48630076063E-02      
  9      5.9822007E+02          3.43395479123E-02      
 10      2.7138602E+02          6.50383973485E-02      
 11      1.2697795E+02          8.39837211801E-02      
 12      6.0222065E+01          1.55432844308E-03      
 13      2.8018582E+01         -2.86629667355E-01      
 14      1.3517522E+01         -4.90496321720E-01      
 15      6.3094060E+00          4.45017838030E-02      
 16      2.9045340E+00          7.31368536484E-01      
 17      1.2875560E+00          4.53738674205E-01      
 18      1.6773200E-01         -7.97571670110E-03      
S   18
  1      7.4479668E+06         -2.62024023820E-07      
  2      1.1153182E+06         -2.08324599458E-06      
  3      2.5384265E+05         -1.07446913816E-05      
  4      7.1915285E+04         -4.46154097586E-05      
  5      2.3470181E+04         -1.59455263015E-04      
  6      8.4774918E+03         -5.09157908562E-04      
  7      3.3083908E+03         -1.47180589779E-03      
  8      1.3726054E+03         -3.85124369716E-03      
  9      5.9822007E+02         -8.88021788243E-03      
 10      2.7138602E+02         -1.69744362038E-02      
 11      1.2697795E+02         -2.18663437935E-02      
 12      6.0222065E+01         -7.35606086144E-04      
 13      2.8018582E+01          7.98234183849E-02      
 14      1.3517522E+01          1.41311078883E-01      
 15      6.3094060E+00         -1.66478117455E-02      
 16      2.9045340E+00         -2.86218456364E-01      
 17      1.2875560E+00         -3.23028562114E-01      
 18      1.6773200E-01          6.00952383974E-01      
S   1
  1      3.3655200E-01          1.0000000        
S   1
  1      7.1069000E-02          1.0000000        
P   11
  1      6.9795982E+03          5.19107496768E-04      
  2      1.6541648E+03          4.26130376276E-03      
  3      5.3602865E+02          2.22760894256E-02      
  4      2.0353713E+02          8.38951095832E-02      
  5      8.5237530E+01          2.24407749739E-01      
  6      3.7841962E+01          3.89499302849E-01      
  7      1.7406512E+01          3.50692932245E-01      
  8      7.8814920E+00          1.03789276238E-01      
  9      3.5332130E+00          3.10593555624E-03      
 10      1.5214730E+00          1.47295898398E-03      
 11      1.9909300E-01         -5.18758030406E-05      
P   11
  1      6.9795982E+03         -2.00632884272E-04      
  2      1.6541648E+03         -1.65790812644E-03      
  3      5.3602865E+02         -8.73750252631E-03      
  4      2.0353713E+02         -3.38592723890E-02      
  5      8.5237530E+01         -9.43405193615E-02      
  6      3.7841962E+01         -1.75337085408E-01      
  7      1.7406512E+01         -1.42047685057E-01      
  8      7.8814920E+00          1.93369657014E-01      
  9      3.5332130E+00          5.27509064317E-01      
 10      1.5214730E+00          3.90682931723E-01      
 11      1.9909300E-01         -2.98277404113E-03      
P   11
  1      6.9795982E+03          3.93994097066E-05      
  2      1.6541648E+03          3.24058412326E-04      
  3      5.3602865E+02          1.71914888124E-03      
  4      2.0353713E+02          6.64161952276E-03      
  5      8.5237530E+01          1.87254292882E-02      
  6      3.7841962E+01          3.47299037765E-02      
  7      1.7406512E+01          2.83285262596E-02      
  8      7.8814920E+00         -4.85363283658E-02      
  9      3.5332130E+00         -1.24451844042E-01      
 10      1.5214730E+00         -1.17991304737E-01      
 11      1.9909300E-01          5.53503320729E-01      
P   1
  1      5.6270400E-01          1.0000000        
P   1
  1      6.7031000E-02          1.0000000        
D   7
  1      2.8223911E+02          1.85508727607E-03      
  2      8.4549957E+01          1.51578176600E-02      
  3      3.2073656E+01          6.56680954303E-02      
  4      1.3497495E+01          1.82625923975E-01      
  5      5.9585500E+00          3.21192209751E-01      
  6      2.6107880E+00          3.71658282901E-01      
  7      1.1039870E+00          2.77965081126E-01      
D   1
  1      4.2404900E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      3.4580000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: As
data:
ARSENIC
S   18
  1      8.4823396E+06          7.59993679770E-06      
  2      1.2701509E+06          6.07160492243E-05      
  3      2.8905696E+05          3.12735993699E-04      
  4      8.1879849E+04          1.29566537082E-03      
  5      2.6716564E+04          4.61152010682E-03      
  6      9.6475842E+03          1.45821057162E-02      
  7      3.7641195E+03          4.12609696624E-02      
  8      1.5615656E+03          1.02906588254E-01      
  9      6.8081467E+02          2.14494734042E-01      
 10      3.0924119E+02          3.33814742190E-01      
 11      1.4525736E+02          3.07448410656E-01      
 12      6.9739048E+01          1.13170055254E-01      
 13      3.1770325E+01          7.53709136678E-03      
 14      1.5391757E+01          3.11855393937E-04      
 15      7.3415260E+00         -1.47977558834E-04      
 16      3.3237160E+00          2.26520646141E-05      
 17      1.4858670E+00         -3.47837568672E-05      
 18      2.1150000E-01         -9.44615399951E-06      
S   18
  1      8.4823396E+06         -2.43115450680E-06      
  2      1.2701509E+06         -1.94100958447E-05      
  3      2.8905696E+05         -1.00145841882E-04      
  4      8.1879849E+04         -4.14786020618E-04      
  5      2.6716564E+04         -1.48438896448E-03      
  6      9.6475842E+03         -4.72132748802E-03      
  7      3.7641195E+03         -1.36699521710E-02      
  8      1.5615656E+03         -3.54899269789E-02      
  9      6.8081467E+02         -8.16977323584E-02      
 10      3.0924119E+02         -1.52587256445E-01      
 11      1.4525736E+02         -1.97994548502E-01      
 12      6.9739048E+01         -3.49500270627E-02      
 13      3.1770325E+01          4.37124508701E-01      
 14      1.5391757E+01          5.59200502748E-01      
 15      7.3415260E+00          1.55716300028E-01      
 16      3.3237160E+00          5.02097219067E-03      
 17      1.4858670E+00          1.66570762793E-03      
 18      2.1150000E-01          2.16936671960E-04      
S   18
  1      8.4823396E+06          9.50135080898E-07      
  2      1.2701509E+06          7.58418919555E-06      
  3      2.8905696E+05          3.91460944510E-05      
  4      8.1879849E+04          1.62089812482E-04      
  5      2.6716564E+04          5.80660482115E-04      
  6      9.6475842E+03          1.84753896032E-03      
  7      3.7641195E+03          5.36776823062E-03      
  8      1.5615656E+03          1.40005150957E-02      
  9      6.8081467E+02          3.26753793416E-02      
 10      3.0924119E+02          6.25341109853E-02      
 11      1.4525736E+02          8.54563702635E-02      
 12      6.9739048E+01          1.51625084402E-02      
 13      3.1770325E+01         -2.61383716305E-01      
 14      1.5391757E+01         -5.01773098699E-01      
 15      7.3415260E+00         -1.97358597805E-02      
 16      3.3237160E+00          7.22980393125E-01      
 17      1.4858670E+00          4.93777863590E-01      
 18      2.1150000E-01         -8.77406270177E-03      
S   18
  1      8.4823396E+06         -2.63654991328E-07      
  2      1.2701509E+06         -2.10568127051E-06      
  3      2.8905696E+05         -1.08602784184E-05      
  4      8.1879849E+04         -4.50162309755E-05      
  5      2.6716564E+04         -1.61059113490E-04      
  6      9.6475842E+03         -5.13389221986E-04      
  7      3.7641195E+03         -1.48906364168E-03      
  8      1.5615656E+03         -3.89700518327E-03      
  9      6.8081467E+02         -9.08147408984E-03      
 10      3.0924119E+02         -1.75260439848E-02      
 11      1.4525736E+02         -2.39306805742E-02      
 12      6.9739048E+01         -4.59658729995E-03      
 13      3.1770325E+01          7.80640951029E-02      
 14      1.5391757E+01          1.55724879418E-01      
 15      7.3415260E+00          4.15812610281E-03      
 16      3.3237160E+00         -3.03581350610E-01      
 17      1.4858670E+00         -3.70779919681E-01      
 18      2.1150000E-01          6.30880604286E-01      
S   1
  1      4.2108600E-01          1.0000000        
S   1
  1      8.8974000E-02          1.0000000        
P   11
  1      7.4238614E+03          5.26734719679E-04      
  2      1.7595166E+03          4.31036209161E-03      
  3      5.7022916E+02          2.24998947225E-02      
  4      2.1657997E+02          8.46434897004E-02      
  5      9.0734252E+01          2.26085278206E-01      
  6      4.0308791E+01          3.90890712292E-01      
  7      1.8555502E+01          3.48444155058E-01      
  8      8.3965430E+00          1.01416247358E-01      
  9      3.7673670E+00          2.75525733395E-03      
 10      1.6297010E+00          1.35612903721E-03      
 11      2.2250300E-01          2.82174906789E-05      
P   11
  1      7.4238614E+03         -2.06647209621E-04      
  2      1.7595166E+03         -1.70268760193E-03      
  3      5.7022916E+02         -8.96021460920E-03      
  4      2.1657997E+02         -3.47034248280E-02      
  5      9.0734252E+01         -9.65830485563E-02      
  6      4.0308791E+01         -1.79034113090E-01      
  7      1.8555502E+01         -1.41338229173E-01      
  8      8.3965430E+00          2.04261099102E-01      
  9      3.7673670E+00          5.37739358051E-01      
 10      1.6297010E+00          3.78666609817E-01      
 11      2.2250300E-01         -4.66409092463E-03      
P   11
  1      7.4238614E+03          4.56164981479E-05      
  2      1.7595166E+03          3.76743420788E-04      
  3      5.7022916E+02          1.98115087507E-03      
  4      2.1657997E+02          7.71310499043E-03      
  5      9.0734252E+01          2.15229851406E-02      
  6      4.0308791E+01          4.04023617129E-02      
  7      1.8555502E+01          3.08202422453E-02      
  8      8.3965430E+00         -5.61820204747E-02      
  9      3.7673670E+00         -1.51100059459E-01      
 10      1.6297010E+00         -1.18991684601E-01      
 11      2.2250300E-01          5.48705107968E-01      
P   1
  1      5.6826300E-01          1.0000000        
P   1
  1      8.0405000E-02          1.0000000        
D   7
  1      3.2101961E+02          1.71431467309E-03      
  2      9.6249305E+01          1.41859799207E-02      
  3      3.6644963E+01          6.25150764414E-02      
  4      1.5493965E+01          1.77259393536E-01      
  5      6.8911380E+00          3.19357012856E-01      
  6      3.0548310E+00          3.75986991259E-01      
  7      1.3142410E+00          2.77795401639E-01      
D   1
  1      5.1343000E-01          1.0000000        
D   1
  1      1.8770000E-01          1.0000000        
F   1
  1      4.1580000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Se
data:
SELENIUM
S   18
  1      9.5636000E+06          7.06695949923E-06      
  2      1.4321000E+06          5.68536778618E-05      
  3      3.2591000E+05          2.92571390678E-04      
  4      9.2312000E+04          1.21138719572E-03      
  5      3.0116000E+04          4.30982802341E-03      
  6      1.0872000E+04          1.36370820611E-02      
  7      4.2401000E+03          3.86711694425E-02      
  8      1.7584000E+03          9.69701063057E-02      
  9      7.6659000E+02          2.04419534835E-01      
 10      3.4843000E+02          3.25871487243E-01      
 11      1.6403000E+02          3.15520457009E-01      
 12      7.9142000E+01          1.29395699793E-01      
 13      3.5524000E+01          1.09949761495E-02      
 14      1.7305000E+01         -3.17594513680E-04      
 15      8.3784000E+00          1.48515909050E-04      
 16      3.7405000E+00         -1.10738100851E-04      
 17      1.6890000E+00          1.81309025254E-05      
 18      2.5520000E-01          6.94635707678E-06      
S   18
  1      9.5636000E+06         -2.27123085977E-06      
  2      1.4321000E+06         -1.82575769290E-05      
  3      3.2591000E+05         -9.41313784004E-05      
  4      9.2312000E+04         -3.89506228379E-04      
  5      3.0116000E+04         -1.39365663574E-03      
  6      1.0872000E+04         -4.43170255107E-03      
  7      4.2401000E+03         -1.28534301313E-02      
  8      1.7584000E+03         -3.34483592850E-02      
  9      7.6659000E+02         -7.75594764097E-02      
 10      3.4843000E+02         -1.46673067803E-01      
 11      1.6403000E+02         -1.98366462809E-01      
 12      7.9142000E+01         -5.74377276546E-02      
 13      3.5524000E+01          4.06112720779E-01      
 14      1.7305000E+01          5.70488427986E-01      
 15      8.3784000E+00          1.81254891232E-01      
 16      3.7405000E+00          8.23248408934E-03      
 17      1.6890000E+00          1.35453493501E-03      
 18      2.5520000E-01          1.34332900972E-04      
S   18
  1      9.5636000E+06          8.96858323321E-07      
  2      1.4321000E+06          7.20634824461E-06      
  3      3.2591000E+05          3.71811532403E-05      
  4      9.2312000E+04          1.53739170144E-04      
  5      3.0116000E+04          5.50945345433E-04      
  6      1.0872000E+04          1.75125846571E-03      
  7      4.2401000E+03          5.10069648186E-03      
  8      1.7584000E+03          1.33172640367E-02      
  9      7.6659000E+02          3.13337007194E-02      
 10      3.4843000E+02          6.05248972192E-02      
 11      1.6403000E+02          8.63267259013E-02      
 12      7.9142000E+01          2.54383706563E-02      
 13      3.5524000E+01         -2.40881003420E-01      
 14      1.7305000E+01         -5.07015604922E-01      
 15      8.3784000E+00         -7.03262451365E-02      
 16      3.7405000E+00          7.12704123866E-01      
 17      1.6890000E+00          5.24015336626E-01      
 18      2.5520000E-01         -9.05864570440E-03      
S   18
  1      9.5636000E+06         -2.63310961848E-07      
  2      1.4321000E+06         -2.11688048986E-06      
  3      3.2591000E+05         -1.09136353086E-05      
  4      9.2312000E+04         -4.51749030900E-05      
  5      3.0116000E+04         -1.61682852582E-04      
  6      1.0872000E+04         -5.14877306266E-04      
  7      4.2401000E+03         -1.49705471087E-03      
  8      1.7584000E+03         -3.92191160228E-03      
  9      7.6659000E+02         -9.21347150813E-03      
 10      3.4843000E+02         -1.79453021843E-02      
 11      1.6403000E+02         -2.55798543965E-02      
 12      7.9142000E+01         -7.94137343696E-03      
 13      3.5524000E+01          7.61265452868E-02      
 14      1.7305000E+01          1.66596607839E-01      
 15      8.3784000E+00          2.31694240527E-02      
 16      3.7405000E+00         -3.18219621983E-01      
 17      1.6890000E+00         -4.10917284238E-01      
 18      2.5520000E-01          6.58001936049E-01      
S   1
  1      5.0927000E-01          1.0000000        
S   1
  1      1.0651000E-01          1.0000000        
P   11
  1      8.0043000E+03          5.20694497829E-04      
  2      1.8969000E+03          4.25014411020E-03      
  3      6.1471000E+02          2.21854777543E-02      
  4      2.3350000E+02          8.36158931585E-02      
  5      9.7856000E+01          2.24168024119E-01      
  6      4.3514000E+01          3.89536971318E-01      
  7      2.0063000E+01          3.49799668686E-01      
  8      9.1127000E+00          1.03572755250E-01      
  9      4.1063000E+00          3.03195197667E-03      
 10      1.7949000E+00          1.27627685366E-03      
 11      2.4615000E-01          9.18031719460E-06      
P   11
  1      8.0043000E+03         -2.07291202897E-04      
  2      1.8969000E+03         -1.70322458366E-03      
  3      6.1471000E+02         -8.96557904563E-03      
  4      2.3350000E+02         -3.47771892410E-02      
  5      9.7856000E+01         -9.72041327725E-02      
  6      4.3514000E+01         -1.81048133920E-01      
  7      2.0063000E+01         -1.44535803368E-01      
  8      9.1127000E+00          2.03158870724E-01      
  9      4.1063000E+00          5.42048325320E-01      
 10      1.7949000E+00          3.76125985371E-01      
 11      2.4615000E-01         -4.45179087332E-03      
P   11
  1      8.0043000E+03          4.98975056824E-05      
  2      1.8969000E+03          4.12236806784E-04      
  3      6.1471000E+02          2.16140121630E-03      
  4      2.3350000E+02          8.45943972174E-03      
  5      9.7856000E+01          2.36132769859E-02      
  6      4.3514000E+01          4.48405857819E-02      
  7      2.0063000E+01          3.39909066998E-02      
  8      9.1127000E+00         -6.06879304099E-02      
  9      4.1063000E+00         -1.71685990403E-01      
 10      1.7949000E+00         -1.23731070524E-01      
 11      2.4615000E-01          5.67369606801E-01      
P   1
  1      6.2432000E-01          1.0000000        
P   1
  1      8.8917000E-02          1.0000000        
D   7
  1      3.6185000E+02          1.59797131863E-03      
  2      1.0855000E+02          1.33730453559E-02      
  3      4.1433000E+01          5.98917661938E-02      
  4      1.7579000E+01          1.72837112160E-01      
  5      7.8627000E+00          3.17926202447E-01      
  6      3.5180000E+00          3.79744118641E-01      
  7      1.5348000E+00          2.77260386528E-01      
D   1
  1      6.0813000E-01          1.0000000        
D   1
  1      2.2200000E-01          1.0000000        
F   1
  1      4.6200000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Br
data:
BROMINE
S   18
  1      1.0639000E+07          6.68584325793E-06      
  2      1.5934000E+06          5.40292136515E-05      
  3      3.6261000E+05          2.77746919618E-04      
  4      1.0270000E+05          1.14913220897E-03      
  5      3.3501000E+04          4.08557629785E-03      
  6      1.2093000E+04          1.29260373338E-02      
  7      4.7159000E+03          3.66945403250E-02      
  8      1.9556000E+03          9.23576206864E-02      
  9      8.5261000E+02          1.96392101030E-01      
 10      3.8767000E+02          3.19044697901E-01      
 11      1.8268000E+02          3.21356960358E-01      
 12      8.8245000E+01          1.42747011338E-01      
 13      3.9263000E+01          1.40420366943E-02      
 14      1.9234000E+01         -8.49325053860E-04      
 15      9.4057000E+00          3.98540773594E-04      
 16      4.1601000E+00         -2.22035023426E-04      
 17      1.8995000E+00          6.69545063208E-05      
 18      3.0114000E-01          2.11180922561E-05      
S   18
  1      1.0639000E+07         -2.15847130216E-06      
  2      1.5934000E+06         -1.74277705729E-05      
  3      3.6261000E+05         -8.97684072370E-05      
  4      1.0270000E+05         -3.71102886400E-04      
  5      3.3501000E+04         -1.32700727778E-03      
  6      1.2093000E+04         -4.21691840968E-03      
  7      4.7159000E+03         -1.22375742107E-02      
  8      1.9556000E+03         -3.18948682028E-02      
  9      8.5261000E+02         -7.43461279735E-02      
 10      3.8767000E+02         -1.42052926205E-01      
 11      1.8268000E+02         -1.98107709399E-01      
 12      8.8245000E+01         -7.39391686541E-02      
 13      3.9263000E+01          3.80120556595E-01      
 14      1.9234000E+01          5.76790589300E-01      
 15      9.4057000E+00          2.03436015698E-01      
 16      4.1601000E+00          1.12521634395E-02      
 17      1.8995000E+00          1.01846094213E-03      
 18      3.0114000E-01          5.27720580935E-05      
S   18
  1      1.0639000E+07          8.60883178294E-07      
  2      1.5934000E+06          6.94672999845E-06      
  3      3.6261000E+05          3.58160139538E-05      
  4      1.0270000E+05          1.47909044150E-04      
  5      3.3501000E+04          5.29935928954E-04      
  6      1.2093000E+04          1.68245161920E-03      
  7      4.7159000E+03          4.90574352767E-03      
  8      1.9556000E+03          1.28158568744E-02      
  9      8.5261000E+02          3.03291747771E-02      
 10      3.8767000E+02          5.90582619932E-02      
 11      1.8268000E+02          8.69193964193E-02      
 12      8.8245000E+01          3.31355261971E-02      
 13      3.9263000E+01         -2.24813204404E-01      
 14      1.9234000E+01         -5.09220864500E-01      
 15      9.4057000E+00         -1.10466667310E-01      
 16      4.1601000E+00          7.02100257109E-01      
 17      1.8995000E+00          5.47437877047E-01      
 18      3.0114000E-01         -8.96199801408E-03      
S   18
  1      1.0639000E+07         -2.64550367052E-07      
  2      1.5934000E+06         -2.13591881121E-06      
  3      3.6261000E+05         -1.10037761180E-05      
  4      1.0270000E+05         -4.54917989934E-05      
  5      3.3501000E+04         -1.62777504417E-04      
  6      1.2093000E+04         -5.17755616718E-04      
  7      4.7159000E+03         -1.50703985259E-03      
  8      1.9556000E+03         -3.95057009607E-03      
  9      8.5261000E+02         -9.33418143534E-03      
 10      3.8767000E+02         -1.83274142369E-02      
 11      1.8268000E+02         -2.69608176440E-02      
 12      8.8245000E+01         -1.07294703754E-02      
 13      3.9263000E+01          7.44228899512E-02      
 14      1.9234000E+01          1.75246104764E-01      
 15      9.4057000E+00          3.99165271075E-02      
 16      4.1601000E+00         -3.30333391956E-01      
 17      1.8995000E+00         -4.45942135198E-01      
 18      3.0114000E-01          6.80853847030E-01      
S   1
  1      6.0472000E-01          1.0000000        
S   1
  1      1.2515000E-01          1.0000000        
P   11
  1      8.6765000E+03          5.08651027529E-04      
  2      2.0559000E+03          4.14089535806E-03      
  3      6.6623000E+02          2.16243486388E-02      
  4      2.5310000E+02          8.17404645819E-02      
  5      1.0612000E+02          2.20438612663E-01      
  6      4.7242000E+01          3.86724399658E-01      
  7      2.1825000E+01          3.52893755114E-01      
  8      9.9684000E+00          1.08069657736E-01      
  9      4.5171000E+00          3.64318560564E-03      
 10      1.9982000E+00          1.22509067196E-03      
 11      2.8145000E-01         -1.61487310758E-05      
P   11
  1      8.6765000E+03         -2.05367485783E-04      
  2      2.0559000E+03         -1.68217789082E-03      
  3      6.6623000E+02         -8.86206137580E-03      
  4      2.5310000E+02         -3.44513670422E-02      
  5      1.0612000E+02         -9.69247241460E-02      
  6      4.7242000E+01         -1.82090466585E-01      
  7      2.1825000E+01         -1.49673698873E-01      
  8      9.9684000E+00          1.95854053551E-01      
  9      4.5171000E+00          5.43432134334E-01      
 10      1.9982000E+00          3.79209803195E-01      
 11      2.8145000E-01         -4.02689750026E-03      
P   11
  1      8.6765000E+03          5.29179905719E-05      
  2      2.0559000E+03          4.36295644577E-04      
  3      6.6623000E+02          2.28699347329E-03      
  4      2.5310000E+02          8.98269178100E-03      
  5      1.0612000E+02          2.52091536985E-02      
  6      4.7242000E+01          4.84043234637E-02      
  7      2.1825000E+01          3.76492642071E-02      
  8      9.9684000E+00         -6.30409186639E-02      
  9      4.5171000E+00         -1.87886256748E-01      
 10      1.9982000E+00         -1.31874246682E-01      
 11      2.8145000E-01          5.72338416868E-01      
P   1
  1      7.0988000E-01          1.0000000        
P   1
  1      1.0204000E-01          1.0000000        
D   7
  1      4.0383000E+02          1.50803641693E-03      
  2      1.2117000E+02          1.27377750932E-02      
