# all_value

name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   13
  1 615200.0000000              0.0001494        
  2  92120.0000000              0.0004927        
  3  20950.0000000              0.0016113        
  4   5920.0000000              0.0052114        
  5   1922.0000000              0.0167435        
  6    688.0000000              0.0503603        
  7    265.0000000              0.1319373        
  8    108.2000000              0.2753508        
  9     46.2200000              0.3838728        
 10     20.2300000              0.2536762        
 11      7.8590000              0.0386519        
 12      3.5470000             -0.0036276        
 13      1.5640000              0.0020548        
S   13
  1 615200.0000000             -0.0000408        
  2  92120.0000000             -0.0001345        
  3  20950.0000000             -0.0004412        
  4   5920.0000000             -0.0014294        
  5   1922.0000000             -0.0046453        
  6    688.0000000             -0.0142168        
  7    265.0000000             -0.0393765        
  8    108.2000000             -0.0915378        
  9     46.2200000             -0.1668405        
 10     20.2300000             -0.1589841        
 11      7.8590000              0.1510834        
 12      3.5470000              0.5670363        
 13      1.5640000              0.4125417        
S   13
  1 615200.0000000              0.0000112        
  2  92120.0000000              0.0000370        
  3  20950.0000000              0.0001213        
  4   5920.0000000              0.0003925        
  5   1922.0000000              0.0012800        
  6    688.0000000              0.0039107        
  7    265.0000000              0.0109296        
  8    108.2000000              0.0255132        
  9     46.2200000              0.0480500        
 10     20.2300000              0.0468949        
 11      7.8590000             -0.0480519        
 12      3.5470000             -0.2363588        
 13      1.5640000             -0.3085593        
S   1
  1      0.4888000              1.0000000        
S   1
  1      0.2266000              1.0000000        
S   1
  1      0.0933100              1.0000000        
S   1
  1     14.8310000              1.0000000        
S   1
  1      7.6400000              1.0000000        
S   1
  1      3.9350000              1.0000000        
S   1
  1      0.0354000              1.0000000        
P   8
  1   1367.0000000              0.0005063        
  2    324.0000000              0.0037938        
  3    104.6000000              0.0193127        
  4     39.3700000              0.0711381        
  5     16.2600000              0.1886840        
  6      7.0560000              0.3387104        
  7      3.1300000              0.3814251        
  8      1.3940000              0.1948542        
P   8
  1   1367.0000000             -0.0001211        
  2    324.0000000             -0.0008984        
  3    104.6000000             -0.0046649        
  4     39.3700000             -0.0171725        
  5     16.2600000             -0.0476350        
  6      7.0560000             -0.0852209        
  7      3.1300000             -0.1094597        
  8      1.3940000             -0.0157089        
P   1
  1      0.5179000              1.0000000        
P   1
  1      0.2032000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1     15.5230000              1.0000000        
P   1
  1      7.0730000              1.0000000        
P   1
  1      3.2230000              1.0000000        
P   1
  1      0.0272000              1.0000000        
D   1
  1      0.1650000              1.0000000        
D   1
  1      0.4130000              1.0000000        
D   1
  1      1.0360000              1.0000000        
D   1
  1     23.4170000              1.0000000        
D   1
  1      9.2500000              1.0000000        
D   1
  1      3.6540000              1.0000000        
D   1
  1      0.0594000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
F   1
  1     14.2070000              1.0000000        
F   1
  1      5.1610000              1.0000000        
F   1
  1      0.1090000              1.0000000        
G   1
  1      0.5970000              1.0000000        
G   1
  1     10.4480000              1.0000000        
G   1
  1      0.2500000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: S
data:
SULFUR
S   13
  1 727800.0000000              0.0001554        
  2 109000.0000000              0.0005046        
  3  24800.0000000              0.0016175        
  4   7014.0000000              0.0051117        
  5   2278.0000000              0.0161905        
  6    814.7000000              0.0484992        
  7    313.4000000              0.1276676        
  8    127.7000000              0.2694767        
  9     54.4800000              0.3831611        
 10     23.8500000              0.2627392        
 11      9.4280000              0.0431322        
 12      4.2900000             -0.0037264        
 13      1.9090000              0.0021479        
S   13
  1 727800.0000000             -0.0000432        
  2 109000.0000000             -0.0001403        
  3  24800.0000000             -0.0004508        
  4   7014.0000000             -0.0014279        
  5   2278.0000000             -0.0045711        
  6    814.7000000             -0.0139376        
  7    313.4000000             -0.0386964        
  8    127.7000000             -0.0908910        
  9     54.4800000             -0.1674364        
 10     23.8500000             -0.1666169        
 11      9.4280000              0.1328293        
 12      4.2900000              0.5655083        
 13      1.9090000              0.4272415        
S   13
  1 727800.0000000              0.0000125        
  2 109000.0000000              0.0000407        
  3  24800.0000000              0.0001310        
  4   7014.0000000              0.0004143        
  5   2278.0000000              0.0013314        
  6    814.7000000              0.0040511        
  7    313.4000000              0.0113555        
  8    127.7000000              0.0267755        
  9     54.4800000              0.0510364        
 10     23.8500000              0.0520469        
 11      9.4280000             -0.0442967        
 12      4.2900000             -0.2526072        
 13      1.9090000             -0.3297678        
S   1
  1      0.6270000              1.0000000        
S   1
  1      0.2873000              1.0000000        
S   1
  1      0.1172000              1.0000000        
S   1
  1     17.5990000              1.0000000        
S   1
  1      9.1860000              1.0000000        
S   1
  1      4.7950000              1.0000000        
S   1
  1      0.0428000              1.0000000        
P   8
  1   1546.0000000              0.0005420        
  2    366.4000000              0.0039949        
  3    118.4000000              0.0203053        
  4     44.5300000              0.0749103        
  5     18.3800000              0.1979599        
  6      7.9650000              0.3518386        
  7      3.5410000              0.3780259        
  8      1.5910000              0.1704564        
P   8
  1   1546.0000000             -0.0001388        
  2    366.4000000             -0.0010148        
  3    118.4000000             -0.0052563        
  4     44.5300000             -0.0194496        
  5     18.3800000             -0.0537531        
  6      7.9650000             -0.0959730        
  7      3.5410000             -0.1178745        
  8      1.5910000              0.0097800        
P   1
  1      0.6205000              1.0000000        
P   1
  1      0.2420000              1.0000000        
P   1
  1      0.0901400              1.0000000        
P   1
  1     18.1270000              1.0000000        
P   1
  1      8.2190000              1.0000000        
P   1
  1      3.7260000              1.0000000        
P   1
  1      0.0317000              1.0000000        
D   1
  1      0.2030000              1.0000000        
D   1
  1      0.5040000              1.0000000        
D   1
  1      1.2500000              1.0000000        
D   1
  1     27.4170000              1.0000000        
D   1
  1     10.8930000              1.0000000        
D   1
  1      4.3190000              1.0000000        
D   1
  1      0.0748000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
F   1
  1     16.5350000              1.0000000        
F   1
  1      6.0080000              1.0000000        
F   1
  1      0.1400000              1.0000000        
G   1
  1      0.6830000              1.0000000        
G   1
  1     12.5180000              1.0000000        
G   1
  1      0.2970000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   13
  1 834900.0000000              0.0001641        
  2 125000.0000000              0.0005267        
  3  28430.0000000              0.0016638        
  4   8033.0000000              0.0051711        
  5   2608.0000000              0.0161450        
  6    933.9000000              0.0478990        
  7    360.0000000              0.1256947        
  8    147.0000000              0.2655995        
  9     62.8800000              0.3811966        
 10     27.6000000              0.2679211        
 11     11.0800000              0.0464082        
 12      5.0750000             -0.0036484        
 13      2.2780000              0.0021529        
S   13
  1 834900.0000000             -0.0000463        
  2 125000.0000000             -0.0001487        
  3  28430.0000000             -0.0004710        
  4   8033.0000000             -0.0014677        
  5   2608.0000000             -0.0046298        
  6    933.9000000             -0.0139887        
  7    360.0000000             -0.0386727        
  8    147.0000000             -0.0909250        
  9     62.8800000             -0.1680822        
 10     27.6000000             -0.1717136        
 11     11.0800000              0.1206631        
 12      5.0750000              0.5645474        
 13      2.2780000              0.4364054        
S   13
  1 834900.0000000              0.0000140        
  2 125000.0000000              0.0000450        
  3  28430.0000000              0.0001427        
  4   8033.0000000              0.0004439        
  5   2608.0000000              0.0014057        
  6    933.9000000              0.0042378        
  7    360.0000000              0.0118341        
  8    147.0000000              0.0279279        
  9     62.8800000              0.0534861        
 10     27.6000000              0.0560161        
 11     11.0800000             -0.0416406        
 12      5.0750000             -0.2664792        
 13      2.2780000             -0.3452430        
S   1
  1      0.7775000              1.0000000        
S   1
  1      0.3527000              1.0000000        
S   1
  1      0.1431000              1.0000000        
S   1
  1     20.6890000              1.0000000        
S   1
  1     10.8800000              1.0000000        
S   1
  1      5.7220000              1.0000000        
S   1
  1      0.0519000              1.0000000        
P   8
  1   1703.0000000              0.0005937        
  2    403.6000000              0.0043262        
  3    130.3000000              0.0218990        
  4     49.0500000              0.0803025        
  5     20.2600000              0.2096664        
  6      8.7870000              0.3648911        
  7      3.9190000              0.3708910        
  8      1.7650000              0.1457674        
P   8
  1   1703.0000000             -0.0001606        
  2    403.6000000             -0.0011649        
  3    130.3000000             -0.0059897        
  4     49.0500000             -0.0221645        
  5     20.2600000             -0.0603359        
  6      8.7870000             -0.1068579        
  7      3.9190000             -0.1220136        
  8      1.7650000              0.0390608        
P   1
  1      0.7207000              1.0000000        
P   1
  1      0.2839000              1.0000000        
P   1
  1      0.1060000              1.0000000        
P   1
  1     20.7840000              1.0000000        
P   1
  1      9.3790000              1.0000000        
P   1
  1      4.2320000              1.0000000        
P   1
  1      0.0376000              1.0000000        
D   1
  1      0.2540000              1.0000000        
D   1
  1      0.6280000              1.0000000        
D   1
  1      1.5510000              1.0000000        
D   1
  1     32.2550000              1.0000000        
D   1
  1     12.8880000              1.0000000        
D   1
  1      5.1490000              1.0000000        
D   1
  1      0.0952000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
F   1
  1     19.1070000              1.0000000        
F   1
  1      6.9500000              1.0000000        
F   1
  1      0.2170000              1.0000000        
G   1
  1      0.8270000              1.0000000        
G   1
  1     14.7820000              1.0000000        
G   1
  1      0.3780000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ar
data:
ARGON
S   13
  1 950600.0000000              0.0001729        
  2 142300.0000000              0.0005491        
  3  32360.0000000              0.0017106        
  4   9145.0000000              0.0052236        
  5   2970.0000000              0.0160867        
  6   1064.0000000              0.0473162        
  7    410.8000000              0.1237533        
  8    168.0000000              0.2620152        
  9     71.9900000              0.3794265        
 10     31.6700000              0.2726419        
 11     12.8900000              0.0496374        
 12      5.9290000             -0.0035227        
 13      2.6780000              0.0021435        
S   13
  1 950600.0000000             -0.0000494        
  2 142300.0000000             -0.0001572        
  3  32360.0000000             -0.0004909        
  4   9145.0000000             -0.0015035        
  5   2970.0000000             -0.0046766        
  6   1064.0000000             -0.0140154        
  7    410.8000000             -0.0385750        
  8    168.0000000             -0.0908526        
  9     71.9900000             -0.1685476        
 10     31.6700000             -0.1762288        
 11     12.8900000              0.1095078        
 12      5.9290000              0.5638908        
 13      2.6780000              0.4444235        
S   13
  1 950600.0000000              0.0000155        
  2 142300.0000000              0.0000491        
  3  32360.0000000              0.0001536        
  4   9145.0000000              0.0004697        
  5   2970.0000000              0.0014670        
  6   1064.0000000              0.0043862        
  7    410.8000000              0.0121987        
  8    168.0000000              0.0288360        
  9     71.9900000              0.0554744        
 10     31.6700000              0.0594865        
 11     12.8900000             -0.0387248        
 12      5.9290000             -0.2779522        
 13      2.6780000             -0.3580799        
S   1
  1      0.9416000              1.0000000        
S   1
  1      0.4239000              1.0000000        
S   1
  1      0.1714000              1.0000000        
S   1
  1     24.0240000              1.0000000        
S   1
  1     12.7060000              1.0000000        
S   1
  1      6.7200000              1.0000000        
S   1
  1      0.0610000              1.0000000        
P   8
  1   1890.0000000              0.0006345        
  2    447.8000000              0.0045580        
  3    144.6000000              0.0229891        
  4     54.4600000              0.0840762        
  5     22.5100000              0.2179697        
  6      9.7740000              0.3744141        
  7      4.3680000              0.3654219        
  8      1.9590000              0.1286601        
P   8
  1   1890.0000000             -0.0001777        
  2    447.8000000             -0.0012754        
  3    144.6000000             -0.0065156        