  3      4.6345000E+01          5.78332530089E-02      
  4      1.9721000E+01          1.69367358226E-01      
  5      8.8624000E+00          3.16918323821E-01      
  6      3.9962000E+00          3.82953560193E-01      
  7      1.7636000E+00          2.76352995282E-01      
D   1
  1      7.0619000E-01          1.0000000        
D   1
  1      2.6390000E-01          1.0000000        
F   1
  1      5.5150000E-01          1.0000000


name: cc-pVTZ(fi/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   18
  1      1.1718113E+07          6.37415217057E-06      
  2      1.7546044E+06          5.19082187323E-05      
  3      3.9928132E+05          2.66577102660E-04      
  4      1.1308457E+05          1.10192575588E-03      
  5      3.6885925E+04          3.91507649191E-03      
  6      1.3312209E+04          1.23853668981E-02      
  7      5.1899883E+03          3.51918327096E-02      
  8      2.1516597E+03          8.88194986797E-02      
  9      9.3803251E+02          1.90113657072E-01      
 10      4.2655732E+02          3.13384326435E-01      
 11      2.0106660E+02          3.25494396143E-01      
 12      9.7097605E+01          1.53437235820E-01      
 13      4.2998724E+01          1.66587154930E-02      
 14      2.1177075E+01         -1.27466237121E-03      
 15      1.0426752E+01          5.97961423084E-04      
 16      4.5850080E+00         -3.12028222819E-04      
 17      2.1176030E+00          1.10116737652E-04      
 18      3.4922500E-01          3.26088817339E-05      
S   18
  1      1.1718113E+07         -2.06691624425E-06      
  2      1.7546044E+06         -1.68167941435E-05      
  3      3.9928132E+05         -8.65390538511E-05      
  4      1.1308457E+05         -3.57395621959E-04      
  5      3.6885925E+04         -1.27713266218E-03      
  6      1.3312209E+04         -4.05653565482E-03      
  7      5.1899883E+03         -1.17774051754E-02      
  8      2.1516597E+03         -3.07312376446E-02      
  9      9.3803251E+02         -7.19048116177E-02      
 10      4.2655732E+02         -1.38515142785E-01      
 11      2.0106660E+02         -1.97620615084E-01      
 12      9.7097605E+01         -8.60958342111E-02      
 13      4.2998724E+01          3.58717649233E-01      
 14      2.1177075E+01          5.80035977324E-01      
 15      1.0426752E+01          2.22336379192E-01      
 16      4.5850080E+00          1.39804191816E-02      
 17      2.1176030E+00          6.92395521833E-04      
 18      3.4922500E-01         -1.80474262521E-05      
S   18
  1      1.1718113E+07          8.32290166663E-07      
  2      1.7546044E+06          6.76684894207E-06      
  3      3.9928132E+05          3.48610645743E-05      
  4      1.1308457E+05          1.43790005929E-04      
  5      3.6885925E+04          5.14972569571E-04      
  6      1.3312209E+04          1.63356808038E-03      
  7      5.1899883E+03          4.76713791345E-03      
  8      2.1516597E+03          1.24597839538E-02      
  9      9.3803251E+02          2.96093177302E-02      
 10      4.2655732E+02          5.80360609785E-02      
 11      2.0106660E+02          8.74107296070E-02      
 12      9.7097605E+01          3.89552485484E-02      
 13      4.2998724E+01         -2.12273448647E-01      
 14      2.1177075E+01         -5.10133413046E-01      
 15      1.0426752E+01         -1.42737632330E-01      
 16      4.5850080E+00          6.92469385918E-01      
 17      2.1176030E+00          5.65586740034E-01      
 18      3.4922500E-01         -8.59375847954E-03      
S   18
  1      1.1718113E+07         -2.65652462311E-07      
  2      1.7546044E+06         -2.16107439942E-06      
  3      3.9928132E+05         -1.11244721907E-05      
  4      1.1308457E+05         -4.59354882578E-05      
  5      3.6885925E+04         -1.64296200630E-04      
  6      1.3312209E+04         -5.22160232671E-04      
  7      5.1899883E+03         -1.52106512018E-03      
  8      2.1516597E+03         -3.98942458967E-03      
  9      9.3803251E+02         -9.46482128299E-03      
 10      4.2655732E+02         -1.87067041704E-02      
 11      2.0106660E+02         -2.81650047964E-02      
 12      9.7097605E+01         -1.30464741164E-02      
 13      4.2998724E+01          7.30724972008E-02      
 14      2.1177075E+01          1.82480471009E-01      
 15      1.0426752E+01          5.46442155112E-02      
 16      4.5850080E+00         -3.41001917018E-01      
 17      2.1176030E+00         -4.76728473642E-01      
 18      3.4922500E-01          7.00150809884E-01      
S   1
  1      7.0705700E-01          1.0000000        
S   1
  1      1.4482100E-01          1.0000000        
P   11
  1      9.3663090E+03          4.98910139880E-04      
  2      2.2195543E+03          4.04857033745E-03      
  3      7.1945288E+02          2.11299165811E-02      
  4      2.7346446E+02          8.00145505804E-02      
  5      1.1475225E+02          2.16841991233E-01      
  6      5.1155569E+01          3.83786936246E-01      
  7      2.3682676E+01          3.55721905196E-01      
  8      1.0875484E+01          1.12556399077E-01      
  9      4.9551310E+00          4.29075857337E-03      
 10      2.2172670E+00          1.17094485497E-03      
 11      3.2215400E-01         -2.63440447622E-05      
P   11
  1      9.3663090E+03         -2.04226838822E-04      
  2      2.2195543E+03         -1.66672937530E-03      
  3      7.1945288E+02         -8.77900608165E-03      
  4      2.7346446E+02         -3.41659245057E-02      
  5      1.1475225E+02         -9.66473265091E-02      
  6      5.1155569E+01         -1.83020309256E-01      
  7      2.3682676E+01         -1.54663915865E-01      
  8      1.0875484E+01          1.88583825769E-01      
  9      4.9551310E+00          5.44587534188E-01      
 10      2.2172670E+00          3.82624409659E-01      
 11      3.2215400E-01         -4.42799573022E-03      
P   11
  1      9.3663090E+03          5.52592928758E-05      
  2      2.2195543E+03          4.54212098098E-04      
  3      7.1945288E+02          2.37908263788E-03      
  4      2.7346446E+02          9.36242710433E-03      
  5      1.1475225E+02          2.64045853621E-02      
  6      5.1155569E+01          5.11861444672E-02      
  7      2.3682676E+01          4.08910493381E-02      
  8      1.0875484E+01         -6.43555340493E-02      
  9      4.9551310E+00         -2.01155322054E-01      
 10      2.2172670E+00         -1.39020651693E-01      
 11      3.2215400E-01          5.72468360155E-01      
P   1
  1      8.0641000E-01          1.0000000        
P   1
  1      1.1761900E-01          1.0000000        
D   7
  1      4.4616133E+02          1.44167503249E-03      
  2      1.3396477E+02          1.22545128796E-02      
  3      5.1345907E+01          5.62279044739E-02      
  4      2.1916906E+01          1.66551292664E-01      
  5      9.8937250E+00          3.16037182270E-01      
  6      4.4925270E+00          3.85631752146E-01      
  7      2.0022930E+00          2.75309835848E-01      
D   1
  1      8.0840900E-01          1.0000000        
D   1
  1      3.0060000E-01          1.0000000        
F   1
  1      6.6220000E-01          1.0000000        
$


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: H
data:
HYDROGEN
S   3
  1      3.3870000E+01          6.06858595771E-03      
  2      5.0950000E+00          4.53098965745E-02      
  3      1.1590000E+00          2.02826206672E-01      
S   1
  1      3.2580000E-01          1.0000000        
S   1
  1      1.0270000E-01          1.0000000        
P   1
  1      1.4070000E+00          1.0000000        
P   1
  1      3.8800000E-01          1.0000000        
D   1
  1      1.0570000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      2.3400000E+02          2.58822519272E-03      
  2      3.5160000E+01          1.95369509578E-02      
  3      7.9890000E+00          9.10073419405E-02      
  4      2.2120000E+00          2.72056506657E-01      
S   1
  1      6.6690000E-01          1.0000000        
S   1
  1      2.0890000E-01          1.0000000        
P   1
  1      3.0440000E+00          1.0000000        
P   1
  1      7.5800000E-01          1.0000000        
D   1
  1      1.9650000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: B
data:
BORON
S   8
  1      5.4730000E+03          5.56847577762E-04      
  2      8.2090000E+02          4.29915680360E-03      
  3      1.8680000E+02          2.19792140381E-02      
  4      5.2830000E+01          8.45083350809E-02      
  5      1.7080000E+01          2.38623471327E-01      
  6      5.9990000E+00          4.34998762575E-01      
  7      2.2080000E+00          3.41735888835E-01      
  8      2.4150000E-01         -9.53189494636E-03      
S   8
  1      5.4730000E+03         -1.12580135006E-04      
  2      8.2090000E+02         -8.70402331222E-04      
  3      1.8680000E+02         -4.49146964830E-03      
  4      5.2830000E+01         -1.77053623869E-02      
  5      1.7080000E+01         -5.36694108652E-02      
  6      5.9990000E+00         -1.19039284183E-01      
  7      2.2080000E+00         -1.65662351739E-01      
  8      2.4150000E-01          5.95993884939E-01      
S   1
  1      5.8790000E-01          1.0000000        
S   1
  1      8.6100000E-02          1.0000000        
P   3
  1      1.2050000E+01          1.31199691999E-02      
  2      2.6130000E+00          7.98844703602E-02      
  3      7.4750000E-01          2.77211667375E-01      
P   1
  1      2.3850000E-01          1.0000000        
P   1
  1      7.6980000E-02          1.0000000        
D   1
  1      6.6100000E-01          1.0000000        
D   1
  1      1.9900000E-01          1.0000000        
F   1
  1      4.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: C
data:
CARBON
S   8
  1      8.2360000E+03          5.33281971165E-04      
  2      1.2350000E+03          4.11950286828E-03      
  3      2.8080000E+02          2.11304632337E-02      
  4      7.9270000E+01          8.19540594771E-02      
  5      2.5590000E+01          2.34924585464E-01      
  6      8.9970000E+00          4.34340234750E-01      
  7      3.3190000E+00          3.45805524021E-01      
  8      3.6430000E-01         -8.96209382437E-03      
S   8
  1      8.2360000E+03         -1.13987795730E-04      
  2      1.2350000E+03         -8.83152060716E-04      
  3      2.8080000E+02         -4.56263664563E-03      
  4      7.9270000E+01         -1.82109874692E-02      
  5      2.5590000E+01         -5.59477859339E-02      
  6      8.9970000E+00         -1.27284991589E-01      
  7      3.3190000E+00         -1.70625425725E-01      
  8      3.6430000E-01          6.00776784439E-01      
S   1
  1      9.0590000E-01          1.0000000        
S   1
  1      1.2850000E-01          1.0000000        
P   3
  1      1.8710000E+01          1.39361092067E-02      
  2      4.1330000E+00          8.64105499654E-02      
  3      1.2000000E+00          2.87303137582E-01      
P   1
  1      3.8270000E-01          1.0000000        
P   1
  1      1.2090000E-01          1.0000000        
D   1
  1      1.0970000E+00          1.0000000        
D   1
  1      3.1800000E-01          1.0000000        
F   1
  1      7.6100000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: N
data:
NITROGEN
S   8
  1      1.1420000E+04          5.25694502755E-04      
  2      1.7120000E+03          4.06099871459E-03      
  3      3.8930000E+02          2.08339891736E-02      
  4      1.1000000E+02          8.08685334383E-02      
  5      3.5570000E+01          2.33231214185E-01      
  6      1.2540000E+01          4.33448713095E-01      
  7      4.6440000E+00          3.47027751142E-01      
  8      5.1180000E-01         -8.48168196755E-03      
S   8
  1      1.1420000E+04         -1.16472762969E-04      
  2      1.7120000E+03         -9.03186242451E-04      
  3      3.8930000E+02         -4.66233389534E-03      
  4      1.1000000E+02         -1.86654573423E-02      
  5      3.5570000E+01         -5.76941497503E-02      
  6      1.2540000E+01         -1.32848092866E-01      
  7      4.6440000E+00         -1.73194086054E-01      
  8      5.1180000E-01          6.03926096038E-01      
S   1
  1      1.2930000E+00          1.0000000        
S   1
  1      1.7870000E-01          1.0000000        
P   3
  1      2.6630000E+01          1.45411590456E-02      
  2      5.9480000E+00          9.11823683044E-02      
  3      1.7420000E+00          2.94410616457E-01      
P   1
  1      5.5500000E-01          1.0000000        
P   1
  1      1.7250000E-01          1.0000000        
D   1
  1      1.6540000E+00          1.0000000        
D   1
  1      4.6900000E-01          1.0000000        
F   1
  1      1.0930000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: O
data:
OXYGEN
S   8
  1      1.5330000E+04          5.11478003985E-04      
  2      2.2990000E+03          3.94955606368E-03      
  3      5.2240000E+02          2.03171576177E-02      
  4      1.4730000E+02          7.93585223466E-02      
  5      4.7550000E+01          2.30885718201E-01      
  6      1.6760000E+01          4.32962255933E-01      
  7      6.2070000E+00          3.49671623945E-01      
  8      6.8820000E-01         -8.12468179682E-03      
S   8
  1      1.5330000E+04         -1.16270378360E-04      
  2      2.2990000E+03         -9.01794314811E-04      
  3      5.2240000E+02         -4.66373809346E-03      
  4      1.4730000E+02         -1.88147240284E-02      
  5      4.7550000E+01         -5.86417849636E-02      
  6      1.6760000E+01         -1.36757297622E-01      
  7      6.2070000E+00         -1.75490965492E-01      
  8      6.8820000E-01          6.04381558307E-01      
S   1
  1      1.7520000E+00          1.0000000        
S   1
  1      2.3840000E-01          1.0000000        
P   3
  1      3.4460000E+01          1.59236007852E-02      
  2      7.7490000E+00          9.96609864402E-02      
  3      2.2800000E+00          3.09522318630E-01      
P   1
  1      7.1560000E-01          1.0000000        
P   1
  1      2.1400000E-01          1.0000000        
D   1
  1      2.3140000E+00          1.0000000        
D   1
  1      6.4500000E-01          1.0000000        
F   1
  1      1.4280000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: F
data:
FLUORINE
S   8
  1      1.9500000E+04          5.11467876609E-04      
  2      2.9230000E+03          3.94844441233E-03      
  3      6.6450000E+02          2.02938987765E-02      
  4      1.8750000E+02          7.92337655118E-02      
  5      6.0620000E+01          2.30690215197E-01      
  6      2.1420000E+01          4.32648011062E-01      
  7      7.9500000E+00          3.49213254124E-01      
  8      8.8150000E-01         -7.85490019562E-03      
S   8
  1      1.9500000E+04         -1.18499725528E-04      
  2      2.9230000E+03         -9.19450986313E-04      
  3      6.6450000E+02         -4.74729440777E-03      
  4      1.8750000E+02         -1.91769263120E-02      
  5      6.0620000E+01         -5.98028822153E-02      
  6      2.1420000E+01         -1.40177102060E-01      
  7      7.9500000E+00         -1.76107989506E-01      
  8      8.8150000E-01          6.05031232883E-01      
S   1
  1      2.2570000E+00          1.0000000        
S   1
  1      3.0410000E-01          1.0000000        
P   3
  1      4.3880000E+01          1.67000408865E-02      
  2      9.9260000E+00          1.04528503801E-01      
  3      2.9300000E+00          3.17193881124E-01      
P   1
  1      9.1320000E-01          1.0000000        
P   1
  1      2.6720000E-01          1.0000000        
D   1
  1      3.1070000E+00          1.0000000        
D   1
  1      8.5500000E-01          1.0000000        
F   1
  1      1.9170000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ne
data:
NEON
S   8
  1      2.4350000E+04          5.06857891128E-04      
  2      3.6500000E+03          3.91249891798E-03      
  3      8.2960000E+02          2.01126783990E-02      
  4      2.3400000E+02          7.86955350280E-02      
  5      7.5610000E+01          2.29991637401E-01      
  6      2.6730000E+01          4.32444870907E-01      
  7      9.9270000E+00          3.49709688410E-01      
  8      1.1020000E+00         -7.60032986872E-03      
S   8
  1      2.4350000E+04         -1.19184724592E-04      
  2      3.6500000E+03         -9.25072754775E-04      
  3      8.2960000E+02         -4.77457728570E-03      
  4      2.3400000E+02         -1.93485967530E-02      
  5      7.5610000E+01         -6.05595349286E-02      
  6      2.6730000E+01         -1.42720710562E-01      
  7      9.9270000E+00         -1.76851711883E-01      
  8      1.1020000E+00          6.05804557853E-01      
S   1
  1      2.8360000E+00          1.0000000        
S   1
  1      3.7820000E-01          1.0000000        
P   3
  1      5.4700000E+01          1.71989443496E-02      
  2      1.2430000E+01          1.07739955018E-01      
  3      3.6790000E+00          3.21608824364E-01      
P   1
  1      1.1430000E+00          1.0000000        
P   1
  1      3.3000000E-01          1.0000000        
D   1
  1      4.0140000E+00          1.0000000        
D   1
  1      1.0960000E+00          1.0000000        
F   1
  1      2.5440000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   13
  1      2.0550000E+05          6.93489817715E-05      
  2      3.0780000E+04          5.36586495078E-04      
  3      7.0060000E+03          2.80135446515E-03      
  4      1.9850000E+03          1.15977672548E-02      
  5      6.4910000E+02          4.01220129184E-02      
  6      2.3500000E+02          1.15542443636E-01      
  7      9.1620000E+01          2.61210295805E-01      
  8      3.7670000E+01          3.95671543301E-01      
  9      1.5910000E+01          2.83229195905E-01      
 10      5.8500000E+00          4.41132626591E-02      
 11      2.5420000E+00         -4.85113353866E-03      
 12      1.0570000E+00          2.58813765131E-03      
 13      1.4550000E-01          7.14693764362E-04      
S   13
  1      2.0550000E+05         -1.80822390701E-05      
  2      3.0780000E+04         -1.40162582317E-04      
  3      7.0060000E+03         -7.31752674513E-04      
  4      1.9850000E+03         -3.05588832407E-03      
  5      6.4910000E+02         -1.07203213709E-02      
  6      2.3500000E+02         -3.23976450863E-02      
  7      9.1620000E+01         -8.06512719987E-02      
  8      3.7670000E+01         -1.56929837213E-01      
  9      1.5910000E+01         -1.66785913388E-01      
 10      5.8500000E+00          1.29951980196E-01      
 11      2.5420000E+00          5.61985640649E-01      
 12      1.0570000E+00          4.33725555231E-01      
 13      1.4550000E-01         -1.10709594063E-02      
S   13
  1      2.0550000E+05          4.17599638798E-06      
  2      3.0780000E+04          3.23472616118E-05      
  3      7.0060000E+03          1.69082250721E-04      
  4      1.9850000E+03          7.05420232976E-04      
  5      6.4910000E+02          2.48250193428E-03      
  6      2.3500000E+02          7.50949816519E-03      
  7      9.1620000E+01          1.89007553166E-02      
  8      3.7670000E+01          3.73295606366E-02      
  9      1.5910000E+01          4.15093379874E-02      
 10      5.8500000E+00         -3.62246418572E-02      
 11      2.5420000E+00         -1.75946666070E-01      
 12      1.0570000E+00         -2.74768299859E-01      
 13      1.4550000E-01          6.52081475557E-01      
S   1
  1      2.9310000E-01          1.0000000        
S   1
  1      5.6500000E-02          1.0000000        
P   7
  1      4.4440000E+02          1.64938680671E-03      
  2      1.0510000E+02          1.31525615769E-02      
  3      3.3470000E+01          6.14134930962E-02      
  4      1.2330000E+01          1.88015013200E-01      
  5      4.8690000E+00          3.60274615720E-01      
  6      1.9610000E+00          4.07999010371E-01      
  7      1.8880000E-01          9.72385108256E-03      
P   7
  1      4.4440000E+02         -2.90017998929E-04      
  2      1.0510000E+02         -2.43660128091E-03      
  3      3.3470000E+01         -1.08904747734E-02      
  4      1.2330000E+01         -3.64265977175E-02      
  5      4.8690000E+00         -6.40031846011E-02      
  6      1.9610000E+00         -9.70445428227E-02      
  7      1.8880000E-01          5.02694782171E-01      
P   1
  1      7.8340000E-01          1.0000000        
P   1
  1      5.5570000E-02          1.0000000        
D   1
  1      3.3300000E-01          1.0000000        
D   1
  1      1.0900000E-01          1.0000000        
F   1
  1      2.4400000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Si
data:
SILICON
S   13
  1      2.5490000E+05          6.40907270449E-05      
  2      3.8190000E+04          4.95749587960E-04      
  3      8.6900000E+03          2.58779287987E-03      
  4      2.4620000E+03          1.07239216450E-02      
  5      8.0480000E+02          3.72140288130E-02      
  6      2.9130000E+02          1.08052509519E-01      
  7      1.1360000E+02          2.48357991181E-01      
  8      4.6750000E+01          3.90206536340E-01      
  9      1.9820000E+01          3.00417294593E-01      
 10      7.7080000E+00          5.54360762491E-02      
 11      3.3400000E+00         -3.97958935523E-03      
 12      1.4020000E+00          2.55225966822E-03      
 13      2.0700000E-01          6.00816229361E-04      
S   13
  1      2.5490000E+05         -1.71283912535E-05      
  2      3.8190000E+04         -1.32588778334E-04      
  3      8.6900000E+03         -6.93097348117E-04      
  4      2.4620000E+03         -2.89048935927E-03      
  5      8.0480000E+02         -1.01895212805E-02      
  6      2.9130000E+02         -3.08757079424E-02      
  7      1.1360000E+02         -7.81371396963E-02      
  8      4.6750000E+01         -1.54420176670E-01      
  9      1.9820000E+01         -1.78729953027E-01      
 10      7.7080000E+00          8.33561141292E-02      
 11      3.3400000E+00          5.48630426904E-01      
 12      1.4020000E+00          4.76680741024E-01      
 13      2.0700000E-01         -1.03327420189E-02      
S   13
  1      2.5490000E+05          4.39547756252E-06      
  2      3.8190000E+04          3.40039454774E-05      
  3      8.6900000E+03          1.77949113091E-04      
  4      2.4620000E+03          7.41521665379E-04      
  5      8.0480000E+02          2.62182748896E-03      
  6      2.9130000E+02          7.95505593227E-03      
  7      1.1360000E+02          2.03516289227E-02      
  8      4.6750000E+01          4.08638203652E-02      
  9      1.9820000E+01          4.95162158981E-02      
 10      7.7080000E+00         -2.60207177962E-02      
 11      3.3400000E+00         -1.91812212600E-01      
 12      1.4020000E+00         -3.17412547605E-01      
 13      2.0700000E-01          6.81679549745E-01      
S   1
  1      4.3870000E-01          1.0000000        
S   1
  1      7.9440000E-02          1.0000000        
P   7
  1      4.8150000E+02          1.94934474894E-03      
  2      1.1390000E+02          1.54680565130E-02      
  3      3.6230000E+01          7.16366241069E-02      
  4      1.3340000E+01          2.13223961472E-01      
  5      5.2520000E+00          3.90089160126E-01      
  6      2.1200000E+00          3.93107724279E-01      
  7      2.5280000E-01          3.99331558613E-03      
P   7
  1      4.8150000E+02         -4.08558364300E-04      
  2      1.1390000E+02         -3.36860378701E-03      
  3      3.6230000E+01         -1.52262567483E-02      
  4      1.3340000E+01         -4.87707694530E-02      
  5      5.2520000E+00         -8.45897883524E-02      
  6      2.1200000E+00         -1.12360115003E-01      
  7      2.5280000E-01          5.35326834748E-01      
P   1
  1      8.5610000E-01          1.0000000        
P   1
  1      7.8890000E-02          1.0000000        
D   1
  1      4.8100000E-01          1.0000000        
D   1