  4     54.4600000             -0.0241765        
  5     22.5100000             -0.0651679        
  6      9.7740000             -0.1153641        
  7      4.3680000             -0.1230461        
  8      1.9590000              0.0657576        
P   1
  1      0.8260000              1.0000000        
P   1
  1      0.3297000              1.0000000        
P   1
  1      0.1242000              1.0000000        
P   1
  1     23.6270000              1.0000000        
P   1
  1     10.6540000              1.0000000        
P   1
  1      4.8040000              1.0000000        
P   1
  1      0.0435000              1.0000000        
D   1
  1      0.3110000              1.0000000        
D   1
  1      0.7630000              1.0000000        
D   1
  1      1.8730000              1.0000000        
D   1
  1     37.3640000              1.0000000        
D   1
  1     15.0130000              1.0000000        
D   1
  1      6.0320000              1.0000000        
D   1
  1      0.1160000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
F   1
  1     21.8840000              1.0000000        
F   1
  1      7.9680000              1.0000000        
F   1
  1      0.2940000              1.0000000        
G   1
  1      1.0070000              1.0000000        
G   1
  1     17.2430000              1.0000000        
G   1
  1      0.4590000              1.0000000        
$


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   5988.0000000              0.0001330        
  2    898.9000000              0.0010250        
  3    205.9000000              0.0052720        
  4     59.2400000              0.0209290        
  5     19.8700000              0.0663400        
  6      7.4060000              0.1657750        
  7      2.9300000              0.3150380        
  8      1.1890000              0.3935230        
  9      0.4798000              0.1908700        
S   9
  1   5988.0000000             -0.0000210        
  2    898.9000000             -0.0001610        
  3    205.9000000             -0.0008200        
  4     59.2400000             -0.0033260        
  5     19.8700000             -0.0105190        
  6      7.4060000             -0.0280970        
  7      2.9300000             -0.0559360        
  8      1.1890000             -0.0992370        
  9      0.4798000             -0.1121890        
S   1
  1      0.0750900              1.0000000        
S   1
  1      0.0283200              1.0000000        
S   1
  1      1.9740000              1.0000000        
S   1
  1      0.6830000              1.0000000        
S   1
  1      0.0076000              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        
P   1
  1      7.3200000              1.0000000        
P   1
  1      1.8750000              1.0000000        
P   1
  1      0.0091000              1.0000000        
D   1
  1      0.1874000              1.0000000        
D   1
  1      0.0801000              1.0000000        
D   1
  1      4.9120000              1.0000000        
D   1
  1      0.0371000              1.0000000        
F   1
  1      0.1829000              1.0000000        
F   1
  1      0.0816000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1   6863.0000000              0.0002360        
  2   1030.0000000              0.0018260        
  3    234.7000000              0.0094520        
  4     66.5600000              0.0379570        
  5     21.6900000              0.1199650        
  6      7.7340000              0.2821620        
  7      2.9160000              0.4274040        
  8      1.1300000              0.2662780        
  9      0.1101000             -0.0072750        
S   9
  1   6863.0000000             -0.0000430        
  2   1030.0000000             -0.0003330        
  3    234.7000000             -0.0017360        
  4     66.5600000             -0.0070120        
  5     21.6900000             -0.0231260        
  6      7.7340000             -0.0581380        
  7      2.9160000             -0.1145560        
  8      1.1300000             -0.1359080        
  9      0.1101000              0.5774410        
S   1
  1      0.2577000              1.0000000        
S   1
  1      0.0440900              1.0000000        
S   1
  1      4.6040000              1.0000000        
S   1
  1      1.6170000              1.0000000        
S   1
  1      0.0150300              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        
P   1
  1     14.4970000              1.0000000        
P   1
  1      3.7870000              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.3480000              1.0000000        
D   1
  1      0.1803000              1.0000000        
D   1
  1      9.1830000              1.0000000        
D   1
  1      0.0654000              1.0000000        
F   1
  1      0.3250000              1.0000000        
F   1
  1      0.1533000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: B
data:
BORON
S   8
  1   5473.0000000              0.0005550        
  2    820.9000000              0.0042910        
  3    186.8000000              0.0219490        
  4     52.8300000              0.0844410        
  5     17.0800000              0.2385570        
  6      5.9990000              0.4350720        
  7      2.2080000              0.3419550        
  8      0.2415000             -0.0095450        
S   8
  1   5473.0000000             -0.0001120        
  2    820.9000000             -0.0008680        
  3    186.8000000             -0.0044840        
  4     52.8300000             -0.0176830        
  5     17.0800000             -0.0536390        
  6      5.9990000             -0.1190050        
  7      2.2080000             -0.1658240        
  8      0.2415000              0.5959810        
S   1
  1      0.5879000              1.0000000        
S   1
  1      0.0861000              1.0000000        
S   1
  1      2.9400000              1.0000000        
S   1
  1      8.3110000              1.0000000        
S   1
  1      0.0291400              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        
P   1
  1      6.0160000              1.0000000        
P   1
  1     22.8910000              1.0000000        
P   1
  1      0.0209600              1.0000000        
D   1
  1      0.6610000              1.0000000        
D   1
  1      0.1990000              1.0000000        
D   1
  1     13.0150000              1.0000000        
D   1
  1      0.0604000              1.0000000        
F   1
  1      0.4900000              1.0000000        
F   1
  1      0.1630000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: C
data:
CARBON
S   8
  1   8236.0000000              0.0005310        
  2   1235.0000000              0.0041080        
  3    280.8000000              0.0210870        
  4     79.2700000              0.0818530        
  5     25.5900000              0.2348170        
  6      8.9970000              0.4344010        
  7      3.3190000              0.3461290        
  8      0.3643000             -0.0089830        
S   8
  1   8236.0000000             -0.0001130        
  2   1235.0000000             -0.0008780        
  3    280.8000000             -0.0045400        
  4     79.2700000             -0.0181330        
  5     25.5900000             -0.0557600        
  6      8.9970000             -0.1268950        
  7      3.3190000             -0.1703520        
  8      0.3643000              0.5986840        
S   1
  1      0.9059000              1.0000000        
S   1
  1      0.1285000              1.0000000        
S   1
  1      4.2920000              1.0000000        
S   1
  1     11.8760000              1.0000000        
S   1
  1      0.0440200              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        
P   1
  1      8.7780000              1.0000000        
P   1
  1     33.1900000              1.0000000        
P   1
  1      0.0356900              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.3180000              1.0000000        
D   1
  1     14.8390000              1.0000000        
D   1
  1      0.1000000              1.0000000        
F   1
  1      0.7610000              1.0000000        
F   1
  1      0.2680000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   8
  1  11420.0000000              0.0005230        
  2   1712.0000000              0.0040450        
  3    389.3000000              0.0207750        
  4    110.0000000              0.0807270        
  5     35.5700000              0.2330740        
  6     12.5400000              0.4335010        
  7      4.6440000              0.3474720        
  8      0.5118000             -0.0085080        
S   8
  1  11420.0000000             -0.0001150        
  2   1712.0000000             -0.0008950        
  3    389.3000000             -0.0046240        
  4    110.0000000             -0.0185280        
  5     35.5700000             -0.0573390        
  6     12.5400000             -0.1320760        
  7      4.6440000             -0.1725100        
  8      0.5118000              0.5999440        
S   1
  1      1.2930000              1.0000000        
S   1
  1      0.1787000              1.0000000        
S   1
  1      5.9520000              1.0000000        
S   1
  1     16.2010000              1.0000000        
S   1
  1      0.0576000              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        
P   1
  1     11.8710000              1.0000000        
P   1
  1     44.8490000              1.0000000        
P   1
  1      0.0491000              1.0000000        
D   1
  1      1.6540000              1.0000000        
D   1
  1      0.4690000              1.0000000        
D   1
  1     14.2000000              1.0000000        
D   1
  1      0.1510000              1.0000000        
F   1
  1      1.0930000              1.0000000        
F   1
  1      0.3640000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   8
  1  15330.0000000              0.0005080        
  2   2299.0000000              0.0039290        
  3    522.4000000              0.0202430        
  4    147.3000000              0.0791810        
  5     47.5500000              0.2306870        
  6     16.7600000              0.4331180        
  7      6.2070000              0.3502600        
  8      0.6882000             -0.0081540        
S   8
  1  15330.0000000             -0.0001150        
  2   2299.0000000             -0.0008950        
  3    522.4000000             -0.0046360        
  4    147.3000000             -0.0187240        
  5     47.5500000             -0.0584630        
  6     16.7600000             -0.1364630        
  7      6.2070000             -0.1757400        
  8      0.6882000              0.6034180        
S   1
  1      1.7520000              1.0000000        
S   1
  1      0.2384000              1.0000000        
S   1
  1      7.8450000              1.0000000        
S   1
  1     21.0320000              1.0000000        
S   1
  1      0.0737600              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        
P   1
  1     15.1590000              1.0000000        
P   1
  1     57.4370000              1.0000000        
P   1
  1      0.0597400              1.0000000        
D   1
  1      2.3140000              1.0000000        
D   1
  1      0.6450000              1.0000000        
D   1
  1     15.8580000              1.0000000        
D   1
  1      0.2140000              1.0000000        
F   1
  1      1.4280000              1.0000000        
F   1
  1      0.5000000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   8
  1  19500.0000000              0.0005070        
  2   2923.0000000              0.0039230        
  3    664.5000000              0.0202000        
  4    187.5000000              0.0790100        
  5     60.6200000              0.2304390        
  6     21.4200000              0.4328720        
  7      7.9500000              0.3499640        
  8      0.8815000             -0.0078920        
S   8
  1  19500.0000000             -0.0001170        
  2   2923.0000000             -0.0009120        
  3    664.5000000             -0.0047170        
  4    187.5000000             -0.0190860        
  5     60.6200000             -0.0596550        
  6     21.4200000             -0.1400100        
  7      7.9500000             -0.1767820        
  8      0.8815000              0.6050430        
S   1
  1      2.2570000              1.0000000        
S   1
  1      0.3041000              1.0000000        
S   1
  1      9.8120000              1.0000000        
S   1
  1     25.9430000              1.0000000        
S   1
  1      0.0915800              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        
P   1
  1     18.7560000              1.0000000        
P   1
  1     71.3480000              1.0000000        
P   1
  1      0.0736100              1.0000000        
D   1
  1      3.1070000              1.0000000        
D   1
  1      0.8550000              1.0000000        
D   1
  1     19.1080000              1.0000000        
D   1
  1      0.2920000              1.0000000        
F   1
  1      1.9170000              1.0000000        
F   1
  1      0.7240000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ne
data:
NEON
S   8
  1  24350.0000000              0.0005020        
  2   3650.0000000              0.0038810        
  3    829.6000000              0.0199970        
  4    234.0000000              0.0784180        
  5     75.6100000              0.2296760        
  6     26.7300000              0.4327220        
  7      9.9270000              0.3506420        
  8      1.1020000             -0.0076450        
S   8
  1  24350.0000000             -0.0001180        
  2   3650.0000000             -0.0009150        
  3    829.6000000             -0.0047370        
  4    234.0000000             -0.0192330        
  5     75.6100000             -0.0603690        
  6     26.7300000             -0.1425080        
  7      9.9270000             -0.1777100        
  8      1.1020000              0.6058360        
S   1
  1      2.8360000              1.0000000        
S   1
  1      0.3782000              1.0000000        
S   1
  1     12.0830000              1.0000000        
S   1
  1     31.9470000              1.0000000        
S   1
  1      0.1133000              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        
P   1
  1     22.8270000              1.0000000        
P   1
  1     87.0170000              1.0000000        
P   1
  1      0.0917500              1.0000000        
D   1
  1      4.0140000              1.0000000        
D   1
  1      1.0960000              1.0000000        
D   1
  1     23.1680000              1.0000000        
D   1
  1      0.3860000              1.0000000        
F   1
  1      2.5440000              1.0000000        
F   1
  1      1.0840000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Na
data:
SODIUM
S   14
  1 423000.0000000              0.180618D-04     
  2  63340.0000000              0.140430D-03     
  3  14410.0000000              0.738438D-03     
  4   4077.0000000              0.311182D-02     
  5   1328.0000000              0.112081D-01     
  6    478.6000000              0.352828D-01     
  7    186.2000000              0.959897D-01     
  8     76.9200000              0.213735D+00     
  9     33.3200000              0.348688D+00     
 10     15.0000000              0.324566D+00     
 11      6.8690000              0.112633D+00     
 12      2.6830000              0.706797D-02     
 13      1.1090000              0.598010D-03     
 14      0.0601500             -0.530870D-05     
S   14
  1 423000.0000000             -0.440653D-05     
  2  63340.0000000             -0.343443D-04     
  3  14410.0000000             -0.180114D-03     
  4   4077.0000000             -0.763900D-03     
  5   1328.0000000             -0.275248D-02     
  6    478.6000000             -0.886016D-02     
  7    186.2000000             -0.247939D-01     
  8     76.9200000             -0.605995D-01     
  9     33.3200000             -0.116446D+00     
 10     15.0000000             -0.162437D+00     
 11      6.8690000             -0.438891D-01     
 12      2.6830000              0.337917D+00     
 13      1.1090000              0.561347D+00     
 14      0.0601500              0.406754D-02     
S   14
  1 423000.0000000              0.663019D-06     
  2  63340.0000000              0.515769D-05     
  3  14410.0000000              0.271250D-04     
  4   4077.0000000              0.114635D-03     
  5   1328.0000000              0.415118D-03     
  6    478.6000000              0.132978D-02     
  7    186.2000000              0.375595D-02     
  8     76.9200000              0.914025D-02     
  9     33.3200000              0.179859D-01     
 10     15.0000000              0.251477D-01     
 11      6.8690000              0.763522D-02     
 12      2.6830000             -0.614589D-01     
 13      1.1090000             -0.115721D+00     
 14      0.0601500              0.626406D+00     
S   1
  1      0.4540000              1.0000000        
S   1
  1      0.0238200              1.0000000        
S   1
  1      4.1890000              1.0000000        
S   1
  1      0.6260000              1.0000000        
S   1
  1      0.0066500              1.0000000        
P   8
  1    243.3000000              0.224392D-02     
  2     57.3900000              0.173997D-01     
  3     18.1000000              0.774125D-01     
  4      6.5750000              0.219102D+00     
  5      2.5210000              0.378522D+00     
  6      0.9607000              0.394902D+00     
  7      0.3512000              0.160424D+00     
  8      0.0982700              0.233311D-02     
P   8
  1    243.3000000             -0.222401D-03     
  2     57.3900000             -0.174277D-02     
  3     18.1000000             -0.775456D-02     
  4      6.5750000             -0.225187D-01     
  5      2.5210000             -0.384330D-01     
  6      0.9607000             -0.450177D-01     
  7      0.3512000             -0.192132D-01     
  8      0.0982700              0.182697D+00     
P   1
  1      0.0373400              1.0000000        
P   1
  1      0.0150000              1.0000000        
P   1
  1      1.5690000              1.0000000        
P   1
  1      0.5120000              1.0000000        
P   1
  1      0.0070000              1.0000000        
D   1
  1      0.1367000              1.0000000        
D   1
  1      0.0636000              1.0000000        
D   1
  1      5.4040000              1.0000000        
D   1
  1      1.5300000              1.0000000        
D   1
  1      0.0223000              1.0000000        
F   1
  1      0.1397000              1.0000000        
F   1
  1      3.4650000              1.0000000        
F   1
  1      0.0714000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   13
  1 164900.0000000              0.729929D-04     
  2  24710.0000000              0.566652D-03     
  3   5628.0000000              0.296269D-02     
  4   1596.0000000              0.122962D-01     
  5    521.0000000              0.427324D-01     
  6    188.0000000              0.123013D+00     
  7     73.0100000              0.274832D+00     
  8     29.9000000              0.401818D+00     
  9     12.5400000              0.264697D+00     
 10      4.3060000              0.332612D-01     
 11      1.8260000             -0.441335D-02     
 12      0.7417000              0.206024D-02     
 13      0.0761200              0.708195D-03     
S   13
  1 164900.0000000             -0.184248D-04     
  2  24710.0000000             -0.143500D-03     
  3   5628.0000000             -0.748710D-03     
  4   1596.0000000             -0.314407D-02     
  5    521.0000000             -0.110481D-01     
  6    188.0000000             -0.336058D-01     
  7     73.0100000             -0.825946D-01     
  8     29.9000000             -0.159314D+00     
  9     12.5400000             -0.152888D+00     
 10      4.3060000              0.190849D+00     
 11      1.8260000              0.579964D+00     
 12      0.7417000              0.372029D+00     
 13      0.0761200             -0.119344D-01     
S   13
  1 164900.0000000              0.355176D-05     
  2  24710.0000000              0.276420D-04     
  3   5628.0000000              0.144404D-03     
  4   1596.0000000              0.605744D-03     
  5    521.0000000              0.213527D-02     
  6    188.0000000              0.649934D-02     
  7     73.0100000              0.161446D-01     
  8     29.9000000              0.315766D-01     
  9     12.5400000              0.316374D-01     
 10      4.3060000             -0.439140D-01     
 11      1.8260000             -0.151093D+00     
 12      0.7417000             -0.217668D+00     
 13      0.0761200              0.547245D+00     
S   1
  1      0.1457000              1.0000000        
S   1
  1      0.0331000              1.0000000        
S   1
  1     17.5160000              1.0000000        
S   1
  1      3.8700000              1.0000000        
S   1
  1      0.0129000              1.0000000        
P   8
  1    316.9000000              0.207532D-02     
  2     74.8600000              0.162869D-01     
  3     23.7200000              0.738697D-01     
  4      8.6690000              0.214297D+00     
  5      3.3630000              0.382154D+00     
  6      1.3100000              0.398178D+00     
  7      0.4911000              0.152878D+00     
  8      0.2364000             -0.437540D-02     
P   8
  1    316.9000000             -0.329727D-03     
  2     74.8600000             -0.258754D-02     
  3     23.7200000             -0.119120D-01     
  4      8.6690000             -0.350227D-01     
  5      3.3630000             -0.639968D-01     
  6      1.3100000             -0.704436D-01     
  7      0.4911000             -0.375836D-01     
  8      0.2364000              0.177043D+00     
P   1
  1      0.0873300              1.0000000        
P   1
  1      0.0323700              1.0000000        
P   1
  1     20.2970000              1.0000000        
P   1
  1      5.1050000              1.0000000        
P   1
  1      0.0074500              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.2940000              1.0000000        
D   1
  1      7.0290000              1.0000000        
D   1
  1      2.1210000              1.0000000        
D   1
  1      0.0468000              1.0000000        
F   1
  1      0.2520000              1.0000000        
F   1
  1      4.5300000              1.0000000        
F   1
  1      0.0940000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   13
  1 205500.0000000              0.678836D-04     
  2  30780.0000000              0.527149D-03     
  3   7006.0000000              0.276203D-02     
  4   1985.0000000              0.114728D-01     
  5    649.1000000              0.398188D-01     
  6    235.0000000              0.115040D+00     
  7     91.6200000              0.260887D+00     
  8     37.6700000              0.396386D+00     
  9     15.9100000              0.284597D+00     
 10      5.8500000              0.444583D-01     
 11      2.5420000             -0.489838D-02     
 12      1.0570000              0.261253D-02     
 13      0.1455000              0.722068D-03     
S   13
  1 205500.0000000             -0.176377D-04     
  2  30780.0000000             -0.137195D-03     
  3   7006.0000000             -0.718910D-03     
  4   1985.0000000             -0.301146D-02     
  5    649.1000000             -0.106014D-01     
  6    235.0000000             -0.321345D-01     
  7     91.6200000             -0.803156D-01     
  8     37.6700000             -0.156794D+00     
  9     15.9100000             -0.168376D+00     
 10      5.8500000              0.126879D+00     
 11      2.5420000              0.561494D+00     
 12      1.0570000              0.436613D+00     
 13      0.1455000             -0.114563D-01     
S   13
  1 205500.0000000              0.407315D-05     
  2  30780.0000000              0.316566D-04     
  3   7006.0000000              0.166116D-03     
  4   1985.0000000              0.694992D-03     
  5    649.1000000              0.245511D-02     
  6    235.0000000              0.744598D-02     
  7     91.6200000              0.188253D-01     
  8     37.6700000              0.372772D-01     
  9     15.9100000              0.419496D-01     
 10      5.8500000             -0.354375D-01     
 11      2.5420000             -0.175132D+00     
 12      1.0570000             -0.276203D+00     
 13      0.1455000              0.652809D+00     
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
S   1
  1      7.4880000              1.0000000        
S   1
  1      1.2720000              1.0000000        
S   1
  1      0.0221000              1.0000000        
P   7
  1    444.4000000              0.162786D-02     
  2    105.1000000              0.130687D-01     
  3     33.4700000              0.612341D-01     
  4     12.3300000              0.187870D+00     
  5      4.8690000              0.360452D+00     
  6      1.9610000              0.408454D+00     
  7      0.1888000              0.976514D-02     
P   7
  1    444.4000000             -0.286341D-03     
  2    105.1000000             -0.242308D-02     
  3     33.4700000             -0.108658D-01     
  4     12.3300000             -0.364307D-01     
  5      4.8690000             -0.641074D-01     
  6      1.9610000             -0.972239D-01     
  7      0.1888000              0.503448D+00     
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
P   1
  1      2.2020000              1.0000000        
P   1
  1      5.5480000              1.0000000        
P   1
  1      0.0146000              1.0000000        
D   1
  1      0.1090000              1.0000000        
D   1
  1      0.3330000              1.0000000        
D   1
  1      2.6340000              1.0000000        
D   1
  1      8.6460000              1.0000000        
D   1
  1      0.0356000              1.0000000        
F   1
  1      0.2440000              1.0000000        
F   1
  1      5.6860000              1.0000000        
F   1
  1      0.0858000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Si
data:
SILICON
S   13
  1 254900.0000000              0.625101D-04     
  2  38190.0000000              0.485553D-03     
  3   8690.0000000              0.254516D-02     
  4   2462.0000000              0.105866D-01     
  5    804.8000000              0.368787D-01     
  6    291.3000000              0.107479D+00     
  7    113.6000000              0.247936D+00     
  8     46.7500000              0.390927D+00     
  9     19.8200000              0.302026D+00     
 10      7.7080000              0.559236D-01     
 11      3.3400000             -0.402406D-02     
 12      1.4020000              0.258030D-02     
 13      0.2070000              0.607930D-03     
S   13
  1 254900.0000000             -0.166370D-04     
  2  38190.0000000             -0.129310D-03     
  3   8690.0000000             -0.678828D-03     
  4   2462.0000000             -0.284117D-02     
  5    804.8000000             -0.100551D-01     
  6    291.3000000             -0.305774D-01     
  7    113.6000000             -0.777256D-01     
  8     46.7500000             -0.154236D+00     
  9     19.8200000             -0.180368D+00     
 10      7.7080000              0.798218D-01     
 11      3.3400000              0.547441D+00     
 12      1.4020000              0.480119D+00     
 13      0.2070000             -0.106996D-01     
S   13
  1 254900.0000000              0.426257D-05     
  2  38190.0000000              0.331062D-04     
  3   8690.0000000              0.174015D-03     
  4   2462.0000000              0.727574D-03     
  5    804.8000000              0.258333D-02     
  6    291.3000000              0.786354D-02     
  7    113.6000000              0.202155D-01     
  8     46.7500000              0.407320D-01     
  9     19.8200000              0.499358D-01     
 10      7.7080000             -0.249396D-01     
 11      3.3400000             -0.190350D+00     
 12      1.4020000             -0.318350D+00     
 13      0.2070000              0.681180D+00     
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
S   1
  1      9.1640000              1.0000000        
S   1
  1      1.6210000              1.0000000        
S   1
  1      0.0330000              1.0000000        
P   7
  1    481.5000000              0.192045D-02     
  2    113.9000000              0.153552D-01     
  3     36.2300000              0.713991D-01     
  4     13.3400000              0.213052D+00     
  5      5.2520000              0.390354D+00     
  6      2.1200000              0.393721D+00     
  7      0.2528000              0.395630D-02     
P   7
  1    481.5000000             -0.405220D-03     
  2    113.9000000             -0.335896D-02     
  3     36.2300000             -0.152860D-01     
  4     13.3400000             -0.489218D-01     
  5      5.2520000             -0.855008D-01     
  6      2.1200000             -0.112137D+00     
  7      0.2528000              0.551919D+00     
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
P   1
  1      6.4580000              1.0000000        
P   1
  1      2.5170000              1.0000000        
P   1
  1      0.0237000              1.0000000        
D   1
  1      0.1590000              1.0000000        
D   1
  1      0.4810000              1.0000000        
D   1
  1     10.6710000              1.0000000        
D   1
  1      3.3080000              1.0000000        
D   1
  1      0.0556000              1.0000000        
F   1
  1      0.3360000              1.0000000        
F   1
  1      7.0010000              1.0000000        
F   1
  1      0.1250000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   13
  1 312400.0000000              0.576960D-04     
  2  46800.0000000              0.448296D-03     
  3  10650.0000000              0.234939D-02     
  4   3018.0000000              0.978265D-02     
  5    986.8000000              0.341467D-01     
  6    357.4000000              0.100204D+00     
  7    139.6000000              0.234372D+00     
  8     57.6300000              0.382434D+00     
  9     24.6000000              0.318088D+00     
 10     10.1200000              0.707788D-01     
 11      4.2830000             -0.181799D-02     
 12      1.8050000              0.216180D-02     
 13      0.2782000              0.432297D-03     
S   13
  1 312400.0000000             -0.156709D-04     
  2  46800.0000000             -0.121724D-03     
  3  10650.0000000             -0.639672D-03     
  4   3018.0000000             -0.267426D-02     
  5    986.8000000             -0.949831D-02     
  6    357.4000000             -0.289349D-01     
  7    139.6000000             -0.745121D-01     
  8     57.6300000             -0.149938D+00     
  9     24.6000000             -0.189467D+00     
 10     10.1200000              0.363270D-01     
 11      4.2830000              0.528816D+00     
 12      1.8050000              0.519115D+00     
 13      0.2782000             -0.925695D-02     
S   13
  1 312400.0000000              0.430631D-05     
  2  46800.0000000              0.334194D-04     
  3  10650.0000000              0.175885D-03     
  4   3018.0000000              0.734340D-03     
  5    986.8000000              0.261775D-02     
  6    357.4000000              0.797852D-02     
  7    139.6000000              0.207940D-01     
  8     57.6300000              0.424446D-01     
  9     24.6000000              0.563436D-01     
 10     10.1200000             -0.127358D-01     
 11      4.2830000             -0.196495D+00     
 12      1.8050000             -0.353555D+00     
 13      0.2782000              0.700912D+00     
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
S   1
  1     10.9780000              1.0000000        
S   1
  1      2.0060000              1.0000000        