  1      1.5900000E-01          1.0000000        
F   1
  1      3.3600000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: P
data:
PHOSPHORUS
S   13
  1      3.1240000E+05          5.93871622734E-05      
  2      4.6800000E+04          4.59223322755E-04      
  3      1.0650000E+04          2.39520845783E-03      
  4      3.0180000E+03          9.92988319098E-03      
  5      9.8680000E+02          3.45133370797E-02      
  6      3.5740000E+02          1.00848052992E-01      
  7      1.3960000E+02          2.34902867637E-01      
  8      5.7630000E+01          3.81741494673E-01      
  9      2.4600000E+01          3.16245037740E-01      
 10      1.0120000E+01          7.00974221206E-02      
 11      4.2830000E+00         -1.79475111487E-03      
 12      1.8050000E+00          2.13470048855E-03      
 13      2.7820000E-01          4.26882452498E-04      
S   13
  1      3.1240000E+05         -1.62081030636E-05      
  2      4.6800000E+04         -1.25305833392E-04      
  3      1.0650000E+04         -6.55344681413E-04      
  4      3.0180000E+03         -2.72833220880E-03      
  5      9.8680000E+02         -9.64813854352E-03      
  6      3.5740000E+02         -2.92677833701E-02      
  7      1.3960000E+02         -7.50063600152E-02      
  8      5.7630000E+01         -1.50183593497E-01      
  9      2.4600000E+01         -1.87885935001E-01      
 10      1.0120000E+01          4.03176834983E-02      
 11      4.2830000E+00          5.30955117250E-01      
 12      1.8050000E+00          5.15107081068E-01      
 13      2.7820000E-01         -8.95831170627E-03      
S   13
  1      3.1240000E+05          4.46860235351E-06      
  2      4.6800000E+04          3.45184277066E-05      
  3      1.0650000E+04          1.80786392769E-04      
  4      3.0180000E+03          7.51731839945E-04      
  5      9.8680000E+02          2.66777351560E-03      
  6      3.5740000E+02          8.09806460797E-03      
  7      1.3960000E+02          2.10005702655E-02      
  8      5.7630000E+01          4.26634916595E-02      
  9      2.4600000E+01          5.60374051356E-02      
 10      1.0120000E+01         -1.41159324033E-02      
 11      4.2830000E+00         -1.98651431071E-01      
 12      1.8050000E+00         -3.53654305723E-01      
 13      2.7820000E-01          7.02974776112E-01      
S   1
  1      6.1580000E-01          1.0000000        
S   1
  1      1.0550000E-01          1.0000000        
P   7
  1      5.0490000E+02          2.37617622633E-03      
  2      1.1940000E+02          1.86913947687E-02      
  3      3.7960000E+01          8.52699970952E-02      
  4      1.3950000E+01          2.44780217845E-01      
  5      5.4570000E+00          4.22308458551E-01      
  6      2.1770000E+00          3.67577638943E-01      
  7      2.8770000E-01         -3.40187273566E-03      
P   7
  1      5.0490000E+02         -5.61184923734E-04      
  2      1.1940000E+02         -4.47246507830E-03      
  3      3.7960000E+01         -2.05850340119E-02      
  4      1.3950000E+01         -6.14809690456E-02      
  5      5.4570000E+00         -1.08088397139E-01      
  6      2.1770000E+00         -1.04741772862E-01      
  7      2.8770000E-01          5.46207812287E-01      
P   1
  1      8.0100000E-01          1.0000000        
P   1
  1      9.7140000E-02          1.0000000        
D   1
  1      6.5200000E-01          1.0000000        
D   1
  1      2.1600000E-01          1.0000000        
F   1
  1      4.5200000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: S
data:
SULFUR
S   13
  1      3.7410000E+05          5.60365935483E-05      
  2      5.6050000E+04          4.32635046203E-04      
  3      1.2760000E+04          2.25649132861E-03      
  4      3.6150000E+03          9.35228455498E-03      
  5      1.1830000E+03          3.25130715852E-02      
  6      4.2880000E+02          9.53875087884E-02      
  7      1.6780000E+02          2.24269711821E-01      
  8      6.9470000E+01          3.73724467850E-01      
  9      2.9840000E+01          3.27035941764E-01      
 10      1.2720000E+01          8.38127589539E-02      
 11      5.2440000E+00          4.36988533837E-04      
 12      2.2190000E+00          1.62508052678E-03      
 13      3.4900000E-01          2.96713603671E-04      
S   13
  1      3.7410000E+05         -1.55718164848E-05      
  2      5.6050000E+04         -1.20113109673E-04      
  3      1.2760000E+04         -6.28776779939E-04      
  4      3.6150000E+03         -2.61290882660E-03      
  5      1.1830000E+03         -9.25272260068E-03      
  6      4.2880000E+02         -2.80723859256E-02      
  7      1.6780000E+02         -7.25731324520E-02      
  8      6.9470000E+01         -1.46733199260E-01      
  9      2.9840000E+01         -1.93582855526E-01      
 10      1.2720000E+01          1.26832291840E-02      
 11      5.2440000E+00          5.19531894871E-01      
 12      2.2190000E+00          5.37530391097E-01      
 13      3.4900000E-01         -8.84804963646E-03      
S   13
  1      3.7410000E+05          4.52577323366E-06      
  2      5.6050000E+04          3.48877507918E-05      
  3      1.2760000E+04          1.82838222861E-04      
  4      3.6150000E+03          7.59170934388E-04      
  5      1.1830000E+03          2.69654380376E-03      
  6      4.2880000E+02          8.19220299218E-03      
  7      1.6780000E+02          2.14135226445E-02      
  8      6.9470000E+01          4.39813083213E-02      
  9      2.9840000E+01          6.07883638268E-02      
 10      1.2720000E+01         -5.13799778240E-03      
 11      5.2440000E+00         -2.06796223041E-01      
 12      2.2190000E+00         -3.80124019518E-01      
 13      3.4900000E-01          7.14474917453E-01      
S   1
  1      7.7670000E-01          1.0000000        
S   1
  1      1.3220000E-01          1.0000000        
P   7
  1      5.7440000E+02          2.46920502419E-03      
  2      1.3580000E+02          1.94626156898E-02      
  3      4.3190000E+01          8.89131747367E-02      
  4      1.5870000E+01          2.54870401343E-01      
  5      6.2080000E+00          4.33455945869E-01      
  6      2.4830000E+00          3.53972793680E-01      
  7      3.2290000E-01         -4.85004939450E-03      
P   7
  1      5.7440000E+02         -6.32013637896E-04      
  2      1.3580000E+02         -4.98459745481E-03      
  3      4.3190000E+01         -2.33614238426E-02      
  4      1.5870000E+01         -6.85177931131E-02      
  5      6.2080000E+00         -1.23718987387E-01      
  6      2.4830000E+00         -9.60920513732E-02      
  7      3.2290000E-01          5.62512764817E-01      
P   1
  1      8.6880000E-01          1.0000000        
P   1
  1      1.0980000E-01          1.0000000        
D   1
  1      8.1900000E-01          1.0000000        
D   1
  1      2.6900000E-01          1.0000000        
F   1
  1      5.5700000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   13
  1      4.5610000E+05          5.11888165084E-05      
  2      6.8330000E+04          3.95283358895E-04      
  3      1.5550000E+04          2.06020007650E-03      
  4      4.4050000E+03          8.55337581160E-03      
  5      1.4390000E+03          2.98977724463E-02      
  6      5.2040000E+02          8.86229995484E-02      
  7      2.0310000E+02          2.12241594359E-01      
  8      8.3960000E+01          3.64767640349E-01      
  9      3.6200000E+01          3.38592709294E-01      
 10      1.5830000E+01          1.00967731036E-01      
 11      6.3340000E+00          3.07173957283E-03      
 12      2.6940000E+00          1.04127914336E-03      
 13      4.3130000E-01          1.53459094548E-04      
S   13
  1      4.5610000E+05         -1.44496437413E-05      
  2      6.8330000E+04         -1.11403025395E-04      
  3      1.5550000E+04         -5.83267098625E-04      
  4      4.4050000E+03         -2.42403526642E-03      
  5      1.4390000E+03         -8.63709090438E-03      
  6      5.2040000E+02         -2.63629225123E-02      
  7      2.0310000E+02         -6.92912810605E-02      
  8      8.3960000E+01         -1.42242953734E-01      
  9      3.6200000E+01         -1.97852923254E-01      
 10      1.5830000E+01         -1.45207520361E-02      
 11      6.3340000E+00          5.03653982625E-01      
 12      2.6940000E+00          5.58438484230E-01      
 13      4.3130000E-01         -8.03591935923E-03      
S   13
  1      4.5610000E+05          4.37374433423E-06      
  2      6.8330000E+04          3.36983169936E-05      
  3      1.5550000E+04          1.76638625451E-04      
  4      4.4050000E+03          7.33450297102E-04      
  5      1.4390000E+03          2.62144032533E-03      
  6      5.2040000E+02          8.01100167591E-03      
  7      2.0310000E+02          2.12886147695E-02      
  8      8.3960000E+01          4.43729596025E-02      
  9      3.6200000E+01          6.46415632655E-02      
 10      1.5830000E+01          4.26843679477E-03      
 11      6.3340000E+00         -2.09223471855E-01      
 12      2.6940000E+00         -4.03259256323E-01      
 13      4.3130000E-01          7.25637029074E-01      
S   1
  1      9.7680000E-01          1.0000000        
S   1
  1      1.6250000E-01          1.0000000        
P   7
  1      6.6330000E+02          2.45796851788E-03      
  2      1.5680000E+02          1.94292043302E-02      
  3      4.9980000E+01          8.89601411970E-02      
  4      1.8420000E+01          2.56320692172E-01      
  5      7.2400000E+00          4.36372786132E-01      
  6      2.9220000E+00          3.49203564559E-01      
  7      3.8180000E-01         -4.62436704008E-03      
P   7
  1      6.6330000E+02         -6.66743999306E-04      
  2      1.5680000E+02         -5.25301128692E-03      
  3      4.9980000E+01         -2.48210238989E-02      
  4      1.8420000E+01         -7.28649323973E-02      
  5      7.2400000E+00         -1.33795019691E-01      
  6      2.9220000E+00         -9.39974848781E-02      
  7      3.8180000E-01          5.64053954958E-01      
P   1
  1      1.0220000E+00          1.0000000        
P   1
  1      1.3010000E-01          1.0000000        
D   1
  1      1.0460000E+00          1.0000000        
D   1
  1      3.4400000E-01          1.0000000        
F   1
  1      7.0600000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ar
data:
ARGON
S   13
  1      5.4500000E+05          4.75629562483E-05      
  2      8.1640000E+04          3.66949568593E-04      
  3      1.8580000E+04          1.91225322842E-03      
  4      5.2610000E+03          7.94576352710E-03      
  5      1.7170000E+03          2.78799550542E-02      
  6      6.1990000E+02          8.32480758627E-02      
  7      2.4160000E+02          2.02129339385E-01      
  8      9.9790000E+01          3.56261298039E-01      
  9      4.3150000E+01          3.47057155340E-01      
 10      1.9140000E+01          1.16798965556E-01      
 11      7.4880000E+00          5.50896421379E-03      
 12      3.2050000E+00          4.75975940203E-04      
 13      5.2040000E-01          2.87196607616E-05      
S   13
  1      5.4500000E+05         -1.36118203219E-05      
  2      8.1640000E+04         -1.04800266661E-04      
  3      1.8580000E+04         -5.48932446647E-04      
  4      5.2610000E+03         -2.28071789488E-03      
  5      1.7170000E+03         -8.16062764973E-03      
  6      6.1990000E+02         -2.50136860827E-02      
  7      2.4160000E+02         -6.65223606081E-02      
  8      9.9790000E+01         -1.38396655194E-01      
  9      4.3150000E+01         -2.00259754508E-01      
 10      1.9140000E+01         -3.56216047405E-02      
 11      7.4880000E+00          4.89615394703E-01      
 12      3.2050000E+00          5.73245356695E-01      
 13      5.2040000E-01         -7.00308864648E-03      
S   13
  1      5.4500000E+05          4.25613691507E-06      
  2      8.1640000E+04          3.27469953289E-05      
  3      1.8580000E+04          1.71728219551E-04      
  4      5.2610000E+03          7.12844340658E-04      
  5      1.7170000E+03          2.55851409113E-03      
  6      6.1990000E+02          7.85109449061E-03      
  7      2.4160000E+02          2.11084547341E-02      
  8      9.9790000E+01          4.45751077800E-02      
  9      4.3150000E+01          6.75173621636E-02      
 10      1.9140000E+01          1.20807146022E-02      
 11      7.4880000E+00         -2.10837900057E-01      
 12      3.2050000E+00         -4.22084238238E-01      
 13      5.2040000E-01          7.33771979301E-01      
S   1
  1      1.1960000E+00          1.0000000        
S   1
  1      1.9540000E-01          1.0000000        
P   7
  1      7.6180000E+02          2.43009945063E-03      
  2      1.8020000E+02          1.92652266451E-02      
  3      5.7500000E+01          8.86066517607E-02      
  4      2.1240000E+01          2.56752817397E-01      
  5      8.3880000E+00          4.38087487973E-01      
  6      3.4160000E+00          3.46226228983E-01      
  7      4.5230000E-01         -5.28648676353E-03      
P   7
  1      7.6180000E+02         -6.84367879212E-04      
  2      1.8020000E+02         -5.39726072351E-03      
  3      5.7500000E+01         -2.57065960592E-02      
  4      2.1240000E+01         -7.57946777036E-02      
  5      8.3880000E+00         -1.40865087136E-01      
  6      3.4160000E+00         -9.22961934631E-02      
  7      4.5230000E-01          5.61760571747E-01      
P   1
  1      1.2060000E+00          1.0000000        
P   1
  1      1.5450000E-01          1.0000000        
D   1
  1      1.2540000E+00          1.0000000        
D   1
  1      4.1000000E-01          1.0000000        
F   1
  1      8.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   18
  1      6.5581573E+06          9.24928473873E-06      
  2      9.8202534E+05          7.04868448757E-05      
  3      2.2346769E+05          3.63418493559E-04      
  4      6.3288291E+04          1.50661122340E-03      
  5      2.0642940E+04          5.37136667295E-03      
  6      7.4505224E+03          1.69815653335E-02      
  7      2.9050744E+03          4.78755245182E-02      
  8      1.2042100E+03          1.17943756553E-01      
  9      5.2430454E+02          2.39047504639E-01      
 10      2.3746563E+02          3.49813234176E-01      
 11      1.1057866E+02          2.84128689643E-01      
 12      5.1374624E+01          7.79497708599E-02      
 13      2.4440846E+01          7.10807204033E-04      
 14      1.1768591E+01          1.52454312239E-03      
 15      5.3421190E+00         -7.13966833327E-04      
 16      2.4950360E+00          2.95072570618E-04      
 17      1.0987730E+00         -1.23496778445E-04      
 18      2.6018000E-01          4.87855468051E-05      
S   18
  1      6.5581573E+06         -2.92972648124E-06      
  2      9.8202534E+05         -2.23247424168E-05      
  3      2.2346769E+05         -1.15210578690E-04      
  4      6.3288291E+04         -4.78049613676E-04      
  5      2.0642940E+04         -1.71204340174E-03      
  6      7.4505224E+03         -5.45935370998E-03      
  7      2.9050744E+03         -1.57571014930E-02      
  8      1.2042100E+03         -4.07563026462E-02      
  9      5.2430454E+02         -9.20667939759E-02      
 10      2.3746563E+02         -1.66871680185E-01      
 11      1.1057866E+02         -1.92265348834E-01      
 12      5.1374624E+01          3.11785728334E-02      
 13      2.4440846E+01          5.06631127512E-01      
 14      1.1768591E+01          5.12290641225E-01      
 15      5.3421190E+00          1.01364072847E-01      
 16      2.4950360E+00         -5.19521349378E-04      
 17      1.0987730E+00          1.95151525349E-03      
 18      2.6018000E-01         -4.12856094755E-04      
S   18
  1      6.5581573E+06          1.12112033207E-06      
  2      9.8202534E+05          8.54642405277E-06      
  3      2.2346769E+05          4.40838057347E-05      
  4      6.3288291E+04          1.83088370527E-04      
  5      2.0642940E+04          6.55385896199E-04      
  6      7.4505224E+03          2.09487809111E-03      
  7      2.9050744E+03          6.05456325355E-03      
  8      1.2042100E+03          1.57895817011E-02      
  9      5.2430454E+02          3.60764810515E-02      
 10      2.3746563E+02          6.75807400749E-02      
 11      1.1057866E+02          8.15632516497E-02      
 12      5.1374624E+01         -1.48369054897E-02      
 13      2.4440846E+01         -3.14073872125E-01      
 14      1.1768591E+01         -4.70565916419E-01      
 15      5.3421190E+00          1.20644767821E-01      
 16      2.4950360E+00          7.33546430908E-01      
 17      1.0987730E+00          4.04719722761E-01      
 18      2.6018000E-01          1.69383764297E-02      
S   18
  1      6.5581573E+06         -2.62794128740E-07      
  2      9.8202534E+05         -2.00474954891E-06      
  3      2.2346769E+05         -1.03299960995E-05      
  4      6.3288291E+04         -4.29643251622E-05      
  5      2.0642940E+04         -1.53526324009E-04      
  6      7.4505224E+03         -4.91924163473E-04      
  7      2.9050744E+03         -1.41830278389E-03      
  8      1.2042100E+03         -3.71481270037E-03      
  9      5.2430454E+02         -8.46523449130E-03      
 10      2.3746563E+02         -1.60211062602E-02      
 11      1.1057866E+02         -1.92476140654E-02      
 12      5.1374624E+01          3.20203459471E-03      
 13      2.4440846E+01          7.96111385082E-02      
 14      1.1768591E+01          1.22532012279E-01      
 15      5.3421190E+00         -3.71736776405E-02      
 16      2.4950360E+00         -2.62293389219E-01      
 17      1.0987730E+00         -2.68293664501E-01      
 18      2.6018000E-01          3.44855509376E-01      
S   1
  1      1.2707900E-01          1.0000000        
S   1
  1      5.4408000E-02          1.0000000        
P   11
  1      8.0501674E+03          3.60728530439E-04      
  2      1.9075361E+03          2.98254318398E-03      
  3      6.1862746E+02          1.58283112901E-02      
  4      2.3532417E+02          6.15706342273E-02      
  5      9.8899646E+01          1.75352355129E-01      
  6      4.4248215E+01          3.41231733331E-01      
  7      2.0617429E+01          3.85746860718E-01      
  8      9.7805160E+00          1.79882887058E-01      
  9      4.4412380E+00          2.07711553711E-02      
 10      1.9640450E+00          8.19682934815E-04      
 11      8.3357800E-01         -1.71290877670E-04      
P   11
  1      8.0501674E+03         -1.37660370747E-04      
  2      1.9075361E+03         -1.13826719312E-03      
  3      6.1862746E+02         -6.11435795494E-03      
  4      2.3532417E+02         -2.41915459744E-02      
  5      9.8899646E+01         -7.19394705143E-02      
  6      4.4248215E+01         -1.46953483470E-01      
  7      2.0617429E+01         -1.74392696669E-01      
  8      9.7805160E+00          4.26228402046E-02      
  9      4.4412380E+00          4.27362168716E-01      
 10      1.9640450E+00          4.91533372660E-01      
 11      8.3357800E-01          1.75205693728E-01      
P   11
  1      8.0501674E+03          2.27960028674E-05      
  2      1.9075361E+03          1.83085161448E-04      
  3      6.1862746E+02          1.01526236654E-03      
  4      2.3532417E+02          3.89446421266E-03      
  5      9.8899646E+01          1.20760429546E-02      
  6      4.4248215E+01          2.35617908695E-02      
  7      2.0617429E+01          3.09677108047E-02      
  8      9.7805160E+00         -1.49070538443E-02      
  9      4.4412380E+00         -7.37735946057E-02      
 10      1.9640450E+00         -1.26371003850E-01      
 11      8.3357800E-01          2.02375860231E-02      
P   1
  1      1.9344500E-01          1.0000000        
P   1
  1      5.6117000E-02          1.0000000        
D   7
  1      2.4414741E+02          2.05164901177E-03      
  2      7.3067595E+01          1.64840391095E-02      
  3      2.7592081E+01          6.99277760809E-02      
  4      1.1546518E+01          1.89733200230E-01      
  5      5.0486280E+00          3.23814757214E-01      
  6      2.1784650E+00          3.66632893282E-01      
  7      9.0025300E-01          2.77252611706E-01      
D   1
  1      3.3732700E-01          1.0000000        
D   1
  1      1.1690000E-01          1.0000000        
F   1
  1      2.8810000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   18
  1      7.4479668E+06          8.63518569072E-06      
  2      1.1153182E+06          6.57140521479E-05      
  3      2.5384265E+05          3.38272515386E-04      
  4      7.1915285E+04          1.40023749418E-03      
  5      2.3470181E+04          4.98443609795E-03      
  6      8.4774918E+03          1.57472075465E-02      
  7      3.3083908E+03          4.44493598667E-02      
  8      1.3726054E+03          1.10160058052E-01      
  9      5.9822007E+02          2.26519132318E-01      
 10      2.7138602E+02          3.42311270135E-01      
 11      1.2697795E+02          2.96738438626E-01      
 12      6.0222065E+01          9.49954870900E-02      
 13      2.8018582E+01          3.89155141324E-03      
 14      1.3517522E+01          9.76528953239E-04      
 15      6.3094060E+00         -4.61066328113E-04      
 16      2.9045340E+00          1.69258368578E-04      
 17      1.2875560E+00         -8.62304740731E-05      
 18      1.6773200E-01         -2.57286728045E-05      
S   18
  1      7.4479668E+06         -2.74896573728E-06      
  2      1.1153182E+06         -2.09115613375E-05      
  3      2.5384265E+05         -1.07791281074E-04      
  4      7.1915285E+04         -4.46295503012E-04      
  5      2.3470181E+04         -1.59674950593E-03      
  6      8.4774918E+03         -5.08056650785E-03      
  7      3.3083908E+03         -1.46792995868E-02      
  8      1.3726054E+03         -3.80227004314E-02      
  9      5.9822007E+02         -8.67429875026E-02      
 10      2.7138602E+02         -1.59677317944E-01      
 11      1.2697795E+02         -1.96219592188E-01      
 12      6.0222065E+01         -4.91282897334E-03      
 13      2.8018582E+01          4.72231784949E-01      
 14      1.3517522E+01          5.40024078931E-01      
 15      6.3094060E+00          1.27929298944E-01      
 16      2.9045340E+00          1.90800489725E-03      
 17      1.2875560E+00          1.88570174961E-03      
 18      1.6773200E-01          2.80300225073E-04      
S   18
  1      7.4479668E+06          1.06306484005E-06      
  2      1.1153182E+06          8.08744371815E-06      
  3      2.5384265E+05          4.16869913959E-05      
  4      7.1915285E+04          1.72648903948E-04      
  5      2.3470181E+04          6.17895267819E-04      
  6      8.4774918E+03          1.96862525227E-03      
  7      3.3083908E+03          5.70197358537E-03      
  8      1.3726054E+03          1.48633207276E-02      
  9      5.9822007E+02          3.43400116249E-02      
 10      2.7138602E+02          6.50385123845E-02      
 11      1.2697795E+02          8.39827795850E-02      
 12      6.0222065E+01          1.55089357980E-03      
 13      2.8018582E+01         -2.86634229183E-01      
 14      1.3517522E+01         -4.90493406013E-01      
 15      6.3094060E+00          4.45129819337E-02      
 16      2.9045340E+00          7.31371719842E-01      
 17      1.2875560E+00          4.53729815184E-01      
 18      1.6773200E-01         -7.97503944258E-03      
S   18
  1      7.4479668E+06         -2.74538690864E-07      
  2      1.1153182E+06         -2.08986807707E-06      
  3      2.5384265E+05         -1.07627866675E-05      
  4      7.1915285E+04         -4.46292605612E-05      
  5      2.3470181E+04         -1.59488528088E-04      
  6      8.4774918E+03         -5.09192800536E-04      
  7      3.3083908E+03         -1.47188008698E-03      
  8      1.3726054E+03         -3.85133637885E-03      