S   1
  1      0.0409000              1.0000000        
P   7
  1    504.9000000              0.233728D-02     
  2    119.4000000              0.185410D-01     
  3     37.9600000              0.849693D-01     
  4     13.9500000              0.244615D+00     
  5      5.4570000              0.422766D+00     
  6      2.1770000              0.368439D+00     
  7      0.2877000             -0.379005D-02     
P   7
  1    504.9000000             -0.555236D-03     
  2    119.4000000             -0.445913D-02     
  3     37.9600000             -0.206350D-01     
  4     13.9500000             -0.617694D-01     
  5      5.4570000             -0.108924D+00     
  6      2.1770000             -0.105599D+00     
  7      0.2877000              0.576981D+00     
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
P   1
  1      7.0840000              1.0000000        
P   1
  1      2.7010000              1.0000000        
P   1
  1      0.0307000              1.0000000        
D   1
  1      0.2160000              1.0000000        
D   1
  1      0.6520000              1.0000000        
D   1
  1     12.8910000              1.0000000        
D   1
  1      4.0560000              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      0.4520000              1.0000000        
F   1
  1      8.4620000              1.0000000        
F   1
  1      0.1650000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: S
data:
SULFUR
S   13
  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      0.3490000              0.301306D-03     
S   13
  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      0.3490000             -0.918072D-02     
S   13
  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      0.3490000              0.714147D+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
S   1
  1     12.9280000              1.0000000        
S   1
  1      2.4130000              1.0000000        
S   1
  1      0.0497000              1.0000000        
P   7
  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      0.3229000             -0.502977D-02     
P   7
  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      0.3229000              0.569394D+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
P   1
  1      8.1140000              1.0000000        
P   1
  1      3.1060000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
D   1
  1     15.2540000              1.0000000        
D   1
  1      4.8450000              1.0000000        
D   1
  1      0.1010000              1.0000000        
F   1
  1      0.5570000              1.0000000        
F   1
  1     10.0520000              1.0000000        
F   1
  1      0.2180000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   13
  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      0.4313000              0.156136D-03     
S   13
  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      0.4313000             -0.835091D-02     
S   13
  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      0.4313000              0.725661D+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
S   1
  1     15.0640000              1.0000000        
S   1
  1      2.8740000              1.0000000        
S   1
  1      0.0591000              1.0000000        
P   7
  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      0.3818000             -0.458423D-02     
P   7
  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      0.3818000              0.564667D+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
P   1
  1      9.4800000              1.0000000        
P   1
  1      3.6680000              1.0000000        
P   1
  1      0.0419000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1     17.9570000              1.0000000        
D   1
  1      5.7600000              1.0000000        
D   1
  1      0.1350000              1.0000000        
F   1
  1      0.7060000              1.0000000        
F   1
  1     11.7790000              1.0000000        
F   1
  1      0.3120000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ar
data:
ARGON
S   13
  1 545000.0000000              0.455828D-04     
  2  81640.0000000              0.354108D-03     
  3  18580.0000000              0.185797D-02     
  4   5261.0000000              0.776851D-02     
  5   1717.0000000              0.274232D-01     
  6    619.9000000              0.823836D-01     
  7    241.6000000              0.201230D+00     
  8     99.7900000              0.356781D+00     
  9     43.1500000              0.349563D+00     
 10     19.1400000              0.118266D+00     
 11      7.4880000              0.560190D-02     
 12      3.2050000              0.483473D-03     
 13      0.5204000              0.292025D-04     
S   13
  1 545000.0000000             -0.129551D-04     
  2  81640.0000000             -0.100428D-03     
  3  18580.0000000             -0.529583D-03     
  4   5261.0000000             -0.221396D-02     
  5   1717.0000000             -0.796845D-02     
  6    619.9000000             -0.245803D-01     
  7    241.6000000             -0.657798D-01     
  8     99.7900000             -0.137942D+00     
  9     43.1500000             -0.201630D+00     
 10     19.1400000             -0.412834D-01     
 11      7.4880000              0.484680D+00     
 12      3.2050000              0.579224D+00     
 13      0.5204000             -0.727553D-02     
S   13
  1 545000.0000000              0.404990D-05     
  2  81640.0000000              0.313691D-04     
  3  18580.0000000              0.165646D-03     
  4   5261.0000000              0.691662D-03     
  5   1717.0000000              0.249790D-02     
  6    619.9000000              0.771074D-02     
  7    241.6000000              0.208714D-01     
  8     99.7900000              0.443965D-01     
  9     43.1500000              0.680224D-01     
 10     19.1400000              0.141350D-01     
 11      7.4880000             -0.207489D+00     
 12      3.2050000             -0.425045D+00     
 13      0.5204000              0.733627D+00     
S   1
  1      1.1960000              1.0000000        
S   1
  1      0.1954000              1.0000000        
S   1
  1     17.3620000              1.0000000        
S   1
  1      3.3780000              1.0000000        
S   1
  1      0.0685000              1.0000000        
P   7
  1    761.8000000              0.236976D-02     
  2    180.2000000              0.190199D-01     
  3     57.5000000              0.880807D-01     
  4     21.2400000              0.256377D+00     
  5      8.3880000              0.438711D+00     
  6      3.4160000              0.347569D+00     
  7      0.4523000             -0.523882D-02     
P   7
  1    761.8000000             -0.667211D-03     
  2    180.2000000             -0.532717D-02     
  3     57.5000000             -0.255494D-01     
  4     21.2400000             -0.757197D-01     
  5      8.3880000             -0.141133D+00     
  6      3.4160000             -0.932768D-01     
  7      0.4523000              0.562450D+00     
P   1
  1      1.2060000              1.0000000        
P   1
  1      0.1545000              1.0000000        
P   1
  1     11.0190000              1.0000000        
P   1
  1      4.3070000              1.0000000        
P   1
  1      0.0487000              1.0000000        
D   1
  1      0.4100000              1.0000000        
D   1
  1      1.2540000              1.0000000        
D   1
  1     20.7060000              1.0000000        
D   1
  1      6.6810000              1.0000000        
D   1
  1      0.1690000              1.0000000        
F   1
  1      0.8900000              1.0000000        
F   1
  1     13.6740000              1.0000000        
F   1
  1      0.4060000              1.0000000        
$


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Al
data:
ALUMINUM
S   16
  1 3269000.0000000             0.213962D-05     
  2 489400.0000000              0.166264D-04     
  3 111400.0000000              0.875168D-04     
  4  31560.0000000              0.368990D-03     
  5  10320.0000000              0.133903D-02     
  6   3731.0000000              0.435636D-02     
  7   1456.0000000              0.128955D-01     
  8    604.1000000              0.348201D-01     
  9    263.5000000              0.843530D-01     
 10    119.8000000              0.175907D+00     
 11     56.3200000              0.292091D+00     
 12     27.1900000              0.328220D+00     
 13     13.2600000              0.186927D+00     
 14      6.0520000              0.310430D-01     
 15      2.9810000             -0.508922D-03     
 16      1.4760000              0.148836D-02     
S   16
  1 3269000.0000000            -0.556026D-06     
  2 489400.0000000             -0.432303D-05     
  3 111400.0000000             -0.227413D-04     
  4  31560.0000000             -0.960116D-04     
  5  10320.0000000             -0.348376D-03     
  6   3731.0000000             -0.113836D-02     
  7   1456.0000000             -0.338744D-02     
  8    604.1000000             -0.931505D-02     
  9    263.5000000             -0.233023D-01     
 10    119.8000000             -0.523486D-01     
 11     56.3200000             -0.999499D-01     
 12     27.1900000             -0.150560D+00     
 13     13.2600000             -0.119121D+00     
 14      6.0520000              0.108091D+00     
 15      2.9810000              0.411129D+00     
 16      1.4760000              0.457214D+00     
S   16
  1 3269000.0000000             0.128423D-06     
  2 489400.0000000              0.997514D-06     
  3 111400.0000000              0.525480D-05     
  4  31560.0000000              0.221450D-04     
  5  10320.0000000              0.805464D-04     
  6   3731.0000000              0.262506D-03     
  7   1456.0000000              0.784220D-03     
  8    604.1000000              0.215039D-02     
  9    263.5000000              0.541974D-02     
 10    119.8000000              0.121686D-01     
 11     56.3200000              0.236823D-01     
 12     27.1900000              0.360937D-01     
 13     13.2600000              0.303284D-01     
 14      6.0520000             -0.309034D-01     
 15      2.9810000             -0.119126D+00     
 16      1.4760000             -0.211145D+00     
S   1
  1      0.7334000              1.0000000        
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1088000              1.0000000        
S   1
  1      0.0467200              1.0000000        
S   1
  1      0.0177000              1.0000000        
P   8
  1   1461.0000000              0.208613D-03     
  2    346.2000000              0.181005D-02     
  3    112.2000000              0.973433D-02     
  4     42.5100000              0.378266D-01     
  5     17.7200000              0.110898D+00     
  6      7.8520000              0.234295D+00     
  7      3.5710000              0.345245D+00     
  8      1.6370000              0.331430D+00     
P   8
  1   1461.0000000             -0.371947D-04     
  2    346.2000000             -0.328563D-03     
  3    112.2000000             -0.174264D-02     
  4     42.5100000             -0.694828D-02     
  5     17.7200000             -0.202807D-01     
  6      7.8520000             -0.448657D-01     
  7      3.5710000             -0.643278D-01     
  8      1.6370000             -0.752666D-01     
P   1
  1      0.7382000              1.0000000        
P   1
  1      0.2577000              1.0000000        
P   1
  1      0.0977300              1.0000000        
P   1
  1      0.0369000              1.0000000        
P   1
  1      0.0115000              1.0000000        
D   1
  1      2.6390000              1.0000000        
D   1
  1      0.5880000              1.0000000        
D   1
  1      0.3800000              1.0000000        
D   1
  1      0.1800000              1.0000000        
D   1
  1      0.0728000              1.0000000        
D   1
  1      0.0254000              1.0000000        
F   1
  1      0.1300000              1.0000000        
F   1
  1      0.2580000              1.0000000        
F   1
  1      0.5130000              1.0000000        
F   1
  1      0.0509000              1.0000000        
G   1
  1      0.2520000              1.0000000        
G   1
  1      0.5430000              1.0000000        
G   1
  1      0.1069000              1.0000000        
H   1
  1      0.4460000              1.0000000        
H   1
  1      0.2270000              1.0000000


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Si
data:
SILICON
S   16
  1 3948000.0000000             0.203712D-05     
  2 591100.0000000              0.158394D-04     
  3 134500.0000000              0.833590D-04     
  4  38120.0000000              0.351361D-03     
  5  12460.0000000              0.127660D-02     
  6   4504.0000000              0.415191D-02     
  7   1758.0000000              0.123030D-01     
  8    729.1000000              0.333102D-01     
  9    318.0000000              0.809845D-01     
 10    144.6000000              0.170290D+00     
 11     67.9700000              0.286879D+00     
 12     32.8200000              0.330340D+00     
 13     16.0300000              0.196602D+00     
 14      7.3960000              0.354535D-01     
 15      3.6610000             -0.535204D-03     
 16      1.8230000              0.161465D-02     
S   16
  1 3948000.0000000            -0.542085D-06     
  2 591100.0000000             -0.421677D-05     
  3 134500.0000000             -0.221813D-04     
  4  38120.0000000             -0.936028D-04     
  5  12460.0000000             -0.340116D-03     
  6   4504.0000000             -0.111061D-02     
  7   1758.0000000             -0.330878D-02     
  8    729.1000000             -0.911602D-02     
  9    318.0000000             -0.228790D-01     
 10    144.6000000             -0.517119D-01     
 11     67.9700000             -0.999091D-01     
 12     32.8200000             -0.152747D+00     
 13     16.0300000             -0.127508D+00     
 14      7.3960000              0.946963D-01     
 15      3.6610000              0.414036D+00     
 16      1.8230000              0.467934D+00     
S   16
  1 3948000.0000000             0.138907D-06     
  2 591100.0000000              0.107953D-05     
  3 134500.0000000              0.568628D-05     
  4  38120.0000000              0.239537D-04     
  5  12460.0000000              0.872409D-04     
  6   4504.0000000              0.284163D-03     
  7   1758.0000000              0.849840D-03     
  8    729.1000000              0.233527D-02     
  9    318.0000000              0.590466D-02     
 10    144.6000000              0.133461D-01     
 11     67.9700000              0.262889D-01     
 12     32.8200000              0.407426D-01     
 13     16.0300000              0.361476D-01     
 14      7.3960000             -0.303923D-01     
 15      3.6610000             -0.135961D+00     
 16      1.8230000             -0.250144D+00     
S   1
  1      0.9147000              1.0000000        
S   1
  1      0.3393000              1.0000000        
S   1
  1      0.1500000              1.0000000        
S   1
  1      0.0643800              1.0000000        
S   1
  1      0.0260000              1.0000000        
P   8
  1   1780.0000000              0.201206D-03     
  2    421.8000000              0.174937D-02     
  3    136.7000000              0.948141D-02     
  4     51.8100000              0.372313D-01     
  5     21.6000000              0.110763D+00     
  6      9.5630000              0.237933D+00     
  7      4.3500000              0.353691D+00     
  8      2.0060000              0.328839D+00     
P   8
  1   1780.0000000             -0.427152D-04     
  2    421.8000000             -0.377039D-03     
  3    136.7000000             -0.202240D-02     
  4     51.8100000             -0.812833D-02     
  5     21.6000000             -0.242272D-01     
  6      9.5630000             -0.543825D-01     
  7      4.3500000             -0.799051D-01     
  8      2.0060000             -0.888958D-01     
P   1
  1      0.9205000              1.0000000        
P   1
  1      0.3500000              1.0000000        
P   1
  1      0.1381000              1.0000000        
P   1
  1      0.0533800              1.0000000        
P   1
  1      0.0192000              1.0000000        
D   1
  1      3.7380000              1.0000000        
D   1
  1      0.8930000              1.0000000        
D   1
  1      0.5330000              1.0000000        
D   1
  1      0.2580000              1.0000000        
D   1
  1      0.1050000              1.0000000        
D   1
  1      0.0390000              1.0000000        
F   1
  1      0.1690000              1.0000000        
F   1
  1      0.3410000              1.0000000        
F   1
  1      0.6880000              1.0000000        
F   1
  1      0.0735000              1.0000000        
G   1
  1      0.3200000              1.0000000        
G   1
  1      0.7050000              1.0000000        
G   1
  1      0.1510000              1.0000000        
H   1
  1      0.5830000              1.0000000        
H   1
  1      0.3230000              1.0000000


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: P
data:
PHOSPHORUS
S   16
  1 4666000.0000000             0.196759D-05     
  2 698600.0000000              0.152963D-04     
  3 159000.0000000              0.804826D-04     
  4  45040.0000000              0.339737D-03     
  5  14720.0000000              0.123291D-02     
  6   5323.0000000              0.401345D-02     
  7   2076.0000000              0.119124D-01     
  8    861.1000000              0.322511D-01     
  9    375.7000000              0.786643D-01     
 10    170.8000000              0.166458D+00     
 11     80.2900000              0.283039D+00     
 12     38.7700000              0.331942D+00     
 13     18.9300000              0.203352D+00     
 14      8.7960000              0.383183D-01     
 15      4.3580000             -0.384720D-03     
 16      2.1740000              0.158744D-02     
S   16
  1 4666000.0000000            -0.534153D-06     
  2 698600.0000000             -0.415422D-05     
  3 159000.0000000             -0.218484D-04     
  4  45040.0000000             -0.923272D-04     
  5  14720.0000000             -0.335109D-03     
  6   5323.0000000             -0.109508D-02     
  7   2076.0000000             -0.326798D-02     
  8    861.1000000             -0.899951D-02     
  9    375.7000000             -0.226528D-01     
 10    170.8000000             -0.514650D-01     
 11     80.2900000             -0.100186D+00     
 12     38.7700000             -0.155075D+00     
 13     18.9300000             -0.133818D+00     
 14      8.7960000              0.878361D-01     
 15      4.3580000              0.422581D+00     
 16      2.1740000              0.474899D+00     
S   16
  1 4666000.0000000             0.146776D-06     
  2 698600.0000000              0.114064D-05     
  3 159000.0000000              0.600568D-05     
  4  45040.0000000              0.253427D-04     
  5  14720.0000000              0.921606D-04     
  6   5323.0000000              0.300563D-03     
  7   2076.0000000              0.899884D-03     
  8    861.1000000              0.247354D-02     
  9    375.7000000              0.626812D-02     
 10    170.8000000              0.142598D-01     
 11     80.2900000              0.282769D-01     
 12     38.7700000              0.445124D-01     
 13     18.9300000              0.407217D-01     
 14      8.7960000             -0.301908D-01     
 15      4.3580000             -0.152894D+00     
 16      2.1740000             -0.282411D+00     
S   1
  1      1.0950000              1.0000000        
S   1
  1      0.4400000              1.0000000        
S   1
  1      0.1945000              1.0000000        
S   1
  1      0.0837600              1.0000000        
S   1
  1      0.0335000              1.0000000        
P   8
  1   2010.0000000              0.215915D-03     
  2    476.3000000              0.187536D-02     
  3    154.4000000              0.101742D-01     
  4     58.5100000              0.399856D-01     
  5     24.4000000              0.118563D+00     
  6     10.8000000              0.251816D+00     
  7      4.9130000              0.366565D+00     
  8      2.2690000              0.316177D+00     
P   8
  1   2010.0000000             -0.511444D-04     
  2    476.3000000             -0.448356D-03     
  3    154.4000000             -0.242340D-02     
  4     58.5100000             -0.969826D-02     
  5     24.4000000             -0.290965D-01     
  6     10.8000000             -0.641726D-01     
  7      4.9130000             -0.945071D-01     
  8      2.2690000             -0.934700D-01     
P   1
  1      1.0430000              1.0000000        
P   1
  1      0.4313000              1.0000000        
P   1
  1      0.1767000              1.0000000        
P   1
  1      0.0700900              1.0000000        
P   1
  1      0.0253000              1.0000000        
D   1
  1      5.1030000              1.0000000        
D   1
  1      1.2540000              1.0000000        
D   1
  1      0.7240000              1.0000000        
D   1
  1      0.3540000              1.0000000        
D   1
  1      0.1440000              1.0000000        
D   1
  1      0.0537000              1.0000000        
F   1
  1      0.2190000              1.0000000        
F   1
  1      0.4500000              1.0000000        
F   1
  1      0.9230000              1.0000000        
F   1
  1      0.0950000              1.0000000        
G   1
  1      0.4120000              1.0000000        
G   1
  1      0.9030000              1.0000000        
G   1
  1      0.1840000              1.0000000        
H   1
  1      0.7450000              1.0000000        
H   1
  1      0.3720000              1.0000000


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: S
data:
SULFUR
S   16
  1 5481000.0000000             0.189338D-05     
  2 820600.0000000              0.147211D-04     
  3 186700.0000000              0.775084D-04     
  4  52880.0000000              0.327224D-03     
  5  17250.0000000              0.119365D-02     
  6   6226.0000000              0.388393D-02     
  7   2429.0000000              0.115336D-01     
  8   1007.0000000              0.312748D-01     
  9    439.5000000              0.764387D-01     
 10    199.8000000              0.162700D+00     
 11     93.9200000              0.279328D+00     
 12     45.3400000              0.333145D+00     
 13     22.1500000              0.209836D+00     
 14     10.3400000              0.415974D-01     
 15      5.1190000             -0.450552D-03     
 16      2.5530000              0.168855D-02     
S   16
  1 5481000.0000000            -0.522912D-06     
  2 820600.0000000             -0.406690D-05     
  3 186700.0000000             -0.214065D-04     
  4  52880.0000000             -0.904540D-04     
  5  17250.0000000             -0.330080D-03     
  6   6226.0000000             -0.107782D-02     
  7   2429.0000000             -0.321874D-02     
  8   1007.0000000             -0.887217D-02     
  9    439.5000000             -0.223771D-01     
 10    199.8000000             -0.510577D-01     
 11     93.9200000             -0.100225D+00     
 12     45.3400000             -0.156795D+00     
 13     22.1500000             -0.139748D+00     
 14     10.3400000              0.810059D-01     
 15      5.1190000              0.430883D+00     
 16      2.5530000              0.481688D+00     
S   16
  1 5481000.0000000             0.151823D-06     
  2 820600.0000000              0.118008D-05     
  3 186700.0000000              0.621699D-05     
  4  52880.0000000              0.262405D-04     
  5  17250.0000000              0.959040D-04     
  6   6226.0000000              0.312678D-03     
  7   2429.0000000              0.936322D-03     
  8   1007.0000000              0.257790D-02     
  9    439.5000000              0.654121D-02     
 10    199.8000000              0.149630D-01     
 11     93.9200000              0.298940D-01     
 12     45.3400000              0.476946D-01     
 13     22.1500000              0.449556D-01     
 14     10.3400000             -0.293009D-01     
 15      5.1190000             -0.168916D+00     
 16      2.5530000             -0.311014D+00     
S   1
  1      1.2820000              1.0000000        
S   1
  1      0.5450000              1.0000000        
S   1
  1      0.2411000              1.0000000        
S   1
  1      0.1035000              1.0000000        
S   1
  1      0.0420000              1.0000000        
P   8
  1   2200.0000000              0.239049D-03     
  2    521.4000000              0.207686D-02     
  3    169.0000000              0.112363D-01     
  4     64.0500000              0.440690D-01     
  5     26.7200000              0.129168D+00     
  6     11.8300000              0.269083D+00     
  7      5.3780000              0.378611D+00     
  8      2.4820000              0.296779D+00     
P   8
  1   2200.0000000             -0.608562D-04     
  2    521.4000000             -0.530419D-03     
  3    169.0000000             -0.287915D-02     
  4     64.0500000             -0.114397D-01     
  5     26.7200000             -0.342764D-01     
  6     11.8300000             -0.735811D-01     
  7      5.3780000             -0.107782D+00     
  8      2.4820000             -0.879769D-01     
P   1
  1      1.1160000              1.0000000        
P   1
  1      0.4848000              1.0000000        
P   1
  1      0.2006000              1.0000000        
P   1
  1      0.0795100              1.0000000        
P   1
  1      0.0294000              1.0000000        
D   1
  1      6.5100000              1.0000000        
D   1
  1      1.5900000              1.0000000        
D   1
  1      0.8860000              1.0000000        
D   1
  1      0.4380000              1.0000000        
D   1
  1      0.1770000              1.0000000        
D   1
  1      0.0664000              1.0000000        
F   1
  1      0.2550000              1.0000000        
F   1
  1      0.5290000              1.0000000        
F   1
  1      1.0960000              1.0000000        
F   1
  1      0.1188000              1.0000000        
G   1
  1      0.4630000              1.0000000        
G   1
  1      1.0710000              1.0000000        
G   1
  1      0.2200000              1.0000000        
H   1
  1      0.8720000              1.0000000        
H   1
  1      0.4720000              1.0000000


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Cl
data:
CHLORINE
S   16
  1 6410000.0000000             0.181350D-05     
  2 959600.0000000              0.141118D-04     
  3 218300.0000000              0.742406D-04     
  4  61810.0000000              0.314131D-03     
  5  20140.0000000              0.114642D-02     
  6   7264.0000000              0.373888D-02     
  7   2832.0000000              0.110946D-01     
  8   1175.0000000              0.301152D-01     
  9    512.6000000              0.739145D-01     
 10    233.0000000              0.158258D+00     
 11    109.5000000              0.274753D+00     
 12     52.8600000              0.334066D+00     
 13     25.8400000              0.217589D+00     
 14     12.1700000              0.457278D-01     
 15      6.0300000             -0.134739D-03     
 16      3.0120000              0.163933D-02     
S   16
  1 6410000.0000000            -0.508303D-06     
  2 959600.0000000             -0.395633D-05     
  3 218300.0000000             -0.208095D-04     
  4  61810.0000000             -0.881175D-04     
  5  20140.0000000             -0.321742D-03     
  6   7264.0000000             -0.105277D-02     
  7   2832.0000000             -0.314183D-02     
  8   1175.0000000             -0.866363D-02     
  9    512.6000000             -0.219353D-01     
 10    233.0000000             -0.502584D-01     
 11    109.5000000             -0.995414D-01     
 12     52.8600000             -0.157647D+00     
 13     25.8400000             -0.146024D+00     
 14     12.1700000              0.692230D-01     
 15      6.0300000              0.430412D+00     
 16      3.0120000              0.490802D+00     
S   16
  1 6410000.0000000             0.153808D-06     
  2 959600.0000000              0.119654D-05     
  3 218300.0000000              0.629828D-05     
  4  61810.0000000              0.266450D-04     
  5  20140.0000000              0.974162D-04     
  6   7264.0000000              0.318360D-03     
  7   2832.0000000              0.952377D-03     
  8   1175.0000000              0.262430D-02     
  9    512.6000000              0.668160D-02     
 10    233.0000000              0.153595D-01     
 11    109.5000000              0.309432D-01     
 12     52.8600000              0.500638D-01     
 13     25.8400000              0.489782D-01     
 14     12.1700000             -0.260807D-01     
 15      6.0300000             -0.178426D+00     
 16      3.0120000             -0.332324D+00     
S   1
  1      1.5110000              1.0000000        
S   1
  1      0.6604000              1.0000000        
S   1
  1      0.2926000              1.0000000        
S   1
  1      0.1254000              1.0000000        
S   1
  1      0.0479000              1.0000000        
P   8
  1   2548.0000000              0.235702D-03     
  2    603.7000000              0.205158D-02     
  3    195.6000000              0.111543D-01     
  4     74.1500000              0.439816D-01     
  5     30.9400000              0.129994D+00     
  6     13.6900000              0.272959D+00     
  7      6.2290000              0.383690D+00     
  8      2.8780000              0.291870D+00     
P   8
  1   2548.0000000             -0.635410D-04     
  2    603.7000000             -0.553259D-03     
  3    195.6000000             -0.302795D-02     
  4     74.1500000             -0.120650D-01     
  5     30.9400000             -0.366348D-01     
  6     13.6900000             -0.790764D-01     
  7      6.2290000             -0.117422D+00     
  8      2.8780000             -0.860943D-01     
P   1
  1      1.2820000              1.0000000        
P   1
  1      0.5641000              1.0000000        
P   1
  1      0.2348000              1.0000000        
P   1
  1      0.0931200              1.0000000        
P   1
  1      0.0348000              1.0000000        
D   1
  1      8.3990000              1.0000000        
D   1
  1      2.0300000              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.5490000              1.0000000        
D   1
  1      0.2210000              1.0000000        
D   1
  1      0.0836000              1.0000000        
F   1
  1      0.3200000              1.0000000        
F   1
  1      0.6560000              1.0000000        
F   1
  1      1.3450000              1.0000000        
F   1
  1      0.1640000              1.0000000        
G   1
  1      0.5560000              1.0000000        
G   1
  1      1.3020000              1.0000000        
G   1
  1      0.2770000              1.0000000        
H   1
  1      1.0530000              1.0000000        
H   1
  1      0.6070000              1.0000000


name: aug-cc-pV(5+d)Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Ar
data:
ARGON
S   16
  1 7401000.0000000             0.175018D-05     
  2 1108000.0000000             0.136147D-04     
  3 252100.0000000              0.716297D-04     
  4  71380.0000000              0.303035D-03     
  5  23260.0000000              0.110610D-02     
  6   8390.0000000              0.360679D-02     
  7   3271.0000000              0.107134D-01     
  8   1357.0000000              0.291074D-01     
  9    592.0000000              0.716617D-01     
 10    269.1000000              0.154144D+00     
 11    126.5000000              0.270423D+00     
 12     61.0300000              0.334862D+00     
 13     29.8600000              0.224347D+00     