  9      5.9822007E+02         -8.88035566377E-03      
 10      2.7138602E+02         -1.69745258068E-02      
 11      1.2697795E+02         -2.18661173399E-02      
 12      6.0222065E+01         -7.34782844585E-04      
 13      2.8018582E+01          7.98251529311E-02      
 14      1.3517522E+01          1.41310294893E-01      
 15      6.3094060E+00         -1.66507045782E-02      
 16      2.9045340E+00         -2.86223845719E-01      
 17      1.2875560E+00         -3.23022524397E-01      
 18      1.6773200E-01          6.00946305644E-01      
S   1
  1      3.3655200E-01          1.0000000        
S   1
  1      7.1069000E-02          1.0000000        
P   11
  1      6.9795982E+03          5.19108795719E-04      
  2      1.6541648E+03          4.26130065796E-03      
  3      5.3602865E+02          2.22760609343E-02      
  4      2.0353713E+02          8.38950146852E-02      
  5      8.5237530E+01          2.24407583301E-01      
  6      3.7841962E+01          3.89499208542E-01      
  7      1.7406512E+01          3.50693090526E-01      
  8      7.8814920E+00          1.03789483855E-01      
  9      3.5332130E+00          3.10595954001E-03      
 10      1.5214730E+00          1.47296514849E-03      
 11      1.9909300E-01         -5.18728969070E-05      
P   11
  1      6.9795982E+03         -2.00633382810E-04      
  2      1.6541648E+03         -1.65790680548E-03      
  3      5.3602865E+02         -8.73749076432E-03      
  4      2.0353713E+02         -3.38592313371E-02      
  5      8.5237530E+01         -9.43404306891E-02      
  6      3.7841962E+01         -1.75337022751E-01      
  7      1.7406512E+01         -1.42047892379E-01      
  8      7.8814920E+00          1.93369299897E-01      
  9      3.5332130E+00          5.27508936688E-01      
 10      1.5214730E+00          3.90683191779E-01      
 11      1.9909300E-01         -2.98278015016E-03      
P   11
  1      6.9795982E+03          3.93994518507E-05      
  2      1.6541648E+03          3.24057699829E-04      
  3      5.3602865E+02          1.71914413852E-03      
  4      2.0353713E+02          6.64160212570E-03      
  5      8.5237530E+01          1.87253847891E-02      
  6      3.7841962E+01          3.47298423123E-02      
  7      1.7406512E+01          2.83285293391E-02      
  8      7.8814920E+00         -4.85361534620E-02      
  9      3.5332130E+00         -1.24451650019E-01      
 10      1.5214730E+00         -1.17991188485E-01      
 11      1.9909300E-01          5.53501444807E-01      
P   1
  1      5.6270400E-01          1.0000000        
P   1
  1      6.7031000E-02          1.0000000        
D   7
  1      2.8223911E+02          1.85508318589E-03      
  2      8.4549957E+01          1.51577883454E-02      
  3      3.2073656E+01          6.56679695304E-02      
  4      1.3497495E+01          1.82625674103E-01      
  5      5.9585500E+00          3.21191977485E-01      
  6      2.6107880E+00          3.71658219074E-01      
  7      1.1039870E+00          2.77965419425E-01      
D   1
  1      4.2404900E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      3.4580000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: As
data:
ARSENIC
S   18
  1      8.4823396E+06          8.01794322584E-06      
  2      1.2701509E+06          6.09400425655E-05      
  3      2.8905696E+05          3.13339934395E-04      
  4      8.1879849E+04          1.29612898096E-03      
  5      2.6716564E+04          4.61261873892E-03      
  6      9.6475842E+03          1.45832452534E-02      
  7      3.7641195E+03          4.12633317260E-02      
  8      1.5615656E+03          1.02909321708E-01      
  9      6.8081467E+02          2.14498252759E-01      
 10      3.0924119E+02          3.33815307942E-01      
 11      1.4525736E+02          3.07444060082E-01      
 12      6.9739048E+01          1.13165690778E-01      
 13      3.1770325E+01          7.53604855368E-03      
 14      1.5391757E+01          3.12471481979E-04      
 15      7.3415260E+00         -1.48631525727E-04      
 16      3.3237160E+00          2.32380200209E-05      
 17      1.4858670E+00         -3.51945418512E-05      
 18      2.1150000E-01         -9.85595270228E-06      
S   18
  1      8.4823396E+06         -2.56482976498E-06      
  2      1.2701509E+06         -1.94817429262E-05      
  3      2.8905696E+05         -1.00339030353E-04      
  4      8.1879849E+04         -4.14933643495E-04      
  5      2.6716564E+04         -1.48473948664E-03      
  6      9.6475842E+03         -4.72168363883E-03      
  7      3.7641195E+03         -1.36707064572E-02      
  8      1.5615656E+03         -3.54907882519E-02      
  9      6.8081467E+02         -8.16990342116E-02      
 10      3.0924119E+02         -1.52587635233E-01      
 11      1.4525736E+02         -1.97992576863E-01      
 12      6.9739048E+01         -3.49424875594E-02      
 13      3.1770325E+01          4.37131524399E-01      
 14      1.5391757E+01          5.59194795139E-01      
 15      7.3415260E+00          1.55711120603E-01      
 16      3.3237160E+00          5.02046217561E-03      
 17      1.4858670E+00          1.66576065988E-03      
 18      2.1150000E-01          2.17047605280E-04      
S   18
  1      8.4823396E+06          1.00237275901E-06      
  2      1.2701509E+06          7.61218762310E-06      
  3      2.8905696E+05          3.92215872809E-05      
  4      8.1879849E+04          1.62147455533E-04      
  5      2.6716564E+04          5.80797351529E-04      
  6      9.6475842E+03          1.84767757238E-03      
  7      3.7641195E+03          5.36806218081E-03      
  8      1.5615656E+03          1.40008496016E-02      
  9      6.8081467E+02          3.26758910163E-02      
 10      3.0924119E+02          6.25342660845E-02      
 11      1.4525736E+02          8.54555392260E-02      
 12      6.9739048E+01          1.51589142138E-02      
 13      3.1770325E+01         -2.61388993768E-01      
 14      1.5391757E+01         -5.01770678051E-01      
 15      7.3415260E+00         -1.97240784729E-02      
 16      3.3237160E+00          7.22985721963E-01      
 17      1.4858670E+00          4.93767697043E-01      
 18      2.1150000E-01         -8.77339950778E-03      
S   18
  1      8.4823396E+06         -2.78154210179E-07      
  2      1.2701509E+06         -2.11345740530E-06      
  3      2.8905696E+05         -1.08812555992E-05      
  4      8.1879849E+04         -4.50323413488E-05      
  5      2.6716564E+04         -1.61097441994E-04      
  6      9.6475842E+03         -5.13429012061E-04      
  7      3.7641195E+03         -1.48914821744E-03      
  8      1.5615656E+03         -3.89710867436E-03      
  9      6.8081467E+02         -9.08163287241E-03      
 10      3.0924119E+02         -1.75261419936E-02      
 11      1.4525736E+02         -2.39304705661E-02      
 12      6.9739048E+01         -4.59564758296E-03      
 13      3.1770325E+01          7.80660819706E-02      
 14      1.5391757E+01          1.55724275992E-01      
 15      7.3415260E+00          4.15470750052E-03      
 16      3.3237160E+00         -3.03587723139E-01      
 17      1.4858670E+00         -3.70773170556E-01      
 18      2.1150000E-01          6.30874508667E-01      
S   1
  1      4.2108600E-01          1.0000000        
S   1
  1      8.8974000E-02          1.0000000        
P   11
  1      7.4238614E+03          5.26736252701E-04      
  2      1.7595166E+03          4.31035889428E-03      
  3      5.7022916E+02          2.24998644731E-02      
  4      2.1657997E+02          8.46433887084E-02      
  5      9.0734252E+01          2.26085101490E-01      
  6      4.0308791E+01          3.90890614248E-01      
  7      1.8555502E+01          3.48444324768E-01      
  8      8.3965430E+00          1.01416466528E-01      
  9      3.7673670E+00          2.75528082391E-03      
 10      1.6297010E+00          1.35613582295E-03      
 11      2.2250300E-01          2.82214050126E-05      
P   11
  1      7.4238614E+03         -2.06647806788E-04      
  2      1.7595166E+03         -1.70268619612E-03      
  3      5.7022916E+02         -8.96020187446E-03      
  4      2.1657997E+02         -3.47033799897E-02      
  5      9.0734252E+01         -9.65829520307E-02      
  6      4.0308791E+01         -1.79034044585E-01      
  7      1.8555502E+01         -1.41338458152E-01      
  8      8.3965430E+00          2.04260718099E-01      
  9      3.7673670E+00          5.37739201194E-01      
 10      1.6297010E+00          3.78666947151E-01      
 11      2.2250300E-01         -4.66412620955E-03      
P   11
  1      7.4238614E+03          4.56165838533E-05      
  2      1.7595166E+03          3.76742719796E-04      
  3      5.7022916E+02          1.98114603682E-03      
  4      2.1657997E+02          7.71308699533E-03      
  5      9.0734252E+01          2.15229412407E-02      
  6      4.0308791E+01          4.04023030535E-02      
  7      1.8555502E+01          3.08202687448E-02      
  8      8.3965430E+00         -5.61818415919E-02      
  9      3.7673670E+00         -1.51099854112E-01      
 10      1.6297010E+00         -1.18991704362E-01      
 11      2.2250300E-01          5.48703822445E-01      
P   1
  1      5.6826300E-01          1.0000000        
P   1
  1      8.0405000E-02          1.0000000        
D   7
  1      3.2101961E+02          1.71431079845E-03      
  2      9.6249305E+01          1.41859470881E-02      
  3      3.6644963E+01          6.25149567164E-02      
  4      1.5493965E+01          1.77259131666E-01      
  5      6.8911380E+00          3.19356771318E-01      
  6      3.0548310E+00          3.75986922933E-01      
  7      1.3142410E+00          2.77795773733E-01      
D   1
  1      5.1343000E-01          1.0000000        
D   1
  1      1.8770000E-01          1.0000000        
F   1
  1      4.1580000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Se
data:
SELENIUM
S   18
  1      9.5636000E+06          7.52380411153E-06      
  2      1.4321000E+06          5.71026996385E-05      
  3      3.2591000E+05          2.93232494374E-04      
  4      9.2312000E+04          1.21189886056E-03      
  5      3.0116000E+04          4.31102685443E-03      
  6      1.0872000E+04          1.36383271088E-02      
  7      4.2401000E+03          3.86737402459E-02      
  8      1.7584000E+03          9.69731125243E-02      
  9      7.6659000E+02          2.04423501060E-01      
 10      3.4843000E+02          3.25872481830E-01      
 11      1.6403000E+02          3.15515976960E-01      
 12      7.9142000E+01          1.29390487117E-01      
 13      3.5524000E+01          1.09934878494E-02      
 14      1.7305000E+01         -3.16756980163E-04      
 15      8.3784000E+00          1.47671401136E-04      
 16      3.7405000E+00         -1.09994216600E-04      
 17      1.6890000E+00          1.75893300573E-05      
 18      2.5520000E-01          6.43484661693E-06      
S   18
  1      9.5636000E+06         -2.41800143633E-06      
  2      1.4321000E+06         -1.83376026778E-05      
  3      3.2591000E+05         -9.43438561091E-05      
  4      9.2312000E+04         -3.89669978232E-04      
  5      3.0116000E+04         -1.39404119175E-03      
  6      1.0872000E+04         -4.43209377240E-03      
  7      4.2401000E+03         -1.28542562706E-02      
  8      1.7584000E+03         -3.34493068829E-02      
  9      7.6659000E+02         -7.75609419066E-02      
 10      3.4843000E+02         -1.46673586182E-01      
 11      1.6403000E+02         -1.98364649377E-01      
 12      7.9142000E+01         -5.74295269007E-02      
 13      3.5524000E+01          4.06121326264E-01      
 14      1.7305000E+01          5.70482685270E-01      
 15      8.3784000E+00          1.81248617947E-01      
 16      3.7405000E+00          8.23162811944E-03      
 17      1.6890000E+00          1.35466859398E-03      
 18      2.5520000E-01          1.34488252787E-04      
S   18
  1      9.5636000E+06          9.54804199315E-07      
  2      1.4321000E+06          7.23794297146E-06      
  3      3.2591000E+05          3.72650405694E-05      
  4      9.2312000E+04          1.53803762482E-04      
  5      3.0116000E+04          5.51097078049E-04      
  6      1.0872000E+04          1.75141215507E-03      
  7      4.2401000E+03          5.10102207421E-03      
  8      1.7584000E+03          1.33176340848E-02      
  9      7.6659000E+02          3.13342855361E-02      
 10      3.4843000E+02          6.05250959748E-02      
 11      1.6403000E+02          8.63259866465E-02      
 12      7.9142000E+01          2.54344011159E-02      
 13      3.5524000E+01         -2.40887038423E-01      
 14      1.7305000E+01         -5.07014017196E-01      
 15      8.3784000E+00         -7.03126003280E-02      
 16      3.7405000E+00          7.12710997312E-01      
 17      1.6890000E+00          5.24003886732E-01      
 18      2.5520000E-01         -9.05789358188E-03      
S   18
  1      9.5636000E+06         -2.80327641756E-07      
  2      1.4321000E+06         -2.12616314045E-06      
  3      3.2591000E+05         -1.09382906717E-05      
  4      9.2312000E+04         -4.51939721002E-05      
  5      3.0116000E+04         -1.61727706948E-04      
  6      1.0872000E+04         -5.14923640767E-04      
  7      4.2401000E+03         -1.49715289965E-03      
  8      1.7584000E+03         -3.92203013788E-03      
  9      7.6659000E+02         -9.21365748356E-03      
 10      3.4843000E+02         -1.79454134964E-02      
 11      1.6403000E+02         -2.55796517261E-02      
 12      7.9142000E+01         -7.94027539671E-03      
 13      3.5524000E+01          7.61288632996E-02      
 14      1.7305000E+01          1.66596175319E-01      
 15      8.3784000E+00          2.31653210180E-02      
 16      3.7405000E+00         -3.18227295599E-01      
 17      1.6890000E+00         -4.10909464682E-01      
 18      2.5520000E-01          6.57995453344E-01      
S   1
  1      5.0927000E-01          1.0000000        
S   1
  1      1.0651000E-01          1.0000000        
P   11
  1      8.0043000E+03          5.20696352978E-04      
  2      1.8969000E+03          4.25014088859E-03      
  3      6.1471000E+02          2.21854455499E-02      
  4      2.3350000E+02          8.36157843406E-02      
  5      9.7856000E+01          2.24167831725E-01      
  6      4.3514000E+01          3.89536862602E-01      
  7      2.0063000E+01          3.49799849124E-01      
  8      9.1127000E+00          1.03572997138E-01      
  9      4.1063000E+00          3.03197887987E-03      
 10      1.7949000E+00          1.27628454998E-03      
 11      2.4615000E-01          9.18495283658E-06      
P   11
  1      8.0043000E+03         -2.07291936838E-04      
  2      1.8969000E+03         -1.70322312703E-03      
  3      6.1471000E+02         -8.96556524656E-03      
  4      2.3350000E+02         -3.47771400273E-02      
  5      9.7856000E+01         -9.72040258716E-02      
  6      4.3514000E+01         -1.81048055506E-01      
  7      2.0063000E+01         -1.44536052484E-01      
  8      9.1127000E+00          2.03158448117E-01      
  9      4.1063000E+00          5.42048133698E-01      
 10      1.7949000E+00          3.76126386046E-01      
 11      2.4615000E-01         -4.45183447515E-03      
P   11
  1      8.0043000E+03          4.98976415791E-05      
  2      1.8969000E+03          4.12236103278E-04      
  3      6.1471000E+02          2.16139608159E-03      
  4      2.3350000E+02          8.45942050263E-03      
  5      9.7856000E+01          2.36132307577E-02      
  6      4.3514000E+01          4.48405264059E-02      
  7      2.0063000E+01          3.39909479952E-02      
  8      9.1127000E+00         -6.06877323665E-02      
  9      4.1063000E+00         -1.71685773751E-01      
 10      1.7949000E+00         -1.23731177102E-01      
 11      2.4615000E-01          5.67368748704E-01      
P   1
  1      6.2432000E-01          1.0000000        
P   1
  1      8.8917000E-02          1.0000000        
D   7
  1      3.6185000E+02          1.59796725413E-03      
  2      1.0855000E+02          1.33730169043E-02      
  3      4.1433000E+01          5.98916368960E-02      
  4      1.7579000E+01          1.72836838014E-01      
  5      7.8627000E+00          3.17925938364E-01      
  6      3.5180000E+00          3.79744045778E-01      
  7      1.5348000E+00          2.77260800304E-01      
D   1
  1      6.0813000E-01          1.0000000        
D   1
  1      2.2200000E-01          1.0000000        
F   1
  1      4.6200000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Br
data:
BROMINE
S   18
  1      1.0639000E+07          7.16493664242E-06      
  2      1.5934000E+06          5.42938745344E-05      
  3      3.6261000E+05          2.78441531488E-04      
  4      1.0270000E+05          1.14967347443E-03      
  5      3.3501000E+04          4.08683328544E-03      
  6      1.2093000E+04          1.29273438181E-02      
  7      4.7159000E+03          3.66972288701E-02      
  8      1.9556000E+03          9.23607886202E-02      
  9      8.5261000E+02          1.96396355722E-01      
 10      3.8767000E+02          3.19046056603E-01      
 11      1.8268000E+02          3.21352505987E-01      
 12      8.8245000E+01          1.42741185851E-01      
 13      3.9263000E+01          1.40401463469E-02      
 14      1.9234000E+01         -8.48286298332E-04      
 15      9.4057000E+00          3.97523241272E-04      
 16      4.1601000E+00         -2.21142151068E-04      
 17      1.8995000E+00          6.62812951079E-05      
 18      3.0114000E-01          2.05171988943E-05      
S   18
  1      1.0639000E+07         -2.31308256543E-06      
  2      1.5934000E+06         -1.75132100309E-05      
  3      3.6261000E+05         -8.99926852076E-05      
  4      1.0270000E+05         -3.71276958965E-04      
  5      3.3501000E+04         -1.32741257770E-03      
  6      1.2093000E+04         -4.21733112004E-03      
  7      4.7159000E+03         -1.22384433832E-02      
  8      1.9556000E+03         -3.18958687657E-02      
  9      8.5261000E+02         -7.43476998486E-02      
 10      3.8767000E+02         -1.42053559668E-01      
 11      1.8268000E+02         -1.98106062872E-01      
 12      8.8245000E+01         -7.39305980567E-02      
 13      3.9263000E+01          3.80130320991E-01      
 14      1.9234000E+01          5.76785064015E-01      
 15      9.4057000E+00          2.03428895466E-01      
 16      4.1601000E+00          1.12509752628E-02      
 17      1.8995000E+00          1.01868119620E-03      
 18      3.0114000E-01          5.29685468856E-05      
S   18
  1      1.0639000E+07          9.22533076192E-07      
  2      1.5934000E+06          6.98079805868E-06      
  3      3.6261000E+05          3.59054417716E-05      
  4      1.0270000E+05          1.47978382521E-04      
  5      3.3501000E+04          5.30097422621E-04      
  6      1.2093000E+04          1.68261520967E-03      
  7      4.7159000E+03          4.90608932142E-03      
  8      1.9556000E+03          1.28162499239E-02      
  9      8.5261000E+02          3.03298071521E-02      
 10      3.8767000E+02          5.90584984941E-02      
 11      1.8268000E+02          8.69187305220E-02      
 12      8.8245000E+01          3.31313408396E-02      
 13      3.9263000E+01         -2.24819806610E-01      
 14      1.9234000E+01         -5.09219879912E-01      
 15      9.4057000E+00         -1.10452040404E-01      
 16      4.1601000E+00          7.02108717444E-01      
 17      1.8995000E+00          5.47425401770E-01      
 18      3.0114000E-01         -8.96128399470E-03      
S   18
  1      1.0639000E+07         -2.83500077362E-07      
  2      1.5934000E+06         -2.14639441147E-06      
  3      3.6261000E+05         -1.10312821528E-05      
  4      1.0270000E+05         -4.55132004516E-05      
  5      3.3501000E+04         -1.62827400072E-04      
  6      1.2093000E+04         -5.17806959137E-04      
  7      4.7159000E+03         -1.50714835494E-03      
  8      1.9556000E+03         -3.95069967540E-03      
  9      8.5261000E+02         -9.33438805236E-03      
 10      3.8767000E+02         -1.83275350603E-02      
 11      1.8268000E+02         -2.69606250935E-02      
 12      8.8245000E+01         -1.07282472297E-02      
 13      3.9263000E+01          7.44254537578E-02      
 14      1.9234000E+01          1.75245863027E-01      
 15      9.4057000E+00          3.99118500116E-02      
 16      4.1601000E+00         -3.30342105521E-01      
 17      1.8995000E+00         -4.45933514571E-01      
 18      3.0114000E-01          6.80847334276E-01      
S   1
  1      6.0472000E-01          1.0000000        
S   1
  1      1.2515000E-01          1.0000000        
P   11
  1      8.6765000E+03          5.08653160865E-04      
  2      2.0559000E+03          4.14089235150E-03      
  3      6.6623000E+02          2.16243162938E-02      
  4      2.5310000E+02          8.17403533847E-02      
  5      1.0612000E+02          2.20438413060E-01      
  6      4.7242000E+01          3.86724282075E-01      
  7      2.1825000E+01          3.52893935176E-01      
  8      9.9684000E+00          1.08069914570E-01      
  9      4.5171000E+00          3.64321699551E-03      
 10      1.9982000E+00          1.22509905655E-03      
 11      2.8145000E-01         -1.61434564257E-05      
P   11
  1      8.6765000E+03         -2.05368342534E-04      
  2      2.0559000E+03         -1.68217649373E-03      
  3      6.6623000E+02         -8.86204728017E-03      
  4      2.5310000E+02         -3.44513160013E-02      
  5      1.0612000E+02         -9.69246116704E-02      
  6      4.7242000E+01         -1.82090380023E-01      
  7      2.1825000E+01         -1.49673952070E-01      
  8      9.9684000E+00          1.95853603554E-01      
  9      4.5171000E+00          5.43431913350E-01      
 10      1.9982000E+00          3.79210237664E-01      
 11      2.8145000E-01         -4.02694128927E-03      
P   11
  1      8.6765000E+03          5.29181760479E-05      
  2      2.0559000E+03          4.36294972422E-04      
  3      6.6623000E+02          2.28698825381E-03      
  4      2.5310000E+02          8.98267204689E-03      
  5      1.0612000E+02          2.52091064420E-02      
  6      4.7242000E+01          4.84042639369E-02      
  7      2.1825000E+01          3.76493148737E-02      
  8      9.9684000E+00         -6.30407079902E-02      
  9      4.5171000E+00         -1.87886029491E-01      
 10      1.9982000E+00         -1.31874427630E-01      
 11      2.8145000E-01          5.72337783721E-01      
P   1
  1      7.0988000E-01          1.0000000        
P   1
  1      1.0204000E-01          1.0000000        
D   7
  1      4.0383000E+02          1.50803240781E-03      
  2      1.2117000E+02          1.27377473215E-02      
  3      4.6345000E+01          5.78331239534E-02      
  4      1.9721000E+01          1.69367077540E-01      
  5      8.8624000E+00          3.16918047503E-01      
  6      3.9962000E+00          3.82953489975E-01      
  7      1.7636000E+00          2.76353431984E-01      
D   1
  1      7.0619000E-01          1.0000000        
D   1
  1      2.6390000E-01          1.0000000        
F   1
  1      5.5150000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   18
  1      1.1718113E+07          6.89784364342E-06      
  2      1.7546044E+06          5.22030813312E-05      
  3      3.9928132E+05          2.67338443077E-04      
  4      1.1308457E+05          1.10252578960E-03      
  5      3.6885925E+04          3.91645325480E-03      
  6      1.3312209E+04          1.23868050557E-02      
  7      5.1899883E+03          3.51947735881E-02      
  8      2.1516597E+03          8.88229934493E-02      
  9      9.3803251E+02          1.90118397833E-01      
 10      4.2655732E+02          3.13386096610E-01      
 11      2.0106660E+02          3.25489718060E-01      
 12      9.7097605E+01          1.53430557031E-01      
 13      4.2998724E+01          1.66563117335E-02      
 14      2.1177075E+01         -1.27335030922E-03      
 15      1.0426752E+01          5.96696687191E-04      
 16      4.5850080E+00         -3.10913832432E-04      
 17      2.1176030E+00          1.09249684964E-04      
 18      3.4922500E-01          3.18775128531E-05      
S   18
  1      1.1718113E+07         -2.23666307070E-06      
  2      1.7546044E+06         -1.69124071138E-05      
  3      3.9928132E+05         -8.67859855535E-05      
  4      1.1308457E+05         -3.57589512505E-04      
  5      3.6885925E+04         -1.27757880892E-03      
  6      1.3312209E+04         -4.05699230744E-03      
  7      5.1899883E+03         -1.17783614756E-02      
  8      2.1516597E+03         -3.07323442988E-02      
  9      9.3803251E+02         -7.19065658032E-02      
 10      4.2655732E+02         -1.38515915443E-01      
 11      2.0106660E+02         -1.97619011130E-01      
 12      9.7097605E+01         -8.60864385236E-02      
 13      4.2998724E+01          3.58728922026E-01      
 14      2.1177075E+01          5.80030497767E-01      
 15      1.0426752E+01          2.22328003572E-01      
 16      4.5850080E+00          1.39788654470E-02      
 17      2.1176030E+00          6.92704827952E-04      
 18      3.4922500E-01         -1.78024778422E-05      
S   18
  1      1.1718113E+07          9.00622564890E-07      
  2      1.7546044E+06          6.80533803735E-06      
  3      3.9928132E+05          3.49604662518E-05      
  4      1.1308457E+05          1.43867969828E-04      
  5      3.6885925E+04          5.15152022491E-04      
  6      1.3312209E+04          1.63375070484E-03      
  7      5.1899883E+03          4.76752182508E-03      
  8      2.1516597E+03          1.24602216724E-02      
  9      9.3803251E+02          2.96100287853E-02      
 10      4.2655732E+02          5.80363469910E-02      
 11      2.0106660E+02          8.74100810048E-02      
 12      9.7097605E+01          3.89506245755E-02      
 13      4.2998724E+01         -2.12280936151E-01      
 14      2.1177075E+01         -5.10132930596E-01      
 15      1.0426752E+01         -1.42721268762E-01      
 16      4.5850080E+00          6.92479815896E-01      
 17      2.1176030E+00          5.65572622163E-01      
 18      3.4922500E-01         -8.59308191820E-03      
S   18
  1      1.1718113E+07         -2.87468275807E-07      
  2      1.7546044E+06         -2.17336601799E-06      
  3      3.9928132E+05         -1.11562235955E-05      
  4      1.1308457E+05         -4.59604596768E-05      
  5      3.6885925E+04         -1.64353722276E-04      
  6      1.3312209E+04         -5.22219502821E-04      
  7      5.1899883E+03         -1.52118965145E-03      
  8      2.1516597E+03         -3.98957240205E-03      
  9      9.3803251E+02         -9.46505911834E-03      
 10      4.2655732E+02         -1.87068407611E-02      
 11      2.0106660E+02         -2.81648073847E-02      
 12      9.7097605E+01         -1.30450571592E-02      
 13      4.2998724E+01          7.30754384318E-02      
 14      2.1177075E+01          1.82480407113E-01      
 15      1.0426752E+01          5.46386885885E-02      
 16      4.5850080E+00         -3.41012135295E-01      
 17      2.1176030E+00         -4.76718582007E-01      
 18      3.4922500E-01          7.00144009432E-01      
S   1
  1      7.0705700E-01          1.0000000        
S   1
  1      1.4482100E-01          1.0000000        
P   11
  1      9.3663090E+03          4.98912680878E-04      
  2      2.2195543E+03          4.04856742740E-03      
  3      7.1945288E+02          2.11298826353E-02      
  4      2.7346446E+02          8.00144320198E-02      
  5      1.1475225E+02          2.16841775342E-01      
  6      5.1155569E+01          3.83786804360E-01      
  7      2.3682676E+01          3.55722091686E-01      
  8      1.0875484E+01          1.12556683707E-01      
  9      4.9551310E+00          4.29079599477E-03      
 10      2.2172670E+00          1.17095464982E-03      
 11      3.2215400E-01         -2.63377426722E-05      
P   11
  1      9.3663090E+03         -2.04227873649E-04      
  2      2.2195543E+03         -1.66672798442E-03      
  3      7.1945288E+02         -8.77899101375E-03      
  4      2.7346446E+02         -3.41658693296E-02      
  5      1.1475225E+02         -9.66472027570E-02      
  6      5.1155569E+01         -1.83020210945E-01      
  7      2.3682676E+01         -1.54664180855E-01      
  8      1.0875484E+01          1.88583317123E-01      
  9      4.9551310E+00          5.44587286319E-01      
 10      2.2172670E+00          3.82624886768E-01      
 11      3.2215400E-01         -4.42804102450E-03      
P   11
  1      9.3663090E+03          5.52595407872E-05      
  2      2.2195543E+03          4.54211429100E-04      
  3      7.1945288E+02          2.37907709934E-03      
  4      2.7346446E+02          9.36240595439E-03      
  5      1.1475225E+02          2.64045347743E-02      
  6      5.1155569E+01          5.11860815749E-02      
  7      2.3682676E+01          4.08911101757E-02      
  8      1.0875484E+01         -6.43553000847E-02      
  9      4.9551310E+00         -2.01155072323E-01      
 10      2.2172670E+00         -1.39020911543E-01      
 11      3.2215400E-01          5.72467831515E-01      
P   1
  1      8.0641000E-01          1.0000000        
P   1
  1      1.1761900E-01          1.0000000        
D   7
  1      4.4616133E+02          1.44167086146E-03      
  2      1.3396477E+02          1.22544842461E-02      
  3      5.1345907E+01          5.62277692836E-02      
  4      2.1916906E+01          1.66550992244E-01      
  5      9.8937250E+00          3.16036882406E-01      
  6      4.4925270E+00          3.85631679714E-01      
  7      2.0022930E+00          2.75310315787E-01      
D   1
  1      8.0840900E-01          1.0000000        
D   1
  1      3.0060000E-01          1.0000000        
F   1
  1      6.6220000E-01          1.0000000        
$


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Li
data:
LITHIUM
S   8
  1   5988.0000000              0.00013237       
  2    898.9000000              0.00102211       
  3    205.9000000              0.00527588       
  4     59.2400000              0.02078064       
  5     19.8700000              0.06592446       
  6      7.4060000              0.16054282       
  7      2.9300000              0.29921270       
  8      1.1890000              0.30576640       
S   8
  1   5988.0000000             -0.00000060       
  2    898.9000000             -0.00000302       
  3     59.2400000             -0.00013601       
  4     19.8700000             -0.00038568       
  5      7.4060000             -0.00444707       
  6      2.9300000             -0.01333675       
  7      1.1890000             -0.07312955       
  8      0.4798000             -0.15864980       
S   1
  1      0.0750900              1.0000000        
S   1
  1      0.0283200              1.0000000        
P   3
  1      3.2660000              0.0086300        
  2      0.6511000              0.0475380        
  3      0.1696000              0.2097720        
P   1
  1      0.0557800              1.0000000        
P   1
  1      0.0205000              1.0000000        
D   1
  1      0.1874000              1.0000000        
D   1
  1      0.0801000              1.0000000        
F   1
  1      0.1829000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Be
data:
BERYLLIUM
S   8
  1   6863.0000000              0.00023697       
  2   1030.0000000              0.00183351       
  3    234.7000000              0.00949070       
  4     66.5600000              0.03811189       
  5     21.6900000              0.12044231       
  6      7.7340000              0.28323718       
  7      2.9160000              0.42869672       
  8      1.1300000              0.26626506       
S   8
  1   6863.0000000              0.00000046       
  2   1030.0000000              0.00000316       
  3     66.5600000             -0.00005417       
  4     21.6900000             -0.00145666       
  5      7.7340000             -0.00841851       
  6      2.9160000             -0.04806918       
  7      1.1300000             -0.11598660       
  8      0.1101000              0.76803258       
S   1
  1      0.2577000              1.0000000        
S   1
  1      0.0440900              1.0000000        
P   3
  1      7.4360000              0.0107360        
  2      1.5770000              0.0628540        
  3      0.4352000              0.2481800        
P   1
  1      0.1438000              1.0000000        
P   1
  1      0.0499400              1.0000000        
D   1
  1      0.3480000              1.0000000        
D   1
  1      0.1803000              1.0000000        
F   1
  1      0.3250000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: B
data:
BORON
S   7
  1   5473.0000000              0.00056047       
  2    820.9000000              0.00433323       
  3    186.8000000              0.02216427       
  4     52.8300000              0.08526216       
  5     17.0800000              0.24081715       
  6      5.9990000              0.43885032       
  7      2.2080000              0.34375171       
S   7
  1   5473.0000000              0.00000183       
  2    820.9000000              0.00001141       
  3     52.8300000             -0.00057275       
  4     17.0800000             -0.00649550       
  5      5.9990000             -0.03990123       
  6      2.2080000             -0.12711517       
  7      0.2415000              0.78684972       
S   1
  1      0.5879000              1.0000000        
S   1
  1      0.0861000              1.0000000        
P   3
  1     12.0500000              0.0131180        
  2      2.6130000              0.0798960        
  3      0.7475000              0.2772750        
P   1
  1      0.2385000              1.0000000        
P   1
  1      0.0769800              1.0000000        
D   1
  1      0.6610000              1.0000000        
D   1
  1      0.1990000              1.0000000        
F   1
  1      0.4900000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: C
data:
CARBON
S   7
  1   8236.0000000              0.00053670       
  2   1235.0000000              0.00415208       
  3    280.8000000              0.02131275       
  4     79.2700000              0.08272152       
  5     25.5900000              0.23725167       
  6      8.9970000              0.43854383       
  7      3.3190000              0.34837651       
S   7
  1   8236.0000000              0.00000174       
  2   1235.0000000              0.00000850       
  3     79.2700000             -0.00067257       
  4     25.5900000             -0.00686089       
  5      8.9970000             -0.04399137       
  6      3.3190000             -0.12633645       
  7      0.3643000              0.78671121       
S   1
  1      0.9059000              1.0000000        
S   1
  1      0.1285000              1.0000000        
P   3
  1     18.7100000              0.0140310        
  2      4.1330000              0.0868660        
  3      1.2000000              0.2902160        
P   1
  1      0.3827000              1.0000000        
P   1
  1      0.1209000              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.3180000              1.0000000        
F   1
  1      0.7610000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: N
data:
NITROGEN
S   7
  1  11420.0000000              0.00052898       
  2   1712.0000000              0.00409115       
  3    389.3000000              0.02101161       
  4    110.0000000              0.08163835       
  5     35.5700000              0.23564992       
  6     12.5400000              0.43792615       
  7      4.6440000              0.35006007       
S   7
  1  11420.0000000              0.00000185       
  2   1712.0000000              0.00000699       
  3    110.0000000             -0.00073647       
  4     35.5700000             -0.00718168       
  5     12.5400000             -0.04679022       
  6      4.6440000             -0.12512392       
  7      0.5118000              0.78627029       
S   1
  1      1.2930000              1.0000000        
S   1
  1      0.1787000              1.0000000        
P   3
  1     26.6300000              0.0146700        
  2      5.9480000              0.0917640        
  3      1.7420000              0.2986830        
P   1
  1      0.5550000              1.0000000        
P   1
  1      0.1725000              1.0000000        
D   1
  1      1.6540000              1.0000000        
D   1
  1      0.4690000              1.0000000        
F   1
  1      1.0930000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: O
data:
OXYGEN
S   7
  1  15330.0000000              0.00051408       
  2   2299.0000000              0.00397596       
  3    522.4000000              0.02048460       
  4    147.3000000              0.08011793       
  5     47.5500000              0.23336300       
  6     16.7600000              0.43777601       
  7      6.2070000              0.35313006       
S   7
  1  15330.0000000              0.00000176       
  2   2299.0000000              0.00000630       
  3    147.3000000             -0.00077290       
  4     47.5500000             -0.00737531       
  5     16.7600000             -0.04881128       
  6      6.2070000             -0.12510028       
  7      0.6882000              0.78780067       
S   1
  1      1.7520000              1.0000000        
S   1
  1      0.2384000              1.0000000        
P   3
  1     34.4600000              0.0159280        
  2      7.7490000              0.0997400        
  3      2.2800000              0.3104920        
P   1
  1      0.7156000              1.0000000        
P   1
  1      0.2140000              1.0000000        
D   1
  1      2.3140000              1.0000000        
D   1
  1      0.6450000              1.0000000        
F   1
  1      1.4280000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: F
data:
FLUORINE
S   7
  1  19500.0000000              0.00051317       
  2   2923.0000000              0.00397063       
  3    664.5000000              0.02044497       
  4    187.5000000              0.07995975       
  5     60.6200000              0.23315620       
  6     21.4200000              0.43760606       
  7      7.9500000              0.35294929       
S   7
  1  19500.0000000              0.00000182       
  2   2923.0000000              0.00000533       
  3    187.5000000             -0.00083067       
  4     60.6200000             -0.00763296       
  5     21.4200000             -0.05084396       
  6      7.9500000             -0.12415851       
  7      0.8815000              0.78784198       
S   1
  1      2.2570000              1.0000000        
S   1
  1      0.3041000              1.0000000        
P   3
  1     43.8800000              0.0166650        
  2      9.9260000              0.1044720        
  3      2.9300000              0.3172600        
P   1
  1      0.9132000              1.0000000        
P   1
  1      0.2672000              1.0000000        
D   1
  1      3.1070000              1.0000000        
D   1
  1      0.8550000              1.0000000        
F   1
  1      1.9170000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ne
data:
NEON
S   7
  1  24350.0000000              0.00050823       
  2   3650.0000000              0.00392910       
  3    829.6000000              0.02024455       
  4    234.0000000              0.07938036       
  5     75.6100000              0.23244288       
  6     26.7300000              0.43756632       
  7      9.9270000              0.35377001       
S   7
  1  24350.0000000              0.00000120       
  2   3650.0000000              0.00000568       
  3    234.0000000             -0.00085669       
  4     75.6100000             -0.00777524       
  5     26.7300000             -0.05216781       
  6      9.9270000             -0.12343198       
  7      1.1020000              0.78771889       
S   1
  1      2.8360000              1.0000000        
S   1
  1      0.3782000              1.0000000        
P   3
  1     54.7000000              0.0171510        
  2     12.4300000              0.1076560        
  3      3.6790000              0.3216810        
P   1
  1      1.1430000              1.0000000        
P   1
  1      0.3300000              1.0000000        
D   1
  1      4.0140000              1.0000000        
D   1
  1      1.0960000              1.0000000        
F   1
  1      2.5440000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Na
data:
SODIUM
S   12
  1 423000.0000000              0.00001806       
  2  63340.0000000              0.00014043       
  3  14410.0000000              0.00073845       
  4   4077.0000000              0.00311187       
  5   1328.0000000              0.01120829       
  6    478.6000000              0.03528361       
  7    186.2000000              0.09599265       
  8     76.9200000              0.21374731       
  9     33.3200000              0.34872680       
 10     15.0000000              0.32465964       
 11      6.8690000              0.11265222       
 12      2.6830000              0.00670647       
S   12
  1 423000.0000000              0.00000003       
  2  63340.0000000              0.00000014       
  3  14410.0000000              0.00000128       
  4   1328.0000000             -0.00000121       
  5    478.6000000             -0.00022002       
  6    186.2000000             -0.00136144       
  7     76.9200000             -0.00899851       
  8     33.3200000             -0.03414214       
  9     15.0000000             -0.09159224       
 10      6.8690000             -0.01797881       
 11      2.6830000              0.37594796       
 12      1.1090000              0.62159455       
S   12
  1 423000.0000000              0.00000007       
  2  63340.0000000              0.00000032       
  3  14410.0000000              0.00000298       
  4    478.6000000             -0.00048984       
  5    186.2000000             -0.00298653       
  6     76.9200000             -0.01998258       
  7     33.3200000             -0.07538099       
  8     15.0000000             -0.20300446       
  9      6.8690000             -0.03867926       
 10      2.6830000              0.82337412       
 11      1.1090000              1.34351812       
 12      0.0601500              0.81655145       
S   1
  1      0.4540000              1.0000000        
S   1
  1      0.0238200              1.0000000        
P   7
  1    243.3000000              0.00224410       
  2     57.3900000              0.01740132       
  3     18.1000000              0.07741973       
  4      6.5750000              0.21912976       
  5      2.5210000              0.37856395       
  6      0.9607000              0.39500854       
  7      0.3512000              0.16047908       
P   7
  1     57.3900000             -0.00004219       
  2     18.1000000             -0.00018968       
  3      6.5750000             -0.00185735       
  4      2.5210000             -0.00212049       
  5      0.9607000             -0.01359725       
  6      0.3512000             -0.00766425       
  7      0.0982700              0.42316543       
P   1
  1      0.0373400              1.0000000        
P   1
  1      0.0150000              1.0000000        
D   1
  1      0.1367000              1.0000000        
D   1
  1      0.0636000              1.0000000        
F   1
  1      0.1397000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Mg
data:
MAGNESIUM
S   11
  1 164900.0000000              0.00007299       
  2  24710.0000000              0.00056663       
  3   5628.0000000              0.00296255       
  4   1596.0000000              0.01229586       
  5    521.0000000              0.04273194       
  6    188.0000000              0.12302264       
  7     73.0100000              0.27489904       
  8     29.9000000              0.40215007       
  9     12.5400000              0.26520544       
 10      4.3060000              0.03205631       
 11      1.8260000             -0.00788236       
S   11
  1 164900.0000000              0.00000024       
  2  24710.0000000              0.00000140       
  3   5628.0000000              0.00000889       
  4    521.0000000             -0.00012231       
  5    188.0000000             -0.00216553       
  6     73.0100000             -0.01239675       
  7     29.9000000             -0.05692040       
  8     12.5400000             -0.08571365       
  9      4.3060000              0.20049608       
 10      1.8260000              0.58174847       
 11      0.7417000              0.37181130       
S   11
  1 164900.0000000              0.00000002       
  2  24710.0000000              0.00000010       
  3   5628.0000000              0.00000088       
  4    188.0000000             -0.00012841       
  5     73.0100000             -0.00061244       
  6     29.9000000             -0.00305919       
  7     12.5400000             -0.00344431       
  8      4.3060000              0.00527255       
  9      1.8260000             -0.01010335       
 10      0.7417000             -0.17126047       
 11      0.0761200              0.74321212       
S   1
  1      0.1457000              1.0000000        
S   1
  1      0.0331000              1.0000000        
P   7
  1    316.9000000              0.00207625       
  2     74.8600000              0.01629423       
  3     23.7200000              0.07389855       
  4      8.6690000              0.21436913       
  5      3.3630000              0.38224438       
  6      1.3100000              0.39817876       
  7      0.4911000              0.15261673       
P   7
  1     74.8600000              0.00000028       
  2     23.7200000             -0.00040306       
  3      8.6690000             -0.00223864       
  4      3.3630000             -0.00752997       
  5      1.3100000             -0.01648498       
  6      0.4911000             -0.03051878       
  7      0.2364000              0.40482820       
P   1
  1      0.0873300              1.0000000        
P   1
  1      0.0323700              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.2940000              1.0000000        
F   1
  1      0.2520000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Al
data:
ALUMINUM
S   11
  1 205500.0000000              0.00006788       
  2  30780.0000000              0.00052711       
  3   7006.0000000              0.00276184       
  4   1985.0000000              0.01147219       
  5    649.1000000              0.03981763       
  6    235.0000000              0.11504636       
  7     91.6200000              0.26094925       
  8     37.6700000              0.39670451       
  9     15.9100000              0.28518359       
 10      5.8500000              0.04356782       
 11      2.5420000             -0.00846385       
S   11
  1 205500.0000000              0.00000018       
  2  30780.0000000              0.00000119       
  3   7006.0000000              0.00000616       
  4    649.1000000             -0.00015117       
  5    235.0000000             -0.00196120       
  6     91.6200000             -0.01197597       
  7     37.6700000             -0.05337437       
  8     15.9100000             -0.09476540       
  9      5.8500000              0.14013667       
 10      2.5420000              0.56626659       
 11      1.0570000              0.43957416       
S   11
  1 205500.0000000              0.00000002       
  2  30780.0000000              0.00000008       
  3   7006.0000000              0.00000071       
  4    235.0000000             -0.00010363       
  5     91.6200000             -0.00049434       
  6     37.6700000             -0.00246131       
  7     15.9100000             -0.00288220       
  8      5.8500000              0.00221687       
  9      2.5420000             -0.01772537       