 14     14.1700000              0.500081D-01     
 15      7.0220000              0.149726D-03     
 16      3.5110000              0.210369D-02     
S   16
  1 7401000.0000000            -0.520448D-06     
  2 1108000.0000000            -0.404909D-05     
  3 252100.0000000             -0.213023D-04     
  4  71380.0000000             -0.901686D-04     
  5  23260.0000000             -0.329374D-03     
  6   8390.0000000             -0.107715D-02     
  7   3271.0000000             -0.321892D-02     
  8   1357.0000000             -0.887845D-02     
  9    592.0000000             -0.225545D-01     
 10    269.1000000             -0.518453D-01     
 11    126.5000000             -0.103722D+00     
 12     61.0300000             -0.166595D+00     
 13     29.8600000             -0.160165D+00     
 14     14.1700000              0.623654D-01     
 15      7.0220000              0.465534D+00     
 16      3.5110000              0.581564D+00     
S   16
  1 7401000.0000000             0.230379D-08     
  2 1108000.0000000             0.174221D-07     
  3 252100.0000000              0.955300D-07     
  4  71380.0000000              0.383619D-06     
  5  23260.0000000              0.150535D-05     
  6   8390.0000000              0.458632D-05     
  7   3271.0000000              0.155002D-04     
  8   1357.0000000              0.406695D-04     
  9    592.0000000              0.131337D-03     
 10    269.1000000              0.332685D-03     
 11    126.5000000              0.106670D-02     
 12     61.0300000              0.257210D-02     
 13     29.8600000              0.483584D-02     
 14     14.1700000             -0.385728D-02     
 15      7.0220000             -0.476125D-01     
 16      3.5110000             -0.182957D+00     
S   1
  1      1.7580000              1.0000000        
S   1
  1      0.7841000              1.0000000        
S   1
  1      0.3480000              1.0000000        
S   1
  1      0.1491000              1.0000000        
S   1
  1      0.0538000              1.0000000        
P   8
  1   2927.0000000              0.188338D-03     
  2    693.5000000              0.164288D-02     
  3    224.7000000              0.894893D-02     
  4     85.1700000              0.355111D-01     
  5     35.5300000              0.105147D+00     
  6     15.7300000              0.221552D+00     
  7      7.1650000              0.308412D+00     
  8      3.3220000              0.232203D+00     
P   8
  1   2927.0000000             -0.150207D-03     
  2    693.5000000             -0.130928D-02     
  3    224.7000000             -0.716501D-02     
  4     85.1700000             -0.285723D-01     
  5     35.5300000             -0.860158D-01     
  6     15.7300000             -0.183996D+00     
  7      7.1650000             -0.265844D+00     
  8      3.3220000             -0.188741D+00     
P   1
  1      1.4780000              1.0000000        
P   1
  1      0.6552000              1.0000000        
P   1
  1      0.2751000              1.0000000        
P   1
  1      0.1097000              1.0000000        
P   1
  1      0.0402000              1.0000000        
D   1
  1     10.5180000              1.0000000        
D   1
  1      2.5160000              1.0000000        
D   1
  1      1.3320000              1.0000000        
D   1
  1      0.6730000              1.0000000        
D   1
  1      0.2700000              1.0000000        
D   1
  1      0.0978000              1.0000000        
F   1
  1      0.4080000              1.0000000        
F   1
  1      0.8250000              1.0000000        
F   1
  1      1.6680000              1.0000000        
F   1
  1      0.2090000              1.0000000        
G   1
  1      0.6650000              1.0000000        
G   1
  1      1.5620000              1.0000000        
G   1
  1      0.3340000              1.0000000        
H   1
  1      1.2640000              1.0000000        
H   1
  1      0.7420000              1.0000000        
$


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   5988.0000000              0.0001590        
  2    898.9000000              0.0010523        
  3    205.9000000              0.0053137        
  4     59.2400000              0.0209831        
  5     19.8700000              0.0664049        
  6      7.4060000              0.1658220        
  7      2.9300000              0.3150359        
  8      1.1890000              0.3934631        
  9      0.4798000              0.1908184        
S   9
  1   5988.0000000             -0.0000248        
  2    898.9000000             -0.0001652        
  3    205.9000000             -0.0008272        
  4     59.2400000             -0.0033354        
  5     19.8700000             -0.0105312        
  6      7.4060000             -0.0281109        
  7      2.9300000             -0.0559366        
  8      1.1890000             -0.0992549        
  9      0.4798000             -0.1121221        
S   1
  1      0.0750900              1.0000000        
S   1
  1      0.0283200              1.0000000        
S   1
  1      1.9740000              1.0000000        
S   1
  1      0.6830000              1.0000000        
S   1
  1      0.0076000              1.0000000        
P   3
  1      3.2660000              0.0086331        
  2      0.6511000              0.0475337        
  3      0.1696000              0.2097708        
P   1
  1      0.0557800              1.0000000        
P   1
  1      0.0205000              1.0000000        
P   1
  1      7.3200000              1.0000000        
P   1
  1      1.8750000              1.0000000        
P   1
  1      0.0091000              1.0000000        
D   1
  1      0.1874000              1.0000000        
D   1
  1      0.0801000              1.0000000        
D   1
  1      4.9120000              1.0000000        
D   1
  1      0.0371000              1.0000000        
F   1
  1      0.1829000              1.0000000        
F   1
  1      0.0816000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1   6863.0000000              0.0002897        
  2   1030.0000000              0.0018847        
  3    234.7000000              0.0095429        
  4     66.5600000              0.0380762        
  5     21.6900000              0.1200942        
  6      7.7340000              0.2822115        
  7      2.9160000              0.4273153        
  8      1.1300000              0.2661276        
  9      0.1101000             -0.0072870        
S   9
  1   6863.0000000             -0.0000529        
  2   1030.0000000             -0.0003433        
  3    234.7000000             -0.0017537        
  4     66.5600000             -0.0070364        
  5     21.6900000             -0.0231606        
  6      7.7340000             -0.0581609        
  7      2.9160000             -0.1145859        
  8      1.1300000             -0.1357835        
  9      0.1101000              0.5773731        
S   1
  1      0.2577000              1.0000000        
S   1
  1      0.0440900              1.0000000        
S   1
  1      4.6040000              1.0000000        
S   1
  1      1.6170000              1.0000000        
S   1
  1      0.0150300              1.0000000        
P   3
  1      7.4360000              0.0107482        
  2      1.5770000              0.0628561        
  3      0.4352000              0.2481982        
P   1
  1      0.1438000              1.0000000        
P   1
  1      0.0499400              1.0000000        
P   1
  1     14.4970000              1.0000000        
P   1
  1      3.7870000              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.3480000              1.0000000        
D   1
  1      0.1803000              1.0000000        
D   1
  1      9.1830000              1.0000000        
D   1
  1      0.0654000              1.0000000        
F   1
  1      0.3250000              1.0000000        
F   1
  1      0.1533000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: B
data:
BORON
S   8
  1   5473.0000000              0.0006618        
  2    820.9000000              0.0044078        
  3    186.8000000              0.0221381        
  4     52.8300000              0.0846659        
  5     17.0800000              0.2387201        
  6      5.9990000              0.4349692        
  7      2.2080000              0.3416948        
  8      0.2415000             -0.0095262        
S   8
  1   5473.0000000             -0.0001338        
  2    820.9000000             -0.0008927        
  3    186.8000000             -0.0045253        
  4     52.8300000             -0.0177437        
  5     17.0800000             -0.0537048        
  6      5.9990000             -0.1190598        
  7      2.2080000             -0.1656727        
  8      0.2415000              0.5959798        
S   1
  1      0.5879000              1.0000000        
S   1
  1      0.0861000              1.0000000        
S   1
  1      2.9400000              1.0000000        
S   1
  1      8.3110000              1.0000000        
S   1
  1      0.0291400              1.0000000        
P   3
  1     12.0500000              0.0131399        
  2      2.6130000              0.0799035        
  3      0.7475000              0.2772102        
P   1
  1      0.2385000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1      6.0160000              1.0000000        
P   1
  1     22.8910000              1.0000000        
P   1
  1      0.0209600              1.0000000        
D   1
  1      0.6610000              1.0000000        
D   1
  1      0.1990000              1.0000000        
D   1
  1     13.0150000              1.0000000        
D   1
  1      0.0604000              1.0000000        
F   1
  1      0.4900000              1.0000000        
F   1
  1      0.1630000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: C
data:
CARBON
S   8
  1   8236.0000000              0.0006772        
  2   1235.0000000              0.0042785        
  3    280.8000000              0.0213576        
  4     79.2700000              0.0821858        
  5     25.5900000              0.2350715        
  6      8.9970000              0.4342613        
  7      3.3190000              0.3457333        
  8      0.3643000             -0.0089547        
S   8
  1   8236.0000000             -0.0001445        
  2   1235.0000000             -0.0009156        
  3    280.8000000             -0.0046031        
  4     79.2700000             -0.0182284        
  5     25.5900000             -0.0558690        
  6      8.9970000             -0.1269889        
  7      3.3190000             -0.1701050        
  8      0.3643000              0.5986760        
S   1
  1      0.9059000              1.0000000        
S   1
  1      0.1285000              1.0000000        
S   1
  1      4.2920000              1.0000000        
S   1
  1     11.8760000              1.0000000        
S   1
  1      0.0440200              1.0000000        
P   3
  1     18.7100000              0.0140738        
  2      4.1330000              0.0869016        
  3      1.2000000              0.2902016        
P   1
  1      0.3827000              1.0000000        
P   1
  1      0.1209000              1.0000000        
P   1
  1      8.7780000              1.0000000        
P   1
  1     33.1900000              1.0000000        
P   1
  1      0.0356900              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.3180000              1.0000000        
D   1
  1     14.8390000              1.0000000        
D   1
  1      0.1000000              1.0000000        
F   1
  1      0.7610000              1.0000000        
F   1
  1      0.2680000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: N
data:
NITROGEN
S   8
  1  11420.0000000              0.0007127        
  2   1712.0000000              0.0042813        
  3    389.3000000              0.0211421        
  4    110.0000000              0.0811887        
  5     35.5700000              0.2334368        
  6     12.5400000              0.4333154        
  7      4.6440000              0.3469116        
  8      0.5118000             -0.0084838        
S   8
  1  11420.0000000             -0.0001573        
  2   1712.0000000             -0.0009485        
  3    389.3000000             -0.0047127        
  4    110.0000000             -0.0186658        
  5     35.5700000             -0.0575021        
  6     12.5400000             -0.1322177        
  7      4.6440000             -0.1721464        
  8      0.5118000              0.5999371        
S   1
  1      1.2930000              1.0000000        
S   1
  1      0.1787000              1.0000000        
S   1
  1      5.9520000              1.0000000        
S   1
  1     16.2010000              1.0000000        
S   1
  1      0.0576000              1.0000000        
P   3
  1     26.6300000              0.0147368        
  2      5.9480000              0.0918329        
  3      1.7420000              0.2986885        
P   1
  1      0.5550000              1.0000000        
P   1
  1      0.1725000              1.0000000        
P   1
  1     11.8710000              1.0000000        
P   1
  1     44.8490000              1.0000000        
P   1
  1      0.0491000              1.0000000        
D   1
  1      1.6540000              1.0000000        
D   1
  1      0.4690000              1.0000000        
D   1
  1     14.2000000              1.0000000        
D   1
  1      0.1510000              1.0000000        
F   1
  1      1.0930000              1.0000000        
F   1
  1      0.3640000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: O
data:
OXYGEN
S   8
  1  15330.0000000              0.0007428        
  2   2299.0000000              0.0042405        
  3    522.4000000              0.0207194        
  4    147.3000000              0.0797931        
  5     47.5500000              0.2311816        
  6     16.7600000              0.4328845        
  7      6.2070000              0.3495073        
  8      0.6882000             -0.0081229        
S   8
  1  15330.0000000             -0.0001688        
  2   2299.0000000             -0.0009679        
  3    522.4000000             -0.0047549        
  4    147.3000000             -0.0189126        
  5     47.5500000             -0.0586914        
  6     16.7600000             -0.1366626        
  7      6.2070000             -0.1752353        
  8      0.6882000              0.6033925        
S   1
  1      1.7520000              1.0000000        
S   1
  1      0.2384000              1.0000000        
S   1
  1      7.8450000              1.0000000        
S   1
  1     21.0320000              1.0000000        
S   1
  1      0.0737600              1.0000000        
P   3
  1     34.4600000              0.0160267        
  2      7.7490000              0.0998490        
  3      2.2800000              0.3105086        
P   1
  1      0.7156000              1.0000000        
P   1
  1      0.2140000              1.0000000        
P   1
  1     15.1590000              1.0000000        
P   1
  1     57.4370000              1.0000000        
P   1
  1      0.0597400              1.0000000        
D   1
  1      2.3140000              1.0000000        
D   1
  1      0.6450000              1.0000000        
D   1
  1     15.8580000              1.0000000        
D   1
  1      0.2140000              1.0000000        
F   1
  1      1.4280000              1.0000000        
F   1
  1      0.5000000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: F
data:
FLUORINE
S   8
  1  19500.0000000              0.0007913        
  2   2923.0000000              0.0043210        
  3    664.5000000              0.0208039        
  4    187.5000000              0.0797933        
  5     60.6200000              0.2310785        
  6     21.4200000              0.4325780        
  7      7.9500000              0.3489945        
  8      0.8815000             -0.0078525        
S   8
  1  19500.0000000             -0.0001835        
  2   2923.0000000             -0.0010071        