 10      1.0570000             -0.19456360       
 11      0.1455000              0.83916779       
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
P   6
  1    444.4000000              0.00173391       
  2    105.1000000              0.01392263       
  3     33.4700000              0.06522521       
  4     12.3300000              0.20017866       
  5      4.8690000              0.38394850       
  6      1.9610000              0.43558565       
P   6
  1    105.1000000             -0.00017480       
  2     33.4700000             -0.00013319       
  3     12.3300000             -0.00475968       
  4      4.8690000             -0.00098982       
  5      1.9610000             -0.03568968       
  6      0.1888000              0.71046193       
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
D   1
  1      0.1090000              1.0000000        
D   1
  1      0.3330000              1.0000000        
F   1
  1      0.2440000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Si
data:
SILICON
S   11
  1 254900.0000000              0.00006251       
  2  38190.0000000              0.00048552       
  3   8690.0000000              0.00254498       
  4   2462.0000000              0.01058597       
  5    804.8000000              0.03687741       
  6    291.3000000              0.10748259       
  7    113.6000000              0.24798550       
  8     46.7500000              0.39118703       
  9     19.8200000              0.30257711       
 10      7.7080000              0.05537785       
 11      3.3400000             -0.00712512       
S   11
  1 254900.0000000              0.00000014       
  2  38190.0000000              0.00000102       
  3   8690.0000000              0.00000430       
  4    804.8000000             -0.00016040       
  5    291.3000000             -0.00176214       
  6    113.6000000             -0.01137378       
  7     46.7500000             -0.05015152       
  8     19.8200000             -0.10096384       
  9      7.7080000              0.09639297       
 10      3.3400000              0.55498165       
 11      1.4020000              0.48600827       
S   11
  1 254900.0000000              0.00000001       
  2  38190.0000000              0.00000006       
  3   8690.0000000              0.00000051       
  4    291.3000000             -0.00007508       
  5    113.6000000             -0.00036120       
  6     46.7500000             -0.00176812       
  7     19.8200000             -0.00195575       
  8      7.7080000              0.00069489       
  9      3.3400000             -0.02685967       
 10      1.4020000             -0.21621457       
 11      0.2070000              0.86305744       
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
P   6
  1    481.5000000              0.00200073       
  2    113.9000000              0.01599801       
  3     36.2300000              0.07438558       
  4     13.3400000              0.22198821       
  5      5.2520000              0.40669611       
  6      2.1200000              0.41039719       
P   6
  1    113.9000000             -0.00016001       
  2     36.2300000             -0.00029669       
  3     13.3400000             -0.00533559       
  4      5.2520000             -0.00421638       
  5      2.1200000             -0.03908399       
  6      0.2528000              0.74339997       
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
D   1
  1      0.1590000              1.0000000        
D   1
  1      0.4810000              1.0000000        
F   1
  1      0.3360000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: P
data:
PHOSPHORUS
S   11
  1 312400.0000000              0.00005769       
  2  46800.0000000              0.00044827       
  3  10650.0000000              0.00234925       
  4   3018.0000000              0.00978211       
  5    986.8000000              0.03414554       
  6    357.4000000              0.10020529       
  7    139.6000000              0.23440516       
  8     57.6300000              0.38261335       
  9     24.6000000              0.31852212       
 10     10.1200000              0.07052989       
 11      4.2830000             -0.00412590       
S   11
  1 312400.0000000              0.00000010       
  2  46800.0000000              0.00000084       
  3  10650.0000000              0.00000264       
  4    986.8000000             -0.00016737       
  5    357.4000000             -0.00157765       
  6    139.6000000             -0.01067979       
  7     57.6300000             -0.04642729       
  8     24.6000000             -0.10482865       
  9     10.1200000              0.05692825       
 10      4.2830000              0.53986949       
 11      1.8050000              0.52891840       
S   11
  1 312400.0000000              0.00000001       
  2  46800.0000000              0.00000005       
  3  10650.0000000              0.00000049       
  4    357.4000000             -0.00007186       
  5    139.6000000             -0.00034880       
  6     57.6300000             -0.00173921       
  7     24.6000000             -0.00210497       
  8     10.1200000              0.00061789       
  9      4.2830000             -0.02581562       
 10      1.8050000             -0.22812942       
 11      0.2782000              0.88113942       
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
P   6
  1    504.9000000              0.00238498       
  2    119.4000000              0.01891905       
  3     37.9600000              0.08670049       
  4     13.9500000              0.24958297       
  5      5.4570000              0.43133755       
  6      2.1770000              0.37583743       
P   6
  1    119.4000000             -0.00007157       
  2     37.9600000             -0.00058994       
  3     13.9500000             -0.00479764       
  4      5.4570000             -0.01113460       
  5      2.1770000             -0.02369496       
  6      0.2877000              0.75524298       
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
D   1
  1      0.2160000              1.0000000        
D   1
  1      0.6520000              1.0000000        
F   1
  1      0.4520000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: S
data:
SULFUR
S   11
  1 374100.0000000              0.00005421       
  2  56050.0000000              0.00042083       
  3  12760.0000000              0.00220688       
  4   3615.0000000              0.00919218       
  5   1183.0000000              0.03211143       
  6    428.8000000              0.09466869       
  7    167.8000000              0.22365199       
  8     69.4700000              0.37451309       
  9     29.8400000              0.32942648       
 10     12.7200000              0.08459822       
 11      5.2440000             -0.00120266       
S   11
  1 374100.0000000              0.00000008       
  2  56050.0000000              0.00000073       
  3  12760.0000000              0.00000156       
  4   1183.0000000             -0.00017063       
  5    428.8000000             -0.00144297       
  6    167.8000000             -0.01013876       
  7     69.4700000             -0.04355588       
  8     29.8400000             -0.10645153       
  9     12.7200000              0.03255928       
 10      5.2440000              0.52989908       
 11      2.2190000              0.55427692       
S   11
  1 374100.0000000              0.00000001       
  2  56050.0000000              0.00000004       
  3  12760.0000000              0.00000033       
  4    428.8000000             -0.00004894       
  5    167.8000000             -0.00023365       
  6     69.4700000             -0.00111784       
  7     29.8400000             -0.00100911       
  8     12.7200000              0.00053449       
  9      5.2440000             -0.03440730       
 10      2.2190000             -0.24553177       
 11      0.3490000              0.89044878       
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
P   6
  1    574.4000000              0.00245950       
  2    135.8000000              0.01957291       
  3     43.1900000              0.08988185       
  4     15.8700000              0.25849862       
  5      6.2080000              0.44047201       
  6      2.4830000              0.36029891       
P   6
  1    135.8000000             -0.00000523       
  2     43.1900000             -0.00078839       
  3     15.8700000             -0.00437243       
  4      6.2080000             -0.01678386       
  5      2.4830000             -0.00798484       
  6      0.3229000              0.74417306       
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
F   1
  1      0.5570000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cl
data:
CHLORINE
S   11
  1 456100.0000000              0.00004930       
  2  68330.0000000              0.00038302       
  3  15550.0000000              0.00200848       
  4   4405.0000000              0.00838534       
  5   1439.0000000              0.02946977       
  6    520.4000000              0.08783241       
  7    203.1000000              0.21148481       
  8     83.9600000              0.36543021       
  9     36.2000000              0.34107709       
 10     15.8300000              0.10211190       
 11      6.3340000              0.00214144       
S   11
  1 456100.0000000              0.00000005       
  2  68330.0000000              0.00000060       
  3  15550.0000000              0.00000053       
  4   1439.0000000             -0.00016510       
  5    520.4000000             -0.00126912       
  6    203.1000000             -0.00937050       
  7     83.9600000             -0.04021004       
  8     36.2000000             -0.10654733       
  9     15.8300000              0.00948710       
 10      6.3340000              0.51584431       
 11      2.6940000              0.57913764       
S   11
  1 456100.0000000              0.00000001       
  2  68330.0000000              0.00000003       
  3  15550.0000000              0.00000028       
  4    520.4000000             -0.00004245       
  5    203.1000000             -0.00020761       
  6     83.9600000             -0.00100346       
  7     36.2000000             -0.00092446       
  8     15.8300000              0.00076373       
  9      6.3340000             -0.03499594       
 10      2.6940000             -0.25495618       
 11      0.4313000              0.90028457       
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
P   6
  1    663.3000000              0.00243891       
  2    156.8000000              0.01949011       
  3     49.9800000              0.08977154       
  4     18.4200000              0.25965851       
  5      7.2400000              0.44305597       
  6      2.9220000              0.35535305       
P   6
  1    156.8000000              0.00002226       
  2     49.9800000             -0.00090089       
  3     18.4200000             -0.00442340       
  4      7.2400000             -0.02032677       
  5      2.9220000              0.00031901       
  6      0.3818000              0.73762441       
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ar
data:
ARGON
S   11
  1 545000.0000000              0.00004558       
  2  81640.0000000              0.00035410       
  3  18580.0000000              0.00185795       
  4   5261.0000000              0.00776841       
  5   1717.0000000              0.02742300       
  6    619.9000000              0.08238353       
  7    241.6000000              0.20123473       
  8     99.7900000              0.35680757       
  9     43.1500000              0.34964569       
 10     19.1400000              0.11827097       
 11      7.4880000              0.00518884       
S   11
  1 545000.0000000              0.00000004       
  2  81640.0000000              0.00000051       
  3  18580.0000000             -0.00000008       
  4   1717.0000000             -0.00015850       
  5    619.9000000             -0.00114105       
  6    241.6000000             -0.00873152       
  7     99.7900000             -0.03755605       
  8     43.1500000             -0.10563244       
  9     19.1400000             -0.00783901       
 10      7.4880000              0.50322656       
 11      3.2050000              0.59773139       
S   11
  1 545000.0000000              0.00000001       
  2  81640.0000000              0.00000003       
  3  18580.0000000              0.00000024       
  4    619.9000000             -0.00003652       
  5    241.6000000             -0.00018121       
  6     99.7900000             -0.00087780       
  7     43.1500000             -0.00077047       
  8     19.1400000              0.00101525       
  9      7.4880000             -0.03616140       
 10      3.2050000             -0.26318234       
 11      0.5204000              0.90746711       
S   1
  1      1.1960000              1.0000000        
S   1
  1      0.1954000              1.0000000        
P   6
  1    761.8000000              0.00240269       
  2    180.2000000              0.01928445       
  3     57.5000000              0.08929747       
  4     21.2400000              0.25990586       
  5      8.3880000              0.44464010       
  6      3.4160000              0.35244184       
P   6
  1    180.2000000              0.00003653       
  2     57.5000000             -0.00098116       
  3     21.2400000             -0.00462553       
  4      8.3880000             -0.02303865       
  5      3.4160000              0.00599348       
  6      0.4523000              0.73378321       
P   1
  1      1.2060000              1.0000000        
P   1
  1      0.1545000              1.0000000        
D   1
  1      0.4100000              1.0000000        
D   1
  1      1.2540000              1.0000000        
F   1
  1      0.8900000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   15
  1 6558157.3000000             0.00000800       
  2 982025.3400000              0.00006220       
  3 223467.6900000              0.00032701       
  4  63288.2910000              0.00137940       
  5  20642.9400000              0.00499845       
  6   7450.5224000              0.01605256       
  7   2905.0744000              0.04594568       
  8   1204.2100000              0.11481758       
  9    524.3045400              0.23535988       
 10    237.4656300              0.34598908       
 11    110.5786600              0.27759527       
 12     51.3746240              0.08587120       
 13     24.4408460              0.06376571       
 14     11.7685910              0.06898293       
 15      5.3421190              0.01326647       
S   14
  1 6558157.3000000            -0.00000002       
  2 223467.6900000              0.00000009       
  3  20642.9400000             -0.00000666       
  4   7450.5224000             -0.00006251       
  5   2905.0744000             -0.00052565       
  6   1204.2100000             -0.00318951       
  7    524.3045400             -0.01601207       
  8    237.4656300             -0.05680927       
  9    110.5786600             -0.10995882       
 10     51.3746240              0.03670142       
 11     24.4408460              0.49656133       
 12     11.7685910              0.53130695       
 13      5.3421190              0.11020454       
 14      2.4950360             -0.00388732       
S   15
  1 6558157.3000000            -0.00000005       
  2 982025.3400000              0.00000004       
  3 223467.6900000              0.00000002       
  4   7450.5224000              0.00000385       
  5   2905.0744000              0.00001987       
  6   1204.2100000              0.00016246       
  7    524.3045400              0.00076851       
  8    237.4656300              0.00347050       
  9    110.5786600              0.00822196       
 10     51.3746240             -0.00025760       
 11     24.4408460             -0.10978347       
 12     11.7685910             -0.27505583       
 13      5.3421190              0.12979210       
 14      2.4950360              0.71958620       
 15      1.0987730              0.43322985       
S   15
  1 6558157.3000000             0.00000001       
  2 982025.3400000             -0.00000005       
  3 223467.6900000             -0.00000002       
  4   2905.0744000              0.00000561       
  5   1204.2100000              0.00002567       
  6    524.3045400              0.00014226       
  7    237.4656300              0.00024796       
  8    110.5786600             -0.00018862       
  9     51.3746240             -0.00081790       
 10     24.4408460              0.02853744       
 11     11.7685910              0.09006843       
 12      5.3421190             -0.04817356       
 13      2.4950360             -0.20307845       
 14      1.0987730              0.10641637       
 15      0.2601800             -0.52790736       
S   1
  1      0.1270790              1.0000000        
S   1
  1      0.0544080              1.0000000        
P   9
  1   8050.1674000              0.00031690       
  2   1907.5361000              0.00276480       
  3    618.6274600              0.01512063       
  4    235.3241700              0.05995976       
  5     98.8996460              0.17332393       
  6     44.2482150              0.34111820       
  7     20.6174290              0.38976530       
  8      9.7805160              0.18373841       
  9      4.4412380              0.02096367       
P   9
  1   8050.1674000             -0.00000094       
  2    618.6274600             -0.00007229       
  3    235.3241700             -0.00025851       
  4     98.8996460             -0.00258117       
  5     44.2482150             -0.00619712       
  6     20.6174290             -0.01487549       
  7      9.7805160              0.04999996       
  8      4.4412380              0.16478326       
  9      1.9640450              0.24875643       
P   9
  1   8050.1674000              0.00000145       
  2    235.3241700             -0.00068029       
  3     98.8996460             -0.00398694       
  4     44.2482150             -0.01757094       
  5     20.6174290             -0.02287088       
  6      9.7805160              0.09046535       
  7      4.4412380              0.42938682       
  8      1.9640450              0.39753850       
  9      0.8335780              0.28929412       
P   1
  1      0.1934450              1.0000000        
P   1
  1      0.0561170              1.0000000        
D   7
  1    244.1474100              0.0020270        
  2     73.0675950              0.0165088        
  3     27.5920810              0.0703823        
  4     11.5465180              0.1911430        
  5      5.0486280              0.3254092        
  6      2.1784650              0.3678199        
  7      0.9002530              0.2744685        
D   1
  1      0.3373270              1.0000000        
D   1
  1      0.1169000              1.0000000        
F   1
  1      0.2881000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   15
  1 7447966.8000000             0.00000740       
  2 1115318.2000000             0.00005739       
  3 253842.6500000              0.00030190       
  4  71915.2850000              0.00127330       
  5  23470.1810000              0.00460994       
  6   8477.4918000              0.01480236       
  7   3308.3908000              0.04238668       
  8   1372.6054000              0.10631536       
  9    598.2200700              0.21942294       
 10    271.3860200              0.32697184       
 11    126.9779500              0.26576068       
 12     60.2220650              0.10109853       
 13     28.0185820              0.16802391       
 14     13.5175220              0.20042655       
 15      6.3094060              0.04923385       
S   14
  1 1115318.2000000            -0.00000003       
  2 253842.6500000             -0.00000001       
  3  23470.1810000             -0.00000661       
  4   8477.4918000             -0.00005335       
  5   3308.3908000             -0.00046763       
  6   1372.6054000             -0.00277366       
  7    598.2200700             -0.01427179       
  8    271.3860200             -0.05137746       
  9    126.9779500             -0.10859001       
 10     60.2220650              0.00568907       
 11     28.0185820              0.45912941       
 12     13.5175220              0.55867647       
 13      6.3094060              0.13923015       
 14      2.9045340             -0.00092042       
S   14
  1 7447966.8000000             0.00000001       
  2 253842.6500000             -0.00000004       
  3   8477.4918000              0.00000052       
  4   3308.3908000              0.00000322       
  5   1372.6054000              0.00003244       
  6    598.2200700              0.00019678       
  7    271.3860200              0.00121903       
  8    126.9779500              0.00438777       
  9     60.2220650              0.00249005       
 10     28.0185820             -0.08048865       
 11     13.5175220             -0.27204617       
 12      6.3094060              0.07258310       
 13      2.9045340              0.74610549       
 14      1.2875560              0.49435091       
S   15
  1 7447966.8000000             0.00000007       
  2 1115318.2000000            -0.00000004       
  3 253842.6500000             -0.00000009       
  4   3308.3908000             -0.00000358       
  5   1372.6054000             -0.00000367       
  6    598.2200700              0.00003661       
  7    271.3860200              0.00104059       
  8    126.9779500              0.00557838       
  9     60.2220650              0.00463536       
 10     28.0185820             -0.13675848       
 11     13.5175220             -0.48384896       
 12      6.3094060              0.13404429       
 13      2.9045340              1.30770146       
 14      1.2875560              0.66509300       
 15      0.1677320              0.77399467       
S   1
  1      0.3365520              1.0000000        
S   1
  1      0.0710690              1.0000000        
P   9
  1   6979.5982000              0.00045689       
  2   1654.1648000              0.00395615       
  3    536.0286500              0.02131436       
  4    203.5371300              0.08187628       
  5     85.2375300              0.22240500       
  6     37.8419620              0.39067982       
  7     17.4065120              0.35608076       
  8      7.8814920              0.10592478       
  9      3.5332130              0.00113089       
P   9
  1   6979.5982000              0.00000118       
  2    536.0286500             -0.00006994       
  3    203.5371300             -0.00121937       
  4     85.2375300             -0.00725963       
  5     37.8419620             -0.02487722       
  6     17.4065120             -0.00920431       
  7      7.8814920              0.23155412       
  8      3.5332130              0.53687029       
  9      1.5214730              0.40442235       
P   9
  1   6979.5982000              0.00000054       
  2    203.5371300             -0.00022785       
  3     85.2375300             -0.00116713       
  4     37.8419620             -0.00466973       
  5     17.4065120             -0.00106762       
  6      7.8814920              0.03555017       
  7      3.5332130              0.08661539       
  8      1.5214730              0.02986223       
  9      0.1990930              0.75798364       
P   1
  1      0.5627040              1.0000000        
P   1
  1      0.0670310              1.0000000        
D   7
  1    282.2391100              0.0018275        
  2     84.5499570              0.0151545        
  3     32.0736560              0.0660460        
  4     13.4974950              0.1839470        
  5      5.9585500              0.3227872        
  6      2.6107880              0.3729459        
  7      1.1039870              0.2751730        
D   1
  1      0.4240490              1.0000000        
D   1
  1      0.1520000              1.0000000        
F   1
  1      0.3458000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   15
  1 8482339.6000000             0.00000680       
  2 1270150.9000000             0.00005280       