  3    664.5000000             -0.0048719        
  4    187.5000000             -0.0193323        
  5     60.6200000             -0.0599582        
  6     21.4200000             -0.1402744        
  7      7.9500000             -0.1761052        
  8      0.8815000              0.6049737        
S   1
  1      2.2570000              1.0000000        
S   1
  1      0.3041000              1.0000000        
S   1
  1      9.8120000              1.0000000        
S   1
  1     25.9430000              1.0000000        
S   1
  1      0.0915800              1.0000000        
P   3
  1     43.8800000              0.0168000        
  2      9.9260000              0.1046299        
  3      2.9300000              0.3172873        
P   1
  1      0.9132000              1.0000000        
P   1
  1      0.2672000              1.0000000        
P   1
  1     18.7560000              1.0000000        
P   1
  1     71.3480000              1.0000000        
P   1
  1      0.0736100              1.0000000        
D   1
  1      3.1070000              1.0000000        
D   1
  1      0.8550000              1.0000000        
D   1
  1     19.1080000              1.0000000        
D   1
  1      0.2920000              1.0000000        
F   1
  1      1.9170000              1.0000000        
F   1
  1      0.7240000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ne
data:
NEON
S   8
  1  24350.0000000              0.0008358        
  2   3650.0000000              0.0043745        
  3    829.6000000              0.0207423        
  4    234.0000000              0.0793936        
  5     75.6100000              0.2304832        
  6     26.7300000              0.4323621        
  7      9.9270000              0.3494274        
  8      1.1020000             -0.0075967        
S   8
  1  24350.0000000             -0.0001967        
  2   3650.0000000             -0.0010354        
  3    829.6000000             -0.0049308        
  4    234.0000000             -0.0195454        
  5     75.6100000             -0.0607585        
  6     26.7300000             -0.1428460        
  7      9.9270000             -0.1768425        
  8      1.1020000              0.6057343        
S   1
  1      2.8360000              1.0000000        
S   1
  1      0.3782000              1.0000000        
S   1
  1     12.0830000              1.0000000        
S   1
  1     31.9470000              1.0000000        
S   1
  1      0.1133000              1.0000000        
P   3
  1     54.7000000              0.0173278        
  2     12.4300000              0.1078707        
  3      3.6790000              0.3217252        
P   1
  1      1.1430000              1.0000000        
P   1
  1      0.3300000              1.0000000        
P   1
  1     22.8270000              1.0000000        
P   1
  1     87.0170000              1.0000000        
P   1
  1      0.0917500              1.0000000        
D   1
  1      4.0140000              1.0000000        
D   1
  1      1.0960000              1.0000000        
D   1
  1     23.1680000              1.0000000        
D   1
  1      0.3860000              1.0000000        
F   1
  1      2.5440000              1.0000000        
F   1
  1      1.0840000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Na
data:
SODIUM
S   14
  1 423000.0000000              0.0000890        
  2  63340.0000000              0.0003055        
  3  14410.0000000              0.0010495        
  4   4077.0000000              0.0035692        
  5   1328.0000000              0.0118412        
  6    478.6000000              0.0361339        
  7    186.2000000              0.0969663        
  8     76.9200000              0.2144124        
  9     33.3200000              0.3483759        
 10     15.0000000              0.3233780        
 11      6.8690000              0.1120091        
 12      2.6830000              0.0070223        
 13      1.1090000              0.0005966        
 14      0.0601500             -0.0000050        
S   14
  1 423000.0000000             -0.0000218        
  2  63340.0000000             -0.0000749        
  3  14410.0000000             -0.0002571        
  4   4077.0000000             -0.0008795        
  5   1328.0000000             -0.0029209        
  6    478.6000000             -0.0091129        
  7    186.2000000             -0.0251502        
  8     76.9200000             -0.0610296        
  9     33.3200000             -0.1167017        
 10     15.0000000             -0.1621266        
 11      6.8690000             -0.0422846        
 12      2.6830000              0.3395466        
 13      1.1090000              0.5607534        
 14      0.0601500              0.0040000        
S   14
  1 423000.0000000              0.0000033        
  2  63340.0000000              0.0000113        
  3  14410.0000000              0.0000387        
  4   4077.0000000              0.0001320        
  5   1328.0000000              0.0004406        
  6    478.6000000              0.0013683        
  7    186.2000000              0.0038100        
  8     76.9200000              0.0092122        
  9     33.3200000              0.0180161        
 10     15.0000000              0.0251437        
 11      6.8690000              0.0072823        
 12      2.6830000             -0.0616094        
 13      1.1090000             -0.1163041        
 14      0.0601500              0.6290489        
S   1
  1      0.4540000              1.0000000        
S   1
  1      0.0238200              1.0000000        
S   1
  1      4.1890000              1.0000000        
S   1
  1      0.6260000              1.0000000        
S   1
  1      0.0066500              1.0000000        
P   8
  1    243.3000000              0.0023360        
  2     57.3900000              0.0175708        
  3     18.1000000              0.0776875        
  4      6.5750000              0.2192534        
  5      2.5210000              0.3784065        
  6      0.9607000              0.3946998        
  7      0.3512000              0.1604432        
  8      0.0982700              0.0023645        
P   8
  1    243.3000000             -0.0002316        
  2     57.3900000             -0.0017602        
  3     18.1000000             -0.0077836        
  4      6.5750000             -0.0225358        
  5      2.5210000             -0.0384212        
  6      0.9607000             -0.0450032        
  7      0.3512000             -0.0191964        
  8      0.0982700              0.1827235        
P   1
  1      0.0373400              1.0000000        
P   1
  1      0.0150000              1.0000000        
P   1
  1      1.5690000              1.0000000        
P   1
  1      0.5120000              1.0000000        
P   1
  1      0.0070000              1.0000000        
D   1
  1      0.1367000              1.0000000        
D   1
  1      0.0636000              1.0000000        
D   1
  1      5.4040000              1.0000000        
D   1
  1      1.5300000              1.0000000        
D   1
  1      0.0223000              1.0000000        
F   1
  1      0.1397000              1.0000000        
F   1
  1      3.4650000              1.0000000        
F   1
  1      0.0714000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   13
  1 164900.0000000              0.0002422        
  2  24710.0000000              0.0009215        
  3   5628.0000000              0.0035555        
  4   1596.0000000              0.0131266        
  5    521.0000000              0.0438767        
  6    188.0000000              0.1242674        
  7     73.0100000              0.2754606        
  8     29.9000000              0.4008546        
  9     12.5400000              0.2632257        
 10      4.3060000              0.0330029        
 11      1.8260000             -0.0043711        
 12      0.7417000              0.0020420        
 13      0.0761200              0.0007009        
S   13
  1 164900.0000000             -0.0000614        
  2  24710.0000000             -0.0002342        
  3   5628.0000000             -0.0009030        
  4   1596.0000000             -0.0033736        
  5    521.0000000             -0.0114009        
  6    188.0000000             -0.0341221        
  7     73.0100000             -0.0831202        
  8     29.9000000             -0.1595571        
  9     12.5400000             -0.1513356        
 10      4.3060000              0.1935020        
 11      1.8260000              0.5798608        
 12      0.7417000              0.3696639        
 13      0.0761200             -0.0115917        
S   13
  1 164900.0000000              0.0000118        
  2  24710.0000000              0.0000451        
  3   5628.0000000              0.0001742        
  4   1596.0000000              0.0006501        
  5    521.0000000              0.0022034        
  6    188.0000000              0.0066013        
  7     73.0100000              0.0162441        
  8     29.9000000              0.0316427        
  9     12.5400000              0.0312732        
 10      4.3060000             -0.0444516        
 11      1.8260000             -0.1516479        
 12      0.7417000             -0.2163940        
 13      0.0761200              0.5453010        
S   1
  1      0.1457000              1.0000000        
S   1
  1      0.0331000              1.0000000        
S   1
  1     17.5160000              1.0000000        
S   1
  1      3.8700000              1.0000000        
S   1
  1      0.0129000              1.0000000        
P   8
  1    316.9000000              0.0021856        
  2     74.8600000              0.0164985        
  3     23.7200000              0.0742262        
  4      8.6690000              0.2145337        
  5      3.3630000              0.3820475        
  6      1.3100000              0.3978887        
  7      0.4911000              0.1528155        
  8      0.2364000             -0.0043175        
P   8
  1    316.9000000             -0.0003462        
  2     74.8600000             -0.0026128        
  3     23.7200000             -0.0119341        
  4      8.6690000             -0.0349344        
  5      3.3630000             -0.0637955        
  6      1.3100000             -0.0700523        
  7      0.4911000             -0.0382229        
  8      0.2364000              0.1775221        
P   1
  1      0.0873300              1.0000000        
P   1
  1      0.0323700              1.0000000        
P   1
  1     20.2970000              1.0000000        
P   1
  1      5.1050000              1.0000000        
P   1
  1      0.0074500              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.2940000              1.0000000        
D   1
  1      7.0290000              1.0000000        
D   1
  1      2.1210000              1.0000000        
D   1
  1      0.0468000              1.0000000        
F   1
  1      0.2520000              1.0000000        
F   1
  1      4.5300000              1.0000000        
F   1
  1      0.0940000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   13
  1 205500.0000000              0.0002486        
  2  30780.0000000              0.0009183        
  3   7006.0000000              0.0034388        
  4   1985.0000000              0.0124309        
  5    649.1000000              0.0411372        
  6    235.0000000              0.1165198        
  7     91.6200000              0.2617217        
  8     37.6700000              0.3953985        
  9     15.9100000              0.2827977        
 10      5.8500000              0.0440595        
 11      2.5420000             -0.0048440        
 12      1.0570000              0.0025850        
 13      0.1455000              0.0007132        
S   13
  1 205500.0000000             -0.0000649        
  2  30780.0000000             -0.0002401        
  3   7006.0000000             -0.0009000        
  4   1985.0000000             -0.0032826        
  5    649.1000000             -0.0110170        
  6    235.0000000             -0.0327430        
  7     91.6200000             -0.0809702        
  8     37.6700000             -0.1571116        
  9     15.9100000             -0.1667395        
 10      5.8500000              0.1299949        
 11      2.5420000              0.5619410        
 12      1.0570000              0.4337633        
 13      0.1455000             -0.0111008        
S   13
  1 205500.0000000              0.0000150        
  2  30780.0000000              0.0000554        
  3   7006.0000000              0.0002080        
  4   1985.0000000              0.0007579        
  5    649.1000000              0.0025517        
  6    235.0000000              0.0075909        
  7     91.6200000              0.0189792        
  8     37.6700000              0.0373779        
  9     15.9100000              0.0415027        
 10      5.8500000             -0.0362454        
 11      2.5420000             -0.1759455        
 12      1.0570000             -0.2747958        
 13      0.1455000              0.6521109        
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
S   1
  1      7.4880000              1.0000000        
S   1
  1      1.2720000              1.0000000        
S   1
  1      0.0221000              1.0000000        
P   7
  1    444.4000000              0.0017470        
  2    105.1000000              0.0133061        
  3     33.4700000              0.0616623        
  4     12.3300000              0.1882350        
  5      4.8690000              0.3604280        
  6      1.9610000              0.4080722        
  7      0.1888000              0.0097994        
P   7
  1    444.4000000             -0.0003076        
  2    105.1000000             -0.0024646        
  3     33.4700000             -0.0109375        
  4     12.3300000             -0.0364711        
  5      4.8690000             -0.0640394        
  6      1.9610000             -0.0970652        
  7      0.1888000              0.5027104        
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
P   1
  1      2.2020000              1.0000000        
P   1
  1      5.5480000              1.0000000        
P   1
  1      0.0146000              1.0000000        
D   1
  1      0.1090000              1.0000000        
D   1
  1      0.3330000              1.0000000        
D   1
  1      2.6340000              1.0000000        
D   1
  1      8.6460000              1.0000000        
D   1
  1      0.0356000              1.0000000        
F   1
  1      0.2440000              1.0000000        
F   1
  1      5.6860000              1.0000000        
F   1
  1      0.0858000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Si
data:
SILICON
S   13
  1 254900.0000000              0.0002529        
  2  38190.0000000              0.0009090        
  3   8690.0000000              0.0033025        
  4   2462.0000000              0.0116759        
  5    804.8000000              0.0383795        
  6    291.3000000              0.1092047        
  7    113.6000000              0.2490127        
  8     46.7500000              0.3899473        
  9     19.8200000              0.2998830        
 10      7.7080000              0.0553498        
 11      3.3400000             -0.0039710        
 12      1.4020000              0.0025494        
 13      0.2070000              0.0006001        
S   13
  1 254900.0000000             -0.0000676        
  2  38190.0000000             -0.0002434        
  3   8690.0000000             -0.0008863        
  4   2462.0000000             -0.0031552        
  5    804.8000000             -0.0105363        
  6    291.3000000             -0.0312848        
  7    113.6000000             -0.0785245        
  8     46.7500000             -0.1546506        
  9     19.8200000             -0.1786818        
 10      7.7080000              0.0834192        
 11      3.3400000              0.5485415        
 12      1.4020000              0.4767448        
 13      0.2070000             -0.0103212        
S   13