  3 289056.9600000              0.00027740       
  4  81879.8490000              0.00117020       
  5  26716.5640000              0.00424225       
  6   9647.5842000              0.01365671       
  7   3764.1195000              0.03934896       
  8   1561.5656000              0.09998182       
  9    680.8146700              0.21243188       
 10    309.2411900              0.33739562       
 11    145.2573600              0.31780963       
 12     69.7390480              0.11854144       
 13     31.7703250             -0.00115394       
 14     15.3917570             -0.01222325       
 15      7.3415260             -0.00383488       
S   14
  1 8482339.6000000             0.00000002       
  2 1270150.9000000            -0.00000002       
  3  26716.5640000             -0.00000665       
  4   9647.5842000             -0.00004641       
  5   3764.1195000             -0.00041659       
  6   1561.5656000             -0.00242107       
  7    680.8146700             -0.01271823       
  8    309.2411900             -0.04643580       
  9    145.2573600             -0.10571369       
 10     69.7390480             -0.01886969       
 11     31.7703250              0.42145361       
 12     15.3917570              0.57684599       
 13      7.3415260              0.16956125       
 14      3.3237160              0.00359968       
S   15
  1 8482339.6000000            -0.00000002       
  2 1270150.9000000            -0.00000003       
  3 289056.9600000             -0.00000004       
  4   9647.5842000             -0.00000096       
  5   3764.1195000             -0.00000087       
  6   1561.5656000             -0.00001384       
  7    680.8146700              0.00001883       
  8    309.2411900              0.00035257       
  9    145.2573600              0.00274213       
 10     69.7390480              0.00305011       
 11     31.7703250             -0.06019926       
 12     15.3917570             -0.25564275       
 13      7.3415260              0.01980290       
 14      3.3237160              0.71569363       
 15      1.4858670              0.52422834       
S   15
  1 8482339.6000000             0.00000003       
  2 1270150.9000000            -0.00000004       
  3 289056.9600000             -0.00000001       
  4   3764.1195000             -0.00000139       
  5   1561.5656000             -0.00001035       
  6    680.8146700             -0.00007234       
  7    309.2411900             -0.00036923       
  8    145.2573600             -0.00131600       
  9     69.7390480             -0.00103221       
 10     31.7703250              0.01961043       
 11     15.3917570              0.07807420       
 12      7.3415260             -0.00507557       
 13      3.3237160             -0.26618958       
 14      1.4858670             -0.42218649       
 15      0.2115000              0.82286594       
S   1
  1      0.4210860              1.0000000        
S   1
  1      0.0889740              1.0000000        
P   9
  1   7423.8614000              0.00045989       
  2   1759.5166000              0.00398225       
  3    570.2291600              0.02146386       
  4    216.5799700              0.08246663       
  5     90.7342520              0.22392290       
  6     40.3087910              0.39218752       
  7     18.5555020              0.35425572       
  8      8.3965430              0.10371914       
  9      3.7673670              0.00077918       
P   9
  1   7423.8614000              0.00000125       
  2    570.2291600             -0.00007059       
  3    216.5799700             -0.00126010       
  4     90.7342520             -0.00747796       
  5     40.3087910             -0.02568253       
  6     18.5555020             -0.00763838       
  7      8.3965430              0.24066580       
  8      3.7673670              0.54498893       
  9      1.6297010              0.39094641       
P   9
  1   7423.8614000             -0.00000014       
  2    216.5799700              0.00004686       
  3     90.7342520              0.00025544       
  4     40.3087910              0.00111677       
  5     18.5555020             -0.00020831       
  6      8.3965430             -0.01529409       
  7      3.7673670             -0.04295202       
  8      1.6297010             -0.05210428       
  9      0.2225030              0.76045650       
P   1
  1      0.5682630              1.0000000        
P   1
  1      0.0804050              1.0000000        
D   7
  1    321.0196100              0.0016840        
  2     96.2493050              0.0141586        
  3     36.6449630              0.0628259        
  4     15.4939650              0.1784993        
  5      6.8911380              0.3209452        
  6      3.0548310              0.3773515        
  7      1.3142410              0.2750231        
D   1
  1      0.5134300              1.0000000        
D   1
  1      0.1877000              1.0000000        
F   1
  1      0.4158000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   15
  1 9563600.0000000             0.00000630       
  2 1432100.0000000             0.00004890       
  3 325910.0000000              0.00025740       
  4  92312.0000000              0.00108610       
  5  30116.0000000              0.00393979       
  6  10872.0000000              0.01270337       
  7   4240.1000000              0.03670892       
  8   1758.4000000              0.09382879       
  9    766.5900000              0.20156259       
 10    348.4300000              0.32729445       
 11    164.0300000              0.32200298       
 12     79.1420000              0.13458083       
 13     35.5240000              0.01864601       
 14     17.3050000              0.01015135       
 15      8.3784000              0.00369398       
S   15
  1 9563600.0000000            -0.00000003       
  2 1432100.0000000             0.00000001       
  3 325910.0000000             -0.00000002       
  4  30116.0000000             -0.00000633       
  5  10872.0000000             -0.00004072       
  6   4240.1000000             -0.00037344       
  7   1758.4000000             -0.00214873       
  8    766.5900000             -0.01147899       
  9    348.4300000             -0.04251374       
 10    164.0300000             -0.10245491       
 11     79.1420000             -0.03653750       
 12     35.5240000              0.38829415       
 13     17.3050000              0.58691452       
 14      8.3784000              0.19742004       
 15      3.7405000              0.00826106       
S   14
  1 9563600.0000000             0.00000001       
  2 1432100.0000000            -0.00000002       
  3  10872.0000000             -0.00000303       
  4   4240.1000000             -0.00002261       
  5   1758.4000000             -0.00016671       
  6    766.5900000             -0.00078872       
  7    348.4300000             -0.00283705       
  8    164.0300000             -0.00481791       
  9     79.1420000              0.00072573       
 10     35.5240000             -0.02308023       
 11     17.3050000             -0.20946856       
 12      8.3784000             -0.00568971       
 13      3.7405000              0.70703055       
 14      1.6890000              0.55976280       
S   15
  1 9563600.0000000             0.00000004       
  2 1432100.0000000            -0.00000006       
  3 325910.0000000             -0.00000004       
  4   4240.1000000              0.00000009       
  5   1758.4000000             -0.00000396       
  6    766.5900000             -0.00002024       
  7    348.4300000             -0.00012587       
  8    164.0300000             -0.00038601       
  9     79.1420000             -0.00046110       
 10     35.5240000              0.00563927       
 11     17.3050000              0.02600202       
 12      8.3784000              0.00376199       
 13      3.7405000             -0.12768051       
 14      1.6890000             -0.34464332       
 15      0.2552000              0.84212156       
S   1
  1      0.5092700              1.0000000        
S   1
  1      0.1065100              1.0000000        
P   9
  1   8004.3000000              0.00045049       
  2   1896.9000000              0.00390485       
  3    614.7100000              0.02109016       
  4    233.5000000              0.08129679       
  5     97.8560000              0.22181651       
  6     43.5140000              0.39084321       
  7     20.0630000              0.35600728       
  8      9.1127000              0.10620681       
  9      4.1063000              0.00114655       
P   9
  1   8004.3000000              0.00000115       
  2    614.7100000             -0.00007294       
  3    233.5000000             -0.00125757       
  4     97.8560000             -0.00756684       
  5     43.5140000             -0.02603015       
  6     20.0630000             -0.00862412       
  7      9.1127000              0.24008483       
  8      4.1063000              0.54864451       
  9      1.7949000              0.38835284       
P   9
  1   8004.3000000             -0.00000043       
  2    233.5000000              0.00021183       
  3     97.8560000              0.00110364       
  4     43.5140000              0.00463024       
  5     20.0630000              0.00020335       
  6      9.1127000             -0.04543565       
  7      4.1063000             -0.12139271       
  8      1.7949000             -0.09666532       
  9      0.2461500              0.75033619       
P   1
  1      0.6243200              1.0000000        
P   1
  1      0.0889170              1.0000000        
D   7
  1    361.8500000              0.0015655        
  2    108.5500000              0.0133262        
  3     41.4330000              0.0601527        
  4     17.5790000              0.1740293        
  5      7.8627000              0.3195690        
  6      3.5180000              0.3812029        
  7      1.5348000              0.2746086        
D   1
  1      0.6081300              1.0000000        
D   1
  1      0.2220000              1.0000000        
F   1
  1      0.4620000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   15
  1 10639000.0000000            0.00000590       
  2 1593400.0000000             0.00004610       
  3 362610.0000000              0.00024220       
  4 102700.0000000              0.00102260       
  5  33501.0000000              0.00371114       
  6  12093.0000000              0.01197752       
  7   4715.9000000              0.03468366       
  8   1955.6000000              0.08907219       
  9    852.6100000              0.19317644       
 10    387.6700000              0.31985383       
 11    182.6800000              0.32728824       
 12     88.2450000              0.14810895       
 13     39.2630000              0.02454580       
 14     19.2340000              0.01479702       
 15      9.4057000              0.00631708       
S   15
  1 10639000.0000000           -0.00000005       
  2 1593400.0000000            -0.00000003       
  3 362610.0000000             -0.00000007       
  4  33501.0000000             -0.00000590       
  5  12093.0000000             -0.00003667       
  6   4715.9000000             -0.00034043       
  7   1955.6000000             -0.00195092       
  8    852.6100000             -0.01054246       
  9    387.6700000             -0.03957580       
 10    182.6800000             -0.09950236       
 11     88.2450000             -0.04919614       
 12     39.2630000              0.36053462       
 13     19.2340000              0.59217869       
 14      9.4057000              0.22178153       
 15      4.1601000              0.01266713       
S   15
  1 10639000.0000000           -0.00000006       
  2 1593400.0000000            -0.00000007       
  3 362610.0000000              0.00000006       
  4  12093.0000000             -0.00000365       
  5   4715.9000000             -0.00002348       
  6   1955.6000000             -0.00017889       
  7    852.6100000             -0.00083654       
  8    387.6700000             -0.00315189       
  9    182.6800000             -0.00583710       
 10     88.2450000             -0.00053066       
 11     39.2630000             -0.01452266       
 12     19.2340000             -0.19749527       
 13      9.4057000             -0.03233373       
 14      4.1601000              0.69515763       
 15      1.8995000              0.58634865       
S   15
  1 10639000.0000000            0.00000002       
  2 1593400.0000000            -0.00000006       
  3 362610.0000000             -0.00000002       
  4   4715.9000000             -0.00000225       
  5   1955.6000000             -0.00001550       
  6    852.6100000             -0.00009734       
  7    387.6700000             -0.00042732       
  8    182.6800000             -0.00135694       
  9     88.2450000             -0.00127446       
 10     39.2630000              0.01243515       
 11     19.2340000              0.05566674       
 12      9.4057000              0.01534391       
 13      4.1601000             -0.20074989       
 14      1.8995000             -0.42740586       
 15      0.3011400              0.86201145       
S   1
  1      0.6047200              1.0000000        
S   1
  1      0.1251500              1.0000000        
P   9
  1   8676.5000000              0.00043569       
  2   2055.9000000              0.00378145       
  3    666.2300000              0.02047825       
  4    253.1000000              0.07928788       
  5    106.1200000              0.21787877       
  6     47.2420000              0.38797206       
  7     21.8250000              0.35947991       
  8      9.9684000              0.11112870       
  9      4.5171000              0.00188585       
P   9
  1   8676.5000000              0.00000107       
  2    666.2300000             -0.00007535       
  3    253.1000000             -0.00123317       
  4    106.1200000             -0.00757393       
  5     47.2420000             -0.02613767       
  6     21.8250000             -0.01088274       
  7      9.9684000              0.23461081       
  8      4.5171000              0.55035624       
  9      1.9982000              0.39215936       
P   9
  1   8676.5000000             -0.00000058       
  2    253.1000000              0.00027989       
  3    106.1200000              0.00147894       
  4     47.2420000              0.00623968       
  5     21.8250000              0.00085353       
  6      9.9684000             -0.05797561       
  7      4.5171000             -0.15922769       
  8      1.9982000             -0.11898101       
  9      0.2814500              0.74578140       
P   1
  1      0.7098800              1.0000000        
P   1
  1      0.1020400              1.0000000        
D   7
  1    403.8300000              0.0014732        
  2    121.1700000              0.0126725        
  3     46.3450000              0.0580451        
  4     19.7210000              0.1705103        
  5      8.8624000              0.3185958        
  6      3.9962000              0.3845023        
  7      1.7636000              0.2737737        
D   1
  1      0.7061900              1.0000000        
D   1
  1      0.2639000              1.0000000        
F   1
  1      0.5515000              1.0000000


name: cc-pVTZ(seg-opt)
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Kr
data:
KRYPTON
S   15
  1 11718113.0000000            0.00000560       
  2 1754604.4000000             0.00004380       
  3 399281.3200000              0.00023050       
  4 113084.5700000              0.00097330       
  5  36885.9250000              0.00353353       
  6  13312.2090000              0.01141569       
  7   5189.9883000              0.03312322       
  8   2151.6597000              0.08539349       
  9    938.0325100              0.18662470       
 10    426.5573200              0.31388400       
 11    201.0666000              0.33149949       
 12     97.0976050              0.15917405       
 13     42.9987240              0.02770660       
 14     21.1770750              0.01603284       
 15     10.4267520              0.00776073       
S   15
  1 11718113.0000000           -0.00000004       
  2 1754604.4000000            -0.00000002       
  3 399281.3200000             -0.00000006       
  4  36885.9250000             -0.00000564       
  5  13312.2090000             -0.00003413       
  6   5189.9883000             -0.00031630       
  7   2151.6597000             -0.00180889       
  8    938.0325100             -0.00984555       
  9    426.5573200             -0.03738963       
 10    201.0666000             -0.09702607       
 11     97.0976050             -0.05842615       
 12     42.9987240              0.33749687       
 13     21.1770750              0.59450348       
 14     10.4267520              0.24272147       
 15      4.5850080              0.01669544       
S   15
  1 11718113.0000000           -0.00000003       
  2 1754604.4000000            -0.00000004       
  3 399281.3200000              0.00000008       
  4  13312.2090000             -0.00000455       
  5   5189.9883000             -0.00003180       
  6   2151.6597000             -0.00023408       
  7    938.0325100             -0.00113587       
  8    426.5573200             -0.00439992       
  9    201.0666000             -0.00930396       
 10     97.0976050             -0.00329561       
 11     42.9987240              0.00080459       
 12     21.1770750             -0.17106401       
 13     10.4267520             -0.04616362       
 14      4.5850080              0.68590529       
 15      2.1176030              0.60868959       
S   15
  1 11718113.0000000            0.00000003       
  2 1754604.4000000            -0.00000006       
  3 399281.3200000             -0.00000001       
  4   5189.9883000              0.00000253       
  5   2151.6597000              0.00001584       
  6    938.0325100              0.00009174       
  7    426.5573200              0.00030496       
  8    201.0666000              0.00057276       
  9     97.0976050             -0.00027796       
 10     42.9987240              0.00457871       
 11     21.1770750              0.04159687       
 12     10.4267520              0.01678524       
 13      4.5850080             -0.19636462       
 14      2.1176030             -0.44405111       
 15      0.3492250              0.87819746       
S   1
  1      0.7070570              1.0000000        
S   1
  1      0.1448210              1.0000000        
P   9
  1   9366.3090000              0.00042309       
  2   2219.5543000              0.00367424       
  3    719.4528800              0.01993124       
  4    273.4644600              0.07742638       
  5    114.7522500              0.21406906       
  6     51.1555690              0.38496619       
  7     23.6826760              0.36268713       
  8     10.8754840              0.11606199       
  9      4.9551310              0.00267795       
P   9
  1   9366.3090000              0.00000102       
  2    719.4528800             -0.00007760       
  3    273.4644600             -0.00121053       
  4    114.7522500             -0.00757495       
  5     51.1555690             -0.02622578       
  6     23.6826760             -0.01308509       
  7     10.8754840              0.22917328       
  8      4.9551310              0.55180439       
  9      2.2172670              0.39629549       
P   9
  1   9366.3090000             -0.00000064       
  2    273.4644600              0.00030767       
  3    114.7522500              0.00164165       
  4     51.1555690              0.00700281       
  5     23.6826760              0.00148459       
  6     10.8754840             -0.06281498       
  7      4.9551310             -0.17880706       
  8      2.2172670             -0.13053072       
  9      0.3221540              0.74352850       
P   1
  1      0.8064100              1.0000000        
P   1
  1      0.1176190              1.0000000        
D   7
  1    446.1613300              0.0014044        
  2    133.9647700              0.0121715        
  3     51.3459070              0.0563919        
  4     21.9169060              0.1676430        
  5      9.8937250              0.3177368        
  6      4.4925270              0.3872647        
  7      2.0022930              0.2728006        
D   1
  1      0.8084090              1.0000000        
D   1
  1      0.3006000              1.0000000        
F   1
  1      0.6622000              1.0000000        
$


name: cc-pVTZ+
description: cc-pVTZ basis set augmented with diffuse functions from 6-31+G basis set.
elt: S
data:
SULFUR
S   15
  1 374100.0000000              0.542140D-04     
  2  56050.0000000              0.420855D-03     
  3  12760.0000000              0.220698D-02     
  4   3615.0000000              0.919258D-02     
  5   1183.0000000              0.321123D-01     
  6    428.8000000              0.946683D-01     
  7    167.8000000              0.223630D+00     
  8     69.4700000              0.374393D+00     
  9     29.8400000              0.329108D+00     
 10     12.7200000              0.847038D-01     
 11      5.2440000              0.440851D-03     
 12      2.2190000              0.164827D-02     
 13      0.7767000             -0.622332D-03     
 14      0.3490000              0.301306D-03     
 15      0.1322000             -0.841290D-04     
S   15
  1 374100.0000000             -0.149837D-04     
  2  56050.0000000             -0.116198D-03     
  3  12760.0000000             -0.611583D-03     
  4   3615.0000000             -0.255370D-02     
  5   1183.0000000             -0.908708D-02     
  6    428.8000000             -0.277045D-01     
  7    167.8000000             -0.720020D-01     
  8     69.4700000             -0.146439D+00     
  9     29.8400000             -0.195150D+00     
 10     12.7200000              0.819193D-02     
 11      5.2440000              0.516601D+00     
 12      2.2190000              0.542178D+00     
 13      0.7767000              0.688430D-01     
 14      0.3490000             -0.918072D-02     
 15      0.1322000              0.226832D-02     
S   15
  1 374100.0000000              0.435066D-05     
  2  56050.0000000              0.337140D-04     
  3  12760.0000000              0.177674D-03     
  4   3615.0000000              0.741116D-03     
  5   1183.0000000              0.264591D-02     
  6    428.8000000              0.807487D-02     
  7    167.8000000              0.212276D-01     
  8     69.4700000              0.438323D-01     
  9     29.8400000              0.612716D-01     
 10     12.7200000             -0.361510D-02     
 11      5.2440000             -0.204510D+00     
 12      2.2190000             -0.381871D+00     
 13      0.7767000              0.826844D-01     
 14      0.3490000              0.714147D+00     
 15      0.1322000              0.393791D+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
P   9
  1    574.4000000              0.242264D-02     
  2    135.8000000              0.192796D-01     
  3     43.1900000              0.885401D-01     
  4     15.8700000              0.254654D+00     
  5      6.2080000              0.433984D+00     
  6      2.4830000              0.354953D+00     
  7      0.8688000              0.618941D-01     
  8      0.3229000             -0.502977D-02     
  9      0.1098000              0.209813D-02     
P   9
  1    574.4000000             -0.620102D-03     
  2    135.8000000             -0.493882D-02     
  3     43.1900000             -0.232647D-01     
  4     15.8700000             -0.685195D-01     
  5      6.2080000             -0.123896D+00     
  6      2.4830000             -0.969499D-01     
  7      0.8688000              0.228215D+00     
  8      0.3229000              0.569394D+00     
  9      0.1098000              0.366302D+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
F   1
  1      0.5570000              1.0000000


name: cc-pVTZ+
description: cc-pVTZ basis set augmented with diffuse functions from 6-31+G basis set.
elt: Cl
data:
CHLORINE
S   15
  1 456100.0000000              0.492970D-04     
  2  68330.0000000              0.383029D-03     
  3  15550.0000000              0.200854D-02     
  4   4405.0000000              0.838558D-02     
  5   1439.0000000              0.294703D-01     
  6    520.4000000              0.878325D-01     
  7    203.1000000              0.211473D+00     
  8     83.9600000              0.365364D+00     
  9     36.2000000              0.340884D+00     
 10     15.8300000              0.102133D+00     
 11      6.3340000              0.311675D-02     
 12      2.6940000              0.105751D-02     
 13      0.9768000             -0.378000D-03     
 14      0.4313000              0.156136D-03     
 15      0.1625000             -0.514126D-04     
S   15
  1 456100.0000000             -0.138304D-04     
  2  68330.0000000             -0.107279D-03     
  3  15550.0000000             -0.565083D-03     
  4   4405.0000000             -0.236135D-02     
  5   1439.0000000             -0.845886D-02     
  6    520.4000000             -0.259638D-01     
  7    203.1000000             -0.686362D-01     
  8     83.9600000             -0.141874D+00     
  9     36.2000000             -0.199319D+00     
 10     15.8300000             -0.195662D-01     
 11      6.3340000              0.499741D+00     
 12      2.6940000              0.563736D+00     
 13      0.9768000              0.790325D-01     
 14      0.4313000             -0.835091D-02     
 15      0.1625000              0.232456D-02     
S   15
  1 456100.0000000              0.418546D-05     
  2  68330.0000000              0.324395D-04     
  3  15550.0000000              0.171105D-03     
  4   4405.0000000              0.714176D-03     
  5   1439.0000000              0.256705D-02     
  6    520.4000000              0.788552D-02     
  7    203.1000000              0.210867D-01     
  8     83.9600000              0.442264D-01     
  9     36.2000000              0.651670D-01     
 10     15.8300000              0.603012D-02     
 11      6.3340000             -0.206495D+00     
 12      2.6940000             -0.405871D+00     
 13      0.9768000              0.759558D-01     
 14      0.4313000              0.725661D+00     
 15      0.1625000              0.394423D+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
P   9
  1    663.3000000              0.240448D-02     
  2    156.8000000              0.192148D-01     
  3     49.9800000              0.885097D-01     
  4     18.4200000              0.256020D+00     
  5      7.2400000              0.436927D+00     
  6      2.9220000              0.350334D+00     
  7      1.0220000              0.585495D-01     
  8      0.3818000             -0.458423D-02     
  9      0.1301000              0.226970D-02     
P   9
  1    663.3000000             -0.652145D-03     
  2    156.8000000             -0.519445D-02     
  3     49.9800000             -0.246938D-01     
  4     18.4200000             -0.728167D-01     
  5      7.2400000             -0.134030D+00     
  6      2.9220000             -0.947742D-01     
  7      1.0220000              0.262289D+00     
  8      0.3818000              0.564667D+00     
  9      0.1301000              0.341250D+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: cc-pVTZ-F12
description: correlation consistent F12 basis sets
elt: Li
data:
LITHIUM
S   9
  1   6601.0000000              0.0001170        
  2    989.7000000              0.0009110        
  3    225.7000000              0.0047280        
  4     64.2900000              0.0191970        
  5     21.1800000              0.0630470        
  6      7.7240000              0.1632080        
  7      3.0030000              0.3148270        
  8      1.2120000              0.3939360        
  9      0.4930000              0.1969180        
S   9
  1   6601.0000000             -0.0000180        
  2    989.7000000             -0.0001420        
  3    225.7000000             -0.0007410        
  4     64.2900000             -0.0030200        
  5     21.1800000             -0.0101230        
  6      7.7240000             -0.0270940        
  7      3.0030000             -0.0573590        
  8      1.2120000             -0.0938950        
  9      0.4930000             -0.1210910        
S   1
  1      0.0951500              1.0000000        
S   1
  1      0.0479100              1.0000000        
S   1
  1      0.0222000              1.0000000        
S   1
  1      0.0064000              1.0000000        
P   2
  1      6.2500000              0.0033880        
  2      1.3700000              0.0193160        
P   1
  1      0.3672000              1.0000000        
P   1
  1      0.1192000              1.0000000        
P   1
  1      0.0447400              1.0000000        
P   1
  1      0.0179500              1.0000000        
P   1
  1      0.0075000              1.0000000        
D   1
  1      0.2351180              1.0000000        
D   1
  1      0.1194040              1.0000000        
D   1
  1      0.0606390              1.0000000        
F   1
  1      0.1637750              1.0000000        
F   1
  1      0.0759100              1.0000000


name: cc-pVTZ-F12
description: correlation consistent F12 basis sets
elt: Be
data:
BERYLLIUM
S   9
  1  14630.0000000              0.0000920        
  2   2191.0000000              0.0007130        
  3    498.2000000              0.0037350        
  4    140.9000000              0.0154680        
  5     45.8600000              0.0528740        
  6     16.4700000              0.1456940        
  7      6.3190000              0.3026810        
  8      2.5350000              0.4049360        
  9      1.0350000              0.2223870        
S   9
  1  14630.0000000             -0.0000170        
  2   2191.0000000             -0.0001300        
  3    498.2000000             -0.0006790        
  4    140.9000000             -0.0028570        
  5     45.8600000             -0.0098130        
  6     16.4700000             -0.0286090        
  7      6.3190000             -0.0637600        
  8      2.5350000             -0.1172310        
  9      1.0350000             -0.1212020        
S   1
  1      0.2528000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0426100              1.0000000        
S   1
  1      0.0141000              1.0000000        
P   2
  1     14.0300000              0.0040990        
  2      3.1680000              0.0256260        
P   1
  1      0.9024000              1.0000000        
P   1
  1      0.3036000              1.0000000        
P   1
  1      0.1130000              1.0000000        
P   1
  1      0.0428600              1.0000000        
P   1
  1      0.0084000              1.0000000        
D   1
  1      0.4670460              1.0000000        
D   1
  1      0.2205970              1.0000000        
D   1
  1      0.1041940              1.0000000        
F   1
  1      0.3166400              1.0000000        
F   1
  1      0.1457880              1.0000000


name: cc-pVTZ-F12
description: correlation consistent F12 basis sets
elt: Na
data:
SODIUM
S   16
  1 1224000.0000000             0.0000048        
  2 183200.0000000              0.0000372        
  3  41700.0000000              0.0001958        
  4  11810.0000000              0.0008267        
  5   3853.0000000              0.0030025        
  6   1391.0000000              0.0097031        
  7    542.5000000              0.0282337        
  8    224.9000000              0.0732058        
  9     97.9300000              0.1628970        
 10     44.3100000              0.2887080        
 11     20.6500000              0.3468290        
 12      9.7290000              0.2068650        
 13      4.2280000              0.0328009        
 14      1.9690000             -0.0006477        
 15      0.8890000              0.0014588        
 16      0.3964000             -0.0001783        
S   16
  1 1224000.0000000            -0.0000012        
  2 183200.0000000             -0.0000091        
  3  41700.0000000             -0.0000478        
  4  11810.0000000             -0.0002020        
  5   3853.0000000             -0.0007358        
  6   1391.0000000             -0.0023875        
  7    542.5000000             -0.0070497        
  8    224.9000000             -0.0187856        
  9     97.9300000             -0.0446153        
 10     44.3100000             -0.0897741        
 11     20.6500000             -0.1429400        
 12      9.7290000             -0.1243150        
 13      4.2280000              0.0999648        
 14      1.9690000              0.4170800        
 15      0.8890000              0.4751230        
 16      0.3964000              0.1632680        
S   16
  1 1224000.0000000             0.0000002        
  2 183200.0000000              0.0000014        
  3  41700.0000000              0.0000072        
  4  11810.0000000              0.0000303        
  5   3853.0000000              0.0001108        
  6   1391.0000000              0.0003586        
  7    542.5000000              0.0010627        
  8    224.9000000              0.0028269        
  9     97.9300000              0.0067674        
 10     44.3100000              0.0136480        
 11     20.6500000              0.0222814        
 12      9.7290000              0.0196011        
 13      4.2280000             -0.0167708        
 14      1.9690000             -0.0773734        
 15      0.8890000             -0.1135010        
 16      0.3964000             -0.1391300        
S   1
  1      0.0699300              1.0000000        
S   1
  1      0.0328900              1.0000000        
S   1
  1      0.0161200              1.0000000        
S   1
  1      0.0050000              1.0000000        
P   9
  1    413.4000000              0.0009082        
  2     97.9800000              0.0074177        
  3     31.3700000              0.0357464        
  4     11.6200000              0.1185200        
  5      4.6710000              0.2614030        
  6      1.9180000              0.3783950        
  7      0.7775000              0.3346320        
  8      0.3013000              0.1268440        
  9      0.2275000             -0.0147117        
P   9
  1    413.4000000             -0.0000902        
  2     97.9800000             -0.0007393        
  3     31.3700000             -0.0035731        
  4     11.6200000             -0.0120142        
  5      4.6710000             -0.0267178        
  6      1.9180000             -0.0392753        
  7      0.7775000             -0.0376083        
  8      0.3013000             -0.0433228        
  9      0.2275000              0.0518003        
P   1
  1      0.0752700              1.0000000        
P   1
  1      0.0312600              1.0000000        
P   1
  1      0.0134200              1.0000000        
P   1
  1      0.0072000              1.0000000        
P   1
  1      0.7968140              1.0000000        
D   1
  1      1.1456650              1.0000000        
D   1
  1      0.0517890              1.0000000        
D   1
  1      0.0916340              1.0000000        
D   1
  1      0.1621360              1.0000000        
F   1
  1      0.1341970              1.0000000        
F   1
  1      0.0695240              1.0000000


name: cc-pVTZ-F12
description: correlation consistent F12 basis sets
elt: Mg
data:
MAGNESIUM
S   13
  1 327600.0000000              0.0000310        
  2  49050.0000000              0.0002410        
  3  11150.0000000              0.0012666        
  4   3152.0000000              0.0053336        
  5   1025.0000000              0.0190770        
  6    368.8000000              0.0588058        
  7    143.2000000              0.1514540        
  8     58.9600000              0.3007160        
  9     25.4000000              0.3811490        
 10     11.1500000              0.2135840        
 11      4.0040000              0.0231210        
 12      1.7010000             -0.0023076        
 13      0.7060000              0.0012890        
S   13
  1 327600.0000000             -0.0000078        
  2  49050.0000000             -0.0000608        
  3  11150.0000000             -0.0003212        
  4   3152.0000000             -0.0013496        
  5   1025.0000000             -0.0049057        
  6    368.8000000             -0.0153561        
  7    143.2000000             -0.0423409        
  8     58.9600000             -0.0940603        
  9     25.4000000             -0.1634250        
 10     11.1500000             -0.1247540        
 11      4.0040000              0.2356230        
 12      1.7010000              0.5775630        
 13      0.7060000              0.3352320        
S   13
  1 327600.0000000              0.0000015        
  2  49050.0000000              0.0000117        
  3  11150.0000000              0.0000619        
  4   3152.0000000              0.0002601        
  5   1025.0000000              0.0009462        
  6    368.8000000              0.0029660        
  7    143.2000000              0.0082125        
  8     58.9600000              0.0183977        
  9     25.4000000              0.0326657        
 10     11.1500000              0.0257315        
 11      4.0040000             -0.0535351        
 12      1.7010000             -0.1568950        
 13      0.7060000             -0.2066590        
S   1
  1      0.1410000              1.0000000        
S   1
  1      0.0680800              1.0000000        
S   1
  1      0.0306300              1.0000000        
S   1
  1      0.0109000              1.0000000        
P   9
  1    539.6000000              0.0008340        
  2    127.9000000              0.0068922        
  3     41.0200000              0.0337874        
  4     15.2500000              0.1144010        
  5      6.1660000              0.2595140        
  6      2.5610000              0.3850950        
  7      1.0600000              0.3353730        
  8      0.4176000              0.1106410        
  9      0.2690000             -0.0121315        
P   9
  1    539.6000000             -0.0001321        
  2    127.9000000             -0.0010954        
  3     41.0200000             -0.0053950        
  4     15.2500000             -0.0185572        
  5      6.1660000             -0.0427375        
  6      2.5610000             -0.0647684        
  7      1.0600000             -0.0627818        
  8      0.4176000             -0.0244912        
  9      0.2690000              0.1047610        
P   1
  1      0.1223000              1.0000000        
P   1
  1      0.0547600              1.0000000        
P   1
  1      0.0238800              1.0000000        
P   1
  1      0.0081000              1.0000000        
P   1
  1      2.8126150              1.0000000        
D   1
  1      1.8375060              1.0000000        
D   1
  1      0.2883070              1.0000000        
D   1
  1      0.1510850              1.0000000        
D   1
  1      0.0774490              1.0000000        
F   1
  1      0.2257910              1.0000000        
F   1
  1      0.1091400              1.0000000


name: cc-pVTZ-DK
description: N/A
elt: Y
data:
YTTRIUM
S   25
  1 125652000.0000000           0.0000380        
  2 20133700.0000000            0.0000990        
  3 4277710.0000000             0.0002750        
  4 1129920.0000000             0.0006340        
  5 351974.0000000              0.0013810        
  6 123945.0000000              0.0028690        
  7  47739.9000000              0.0059230        
  8  19619.2000000              0.0123320        
  9   8450.3600000              0.0261600        
 10   3769.0200000              0.0556820        
 11   1727.9100000              0.1138630        
 12    811.0400000              0.2051020        
 13    389.1110000              0.2814370        
 14    190.7170000              0.2287340        
 15     95.4433000              0.0890280        
 16     48.6821000              0.0824400        
 17     25.2032000              0.1083430        
 18     13.1419000              0.0442950        
 19      6.8166900              0.0108440        
 20      3.4533900              0.0084610        
 21      1.6659100              0.0019320        
 22      0.7900420             -0.0000540        
 23      0.3582790              0.0000200        
 24      0.0954820             -0.0000120        
 25      0.0539170              0.0000090        
S   25
  1 125652000.0000000          -0.0000220        
  2 20133700.0000000           -0.0000570        
  3 4277710.0000000            -0.0001590        
  4 1129920.0000000            -0.0003680        
  5 351974.0000000             -0.0008030        
  6 123945.0000000             -0.0016720        
  7  47739.9000000             -0.0034650        
  8  19619.2000000             -0.0072570        
  9   8450.3600000             -0.0155630        
 10   3769.0200000             -0.0337490        
 11   1727.9100000             -0.0716650        
 12    811.0400000             -0.1390300        
 13    389.1110000             -0.2226090        
 14    190.7170000             -0.2338900        
 15     95.4433000             -0.0401650        
 16     48.6821000              0.3553160        
 17     25.2032000              0.5138360        
 18     13.1419000              0.2129770        
 19      6.8166900              0.0360490        
 20      3.4533900              0.0200810        
 21      1.6659100              0.0043340        
 22      0.7900420             -0.0001540        
 23      0.3582790              0.0000270        
 24      0.0954820             -0.0000270        
 25      0.0539170              0.0000190        
S   25
  1 125652000.0000000           0.0000060        
  2 20133700.0000000            0.0000150        
  3 4277710.0000000             0.0000420        
  4 1129920.0000000             0.0000970        
  5 351974.0000000              0.0002120        
  6 123945.0000000              0.0004420        
  7  47739.9000000              0.0009200        
  8  19619.2000000              0.0019340        
  9   8450.3600000              0.0041920        
 10   3769.0200000              0.0092110        
 11   1727.9100000              0.0201940        
 12    811.0400000              0.0412260        
 13    389.1110000              0.0731750        
 14    190.7170000              0.0874300        
 15     95.4433000              0.0099990        
 16     48.6821000             -0.2504440        
 17     25.2032000             -0.4946370        
 18     13.1419000             -0.2142400        
 19      6.8166900              0.4939470        
 20      3.4533900              0.6907770        
 21      1.6659100              0.1581590        
 22      0.7900420              0.0015260        
 23      0.3582790              0.0034050        
 24      0.0954820             -0.0004310        
 25      0.0539170              0.0003640        
S   25
  1 125652000.0000000          -0.0000020        
  2 20133700.0000000           -0.0000050        
  3 4277710.0000000            -0.0000150        
  4 1129920.0000000            -0.0000350        
  5 351974.0000000             -0.0000760        
  6 123945.0000000             -0.0001590        
  7  47739.9000000             -0.0003300        
  8  19619.2000000             -0.0006950        
  9   8450.3600000             -0.0015050        
 10   3769.0200000             -0.0033110        
 11   1727.9100000             -0.0072380        
 12    811.0400000             -0.0148080        
 13    389.1110000             -0.0261900        
 14    190.7170000             -0.0316290        
 15     95.4433000             -0.0034010        
 16     48.6821000              0.0946240        
 17     25.2032000              0.2044610        
 18     13.1419000              0.0856020        
 19      6.8166900             -0.2538650        
 20      3.4533900             -0.6127890        
 21      1.6659100             -0.1264940        
 22      0.7900420              0.7436770        
 23      0.3582790              0.5597720        
 24      0.0954820              0.0475750        
 25      0.0539170             -0.0190500        
S   25
  1 125652000.0000000           0.0000010        
  2 20133700.0000000            0.0000010        
  3 4277710.0000000             0.0000040        
  4 1129920.0000000             0.0000100        
  5 351974.0000000              0.0000210        
  6 123945.0000000              0.0000430        
  7  47739.9000000              0.0000900        
  8  19619.2000000              0.0001900        
  9   8450.3600000              0.0004100        
 10   3769.0200000              0.0009050        
 11   1727.9100000              0.0019740        
 12    811.0400000              0.0040530        
 13    389.1110000              0.0071420        
 14    190.7170000              0.0087000        
 15     95.4433000              0.0008310        
 16     48.6821000             -0.0258900        
 17     25.2032000             -0.0573760        
 18     13.1419000             -0.0230220        
 19      6.8166900              0.0712900        
 20      3.4533900              0.1938920        
 21      1.6659100              0.0312430        
 22      0.7900420             -0.2852390        
 23      0.3582790             -0.3947980        
 24      0.0954820              0.1501200        
 25      0.0539170              0.6757620        
S   25
  1 125652000.0000000           0.0000010        
  2 20133700.0000000            0.0000020        
  3 4277710.0000000             0.0000070        
  4 1129920.0000000             0.0000160        
  5 351974.0000000              0.0000350        
  6 123945.0000000              0.0000720        
  7  47739.9000000              0.0001520        
  8  19619.2000000              0.0003130        
  9   8450.3600000              0.0007010        
 10   3769.0200000              0.0014760        
 11   1727.9100000              0.0034120        
 12    811.0400000              0.0065110        
 13    389.1110000              0.0126710        
 14    190.7170000              0.0128480        
 15     95.4433000              0.0055480        
 16     48.6821000             -0.0530480        
 17     25.2032000             -0.0770720        
 18     13.1419000             -0.0781360        
 19      6.8166900              0.1960260        
 20      3.4533900              0.2199610        
 21      1.6659100              0.2714330        
 22      0.7900420             -1.0439730        
 23      0.3582790             -0.2222660        
 24      0.0954820              2.6686410        
 25      0.0539170             -1.3420860        
S   25
  1 125652000.0000000           0.0000010        
  2 20133700.0000000            0.0000040        
  3 4277710.0000000             0.0000100        
  4 1129920.0000000             0.0000230        
  5 351974.0000000              0.0000510        
  6 123945.0000000              0.0001040        
  7  47739.9000000              0.0002250        
  8  19619.2000000              0.0004420        
  9   8450.3600000              0.0010560        
 10   3769.0200000              0.0020350        
 11   1727.9100000              0.0052400        
 12    811.0400000              0.0087090        
 13    389.1110000              0.0202960        
 14    190.7170000              0.0140590        
 15     95.4433000              0.0191750        
 16     48.6821000             -0.1030150        
 17     25.2032000             -0.0627500        
 18     13.1419000             -0.2157100        
 19      6.8166900              0.4965000        
 20      3.4533900              0.0288990        
 21      1.6659100              0.9537960        
 22      0.7900420             -3.3467460        
 23      0.3582790              2.7612670        
 24      0.0954820              1.3724070        
 25      0.0539170             -3.9422120        
S   1
  1      0.0238090              1.0000000        
P   20
  1 899731.0000000              0.0000140        
  2 150037.0000000              0.0000530        
  3  34339.3000000              0.0002080        
  4   9996.3200000              0.0007750        
  5   3481.5200000              0.0028250        
  6   1382.5800000              0.0097320        
  7    603.4010000              0.0303590        
  8    281.5920000              0.0828300        
  9    137.7670000              0.1847570        
 10     69.6793000              0.3116770        
 11     36.0696000              0.3427930        
 12     18.9597000              0.1889650        
 13     10.0434000              0.0357120        
 14      5.3130700             -0.0051850        
 15      2.7721800             -0.0049220        
 16      1.4017300             -0.0008290        
 17      0.6837770              0.0000540        
 18      0.3265150              0.0000940        
 19      0.1331130              0.0000110        
 20      0.0565070              0.0000020        
P   20
  1 899731.0000000             -0.0000060        
  2 150037.0000000             -0.0000210        
  3  34339.3000000             -0.0000840        
  4   9996.3200000             -0.0003140        
  5   3481.5200000             -0.0011490        
  6   1382.5800000             -0.0039830        
  7    603.4010000             -0.0126000        
  8    281.5920000             -0.0352680        
  9    137.7670000             -0.0819870        
 10     69.6793000             -0.1459460        
 11     36.0696000             -0.1639830        
 12     18.9597000             -0.0007890        
 13     10.0434000              0.2968570        
 14      5.3130700              0.4753820        
 15      2.7721800              0.2970230        
 16      1.4017300              0.0496310        
 17      0.6837770             -0.0016450        
 18      0.3265150             -0.0031360        
 19      0.1331130             -0.0004470        
 20      0.0565070             -0.0000380        
P   20
  1 899731.0000000              0.0000020        
  2 150037.0000000              0.0000070        
  3  34339.3000000              0.0000280        
  4   9996.3200000              0.0001060        
  5   3481.5200000              0.0003890        
  6   1382.5800000              0.0013490        
  7    603.4010000              0.0042740        
  8    281.5920000              0.0119970        
  9    137.7670000              0.0280270        
 10     69.6793000              0.0502390        
 11     36.0696000              0.0566460        
 12     18.9597000             -0.0063640        
 13     10.0434000             -0.1256460        
 14      5.3130700             -0.2231580        
 15      2.7721800             -0.1444230        
 16      1.4017300              0.2396110        
 17      0.6837770              0.5197150        
 18      0.3265150              0.3711800        
 19      0.1331130              0.0688960        
 20      0.0565070             -0.0032160        
P   20
  1 899731.0000000             -0.0000010        
  2 150037.0000000             -0.0000020        
  3  34339.3000000             -0.0000070        
  4   9996.3200000             -0.0000280        
  5   3481.5200000             -0.0001020        
  6   1382.5800000             -0.0003530        
  7    603.4010000             -0.0011180        
  8    281.5920000             -0.0031360        
  9    137.7670000             -0.0073370        
 10     69.6793000             -0.0131460        
 11     36.0696000             -0.0148640        
 12     18.9597000              0.0018970        
 13     10.0434000              0.0333980        
 14      5.3130700              0.0606620        
 15      2.7721800              0.0379810        
 16      1.4017300             -0.0741550        
 17      0.6837770             -0.1789410        
 18      0.3265150             -0.1616030        
 19      0.1331130              0.1999360        
 20      0.0565070              0.6151410        
P   20
  1 899731.0000000             -0.0000010        
  2 150037.0000000             -0.0000040        
  3  34339.3000000             -0.0000170        
  4   9996.3200000             -0.0000620        
  5   3481.5200000             -0.0002350        
  6   1382.5800000             -0.0007770        
  7    603.4010000             -0.0025980        
  8    281.5920000             -0.0068700        
  9    137.7670000             -0.0172090        
 10     69.6793000             -0.0281710        
 11     36.0696000             -0.0376570        
 12     18.9597000              0.0126630        
 13     10.0434000              0.0591940        
 14      5.3130700              0.1749240        
 15      2.7721800              0.0307070        
 16      1.4017300             -0.0601690        
 17      0.6837770             -0.8888730        
 18      0.3265150              0.3769820        
 19      0.1331130              1.3851310        
 20      0.0565070             -0.9603310        
P   20
  1 899731.0000000             -0.0000010        
  2 150037.0000000             -0.0000050        
  3  34339.3000000             -0.0000200        
  4   9996.3200000             -0.0000700        
  5   3481.5200000             -0.0002780        
  6   1382.5800000             -0.0008700        
  7    603.4010000             -0.0031000        
  8    281.5920000             -0.0076420        
  9    137.7670000             -0.0207720        
 10     69.6793000             -0.0304950        
 11     36.0696000             -0.0490530        
 12     18.9597000              0.0273890        
 13     10.0434000              0.0512960        
 14      5.3130700              0.2533410        
 15      2.7721800             -0.0539630        
 16      1.4017300             -0.0228610        
 17      0.6837770             -1.5625650        
 18      0.3265150              2.3965880        
 19      0.1331130             -0.9263150        
 20      0.0565070             -0.9296140        
P   1
  1      0.0230720              1.0000000        
D   13
  1   1692.8100000              0.0001720        
  2    495.3540000              0.0015040        
  3    185.7570000              0.0088970        
  4     80.7331000              0.0349980        
  5     38.1052000              0.1020330        
  6     18.7825000              0.2187390        
  7      9.4512200              0.3241590        
  8      4.7787300              0.3330020        
  9      2.3834500              0.1976710        
 10      1.1262500              0.0473440        
 11      0.4918370              0.0020740        
 12      0.2031270              0.0003690        
 13      0.0806030             -0.0000910        
D   13
  1   1692.8100000             -0.0000310        
  2    495.3540000             -0.0002740        
  3    185.7570000             -0.0016290        
  4     80.7331000             -0.0064310        
  5     38.1052000             -0.0189300        
  6     18.7825000             -0.0407270        
  7      9.4512200             -0.0585640        
  8      4.7787300             -0.0555840        
  9      2.3834500              0.0031940        
 10      1.1262500              0.1495820        
 11      0.4918370              0.3059940        
 12      0.2031270              0.3834170        
 13      0.0806030              0.3322840        
D   13
  1   1692.8100000              0.0000350        
  2    495.3540000              0.0003060        
  3    185.7570000              0.0018110        
  4     80.7331000              0.0071820        
  5     38.1052000              0.0210830        
  6     18.7825000              0.0455820        
  7      9.4512200              0.0647290        
  8      4.7787300              0.0610630        
  9      2.3834500             -0.0122660        
 10      1.1262500             -0.1866690        
 11      0.4918370             -0.3892700        
 12      0.2031270             -0.2383360        
 13      0.0806030              0.4661860        
D   13
  1   1692.8100000             -0.0000420        
  2    495.3540000             -0.0003750        
  3    185.7570000             -0.0022030        
  4     80.7331000             -0.0088120        
  5     38.1052000             -0.0257040        
  6     18.7825000             -0.0560910        
  7      9.4512200             -0.0776040        
  8      4.7787300             -0.0719720        
  9      2.3834500              0.0271310        
 10      1.1262500              0.2803270        
 11      0.4918370              0.5362770        
 12      0.2031270             -0.5530610        
 13      0.0806030             -0.6755560        
D   1
  1      0.0303380              1.0000000        
F   1
  1      0.4785000              1.0000000        
F   1
  1      0.1232000              1.0000000        
G   1
  1      0.2762000              1.0000000