  1 254900.0000000              0.0000173        
  2  38190.0000000              0.0000624        
  3   8690.0000000              0.0002272        
  4   2462.0000000              0.0008085        
  5    804.8000000              0.0027076        
  6    291.3000000              0.0080506        
  7    113.6000000              0.0204261        
  8     46.7500000              0.0408728        
  9     19.8200000              0.0494300        
 10      7.7080000             -0.0259952        
 11      3.3400000             -0.1915191        
 12      1.4020000             -0.3167253        
 13      0.2070000              0.6807332        
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
S   1
  1      9.1640000              1.0000000        
S   1
  1      1.6210000              1.0000000        
S   1
  1      0.0330000              1.0000000        
P   7
  1    481.5000000              0.0020745        
  2    113.9000000              0.0156644        
  3     36.2300000              0.0719518        
  4     13.3400000              0.2134897        
  5      5.2520000              0.3902729        
  6      2.1200000              0.3932155        
  7      0.2528000              0.0039858        
P   7
  1    481.5000000             -0.0004381        
  2    113.9000000             -0.0034247        
  3     36.2300000             -0.0154023        
  4     13.3400000             -0.0489931        
  5      5.2520000             -0.0854192        
  6      2.1200000             -0.1119097        
  7      0.2528000              0.5513707        
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
P   1
  1      6.4580000              1.0000000        
P   1
  1      2.5170000              1.0000000        
P   1
  1      0.0237000              1.0000000        
D   1
  1      0.1590000              1.0000000        
D   1
  1      0.4810000              1.0000000        
D   1
  1     10.6710000              1.0000000        
D   1
  1      3.3080000              1.0000000        
D   1
  1      0.0556000              1.0000000        
F   1
  1      0.3360000              1.0000000        
F   1
  1      7.0010000              1.0000000        
F   1
  1      0.1250000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   13
  1 312400.0000000              0.0002571        
  2  46800.0000000              0.0009020        
  3  10650.0000000              0.0031853        
  4   3018.0000000              0.0110055        
  5    986.8000000              0.0358359        
  6    357.4000000              0.1021861        
  7    139.6000000              0.2357207        
  8     57.6300000              0.3815204        
  9     24.6000000              0.3156027        
 10     10.1200000              0.0699621        
 11      4.2830000             -0.0017854        
 12      1.8050000              0.0021312        
 13      0.2782000              0.0004255        
S   13
  1 312400.0000000             -0.0000702        
  2  46800.0000000             -0.0002465        
  3  10650.0000000             -0.0008732        
  4   3018.0000000             -0.0030327        
  5    986.8000000             -0.0100473        
  6    357.4000000             -0.0297436        
  7    139.6000000             -0.0754666        
  8     57.6300000             -0.1504688        
  9     24.6000000             -0.1878391        
 10     10.1200000              0.0403987        
 11      4.2830000              0.5308169        
 12      1.8050000              0.5151652        
 13      0.2782000             -0.0089109        
S   13
  1 312400.0000000             -0.0000193        
  2  46800.0000000             -0.0000677        
  3  10650.0000000             -0.0002401        
  4   3018.0000000             -0.0008334        
  5    986.8000000             -0.0027699        
  6    357.4000000             -0.0082076        
  7    139.6000000             -0.0210652        
  8     57.6300000             -0.0426310        
  9     24.6000000             -0.0558250        
 10     10.1200000              0.0140284        
 11      4.2830000              0.1981170        
 12      1.8050000              0.3517465        
 13      0.2782000             -0.7008474        
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
S   1
  1     10.9780000              1.0000000        
S   1
  1      2.0060000              1.0000000        
S   1
  1      0.0409000              1.0000000        
P   7
  1    504.9000000              0.0025366        
  2    119.4000000              0.0189426        
  3     37.9600000              0.0856706        
  4     13.9500000              0.2451121        
  5      5.4570000              0.4225698        
  6      2.1770000              0.3677769        
  7      0.2877000             -0.0037587        
P   7
  1    504.9000000             -0.0006028        
  2    119.4000000             -0.0045552        
  3     37.9600000             -0.0208047        
  4     13.9500000             -0.0618635        
  5      5.4570000             -0.1088145        
  6      2.1770000             -0.1052149        
  7      0.2877000              0.5764654        
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
P   1
  1      7.0840000              1.0000000        
P   1
  1      2.7010000              1.0000000        
P   1
  1      0.0307000              1.0000000        
D   1
  1      0.2160000              1.0000000        
D   1
  1      0.6520000              1.0000000        
D   1
  1     12.8910000              1.0000000        
D   1
  1      4.0560000              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      0.4520000              1.0000000        
F   1
  1      8.4620000              1.0000000        
F   1
  1      0.1650000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: S
data:
SULFUR
S   13
  1 374100.0000000              0.0002638        
  2  56050.0000000              0.0009062        
  3  12760.0000000              0.0031247        
  4   3615.0000000              0.0105603        
  5   1183.0000000              0.0340035        
  6    428.8000000              0.0969219        
  7    167.8000000              0.2252582        
  8     69.4700000              0.3735512        
  9     29.8400000              0.3262878        
 10     12.7200000              0.0836129        
 11      5.2440000              0.0004429        
 12      2.2190000              0.0016215        
 13      0.3490000              0.0002957        
S   13
  1 374100.0000000             -0.0000733        
  2  56050.0000000             -0.0002521        
  3  12760.0000000             -0.0008725        
  4   3615.0000000             -0.0029604        
  5   1183.0000000             -0.0097096        
  6    428.8000000             -0.0286229        
  7    167.8000000             -0.0731204        
  8     69.4700000             -0.1470961        
  9     29.8400000             -0.1935729        
 10     12.7200000              0.0128266        
 11      5.2440000              0.5194749        
 12      2.2190000              0.5375512        
 13      0.3490000             -0.0088273        
S   13
  1 374100.0000000              0.0000213        
  2  56050.0000000              0.0000732        
  3  12760.0000000              0.0002535        
  4   3615.0000000              0.0008599        
  5   1183.0000000              0.0028283        
  6    428.8000000              0.0083497        
  7    167.8000000              0.0215638        
  8     69.4700000              0.0440714        
  9     29.8400000              0.0607406        
 10     12.7200000             -0.0051710        
 11      5.2440000             -0.2066834        
 12      2.2190000             -0.3796525        
 13      0.3490000              0.7139336        
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
S   1
  1     12.9280000              1.0000000        
S   1
  1      2.4130000              1.0000000        
S   1
  1      0.0497000              1.0000000        
P   7
  1    574.4000000              0.0026583        
  2    135.8000000              0.0197601        
  3     43.1900000              0.0893840        
  4     15.8700000              0.2552538        
  5      6.2080000              0.4337250        
  6      2.4830000              0.3541224        
  7      0.3229000             -0.0050047        
P   7
  1    574.4000000             -0.0006804        
  2    135.8000000             -0.0050630        
  3     43.1900000             -0.0234889        
  4     15.8700000             -0.0686526        
  5      6.2080000             -0.1237698        
  6      2.4830000             -0.0963932        
  7      0.3229000              0.5688332        
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
P   1
  1      8.1140000              1.0000000        
P   1
  1      3.1060000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
D   1
  1     15.2540000              1.0000000        
D   1
  1      4.8450000              1.0000000        
D   1
  1      0.1010000              1.0000000        
F   1
  1      0.5570000              1.0000000        
F   1
  1     10.0520000              1.0000000        
F   1
  1      0.2180000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   13
  1 456100.0000000              0.0002645        
  2  68330.0000000              0.0008905        
  3  15550.0000000              0.0029934        
  4   4405.0000000              0.0098871        
  5   1439.0000000              0.0315606        
  6    520.4000000              0.0903711        
  7    203.1000000              0.2134406        
  8     83.9600000              0.3646772        
  9     36.2000000              0.3377387        
 10     15.8300000              0.1006810        
 11      6.3340000              0.0030732        
 12      2.6940000              0.0010373        
 13      0.4313000              0.0001520        
S   13
  1 456100.0000000             -0.0000747        
  2  68330.0000000             -0.0002515        
  3  15550.0000000             -0.0008492        
  4   4405.0000000             -0.0028128        
  5   1439.0000000             -0.0091519        
  6    520.4000000             -0.0269903        
  7    203.1000000             -0.0699330        
  8     83.9600000             -0.1426906        
  9     36.2000000             -0.1978853        
 10     15.8300000             -0.0143283        
 11      6.3340000              0.5036507        
 12      2.6940000              0.5584234        
 13      0.4313000             -0.0080500        
S   13
  1 456100.0000000              0.0000226        
  2  68330.0000000              0.0000761        
  3  15550.0000000              0.0002572        
  4   4405.0000000              0.0008515        
  5   1439.0000000              0.0027786        
  6    520.4000000              0.0082052        
  7    203.1000000              0.0214933        
  8     83.9600000              0.0445276        
  9     36.2000000              0.0646680        
 10     15.8300000              0.0041911        
 11      6.3340000             -0.2092752        
 12      2.6940000             -0.4033247        
 13      0.4313000              0.7256082        
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
S   1
  1     15.0640000              1.0000000        
S   1
  1      2.8740000              1.0000000        
S   1
  1      0.0591000              1.0000000        
P   7
  1    663.3000000              0.0026741        
  2    156.8000000              0.0197715        
  3     49.9800000              0.0894991        
  4     18.4200000              0.2567502        
  5      7.2400000              0.4366374        
  6      2.9220000              0.3493206        
  7      0.3818000             -0.0045545        
P   7
  1    663.3000000             -0.0007253        
  2    156.8000000             -0.0053474        
  3     49.9800000             -0.0249761        
  4     18.4200000             -0.0730005        
  5      7.2400000             -0.1338923        
  6      2.9220000             -0.0940334        
  7      0.3818000              0.5640464        
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
P   1
  1      9.4800000              1.0000000        
P   1
  1      3.6680000              1.0000000        
P   1
  1      0.0419000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1     17.9570000              1.0000000        
D   1
  1      5.7600000              1.0000000        
D   1
  1      0.1350000              1.0000000        
F   1
  1      0.7060000              1.0000000        
F   1
  1     11.7790000              1.0000000        
F   1
  1      0.3120000              1.0000000


name: aug-cc-pCVTZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ar
data:
ARGON
S   13
  1 545000.0000000              0.0002676        
  2  81640.0000000              0.0008851        
  3  18580.0000000              0.0029115        
  4   5261.0000000              0.0094107        
  5   1717.0000000              0.0297252        
  6    619.9000000              0.0852189        
  7    241.6000000              0.2035465        
  8     99.7900000              0.3562637        
  9     43.1500000              0.3461000        
 10     19.1400000              0.1164162        
 11      7.4880000              0.0055038        
 12      3.2050000              0.0004726        
 13      0.5204000              0.0000270        
S   13
  1 545000.0000000             -0.0000766        
  2  81640.0000000             -0.0002534        
  3  18580.0000000             -0.0008375        
  4   5261.0000000             -0.0027127        
  5   1717.0000000             -0.0087370        
  6    619.9000000             -0.0257215        
  7    241.6000000             -0.0672613        
  8     99.7900000             -0.1389310        
  9     43.1500000             -0.2003327        
 10     19.1400000             -0.0353876        
 11      7.4880000              0.4896428        
 12      3.2050000              0.5732040        
 13      0.5204000             -0.0070177        
S   13
  1 545000.0000000              0.0000239        
  2  81640.0000000              0.0000792        
  3  18580.0000000              0.0002620        
  4   5261.0000000              0.0008483        
  5   1717.0000000              0.0027402        
  6    619.9000000              0.0080774        
  7    241.6000000              0.0213514        
  8     99.7900000              0.0447653        
  9     43.1500000              0.0675613        
 10     19.1400000              0.0119876        
 11      7.4880000             -0.2109174        
 12      3.2050000             -0.4221521        
 13      0.5204000              0.7337362        
S   1
  1      1.1960000              1.0000000        
S   1
  1      0.1954000              1.0000000        
S   1
  1     17.3620000              1.0000000        
S   1
  1      3.3780000              1.0000000        
S   1
  1      0.0685000              1.0000000        
P   7
  1    761.8000000              0.0026746        
  2    180.2000000              0.0196563        
  3     57.5000000              0.0892268        
  4     21.2400000              0.2572532        
  5      8.3880000              0.4383940        
  6      3.4160000              0.3463553        
  7      0.4523000             -0.0052053        
P   7
  1    761.8000000             -0.0007530        
  2    180.2000000             -0.0055091        
  3     57.5000000             -0.0258919        
  4     21.2400000             -0.0759587        
  5      8.3880000             -0.1409826        
  6      3.4160000             -0.0923338        
  7      0.4523000              0.5617501        
P   1
  1      1.2060000              1.0000000        
P   1
  1      0.1545000              1.0000000        
P   1
  1     11.0190000              1.0000000        
P   1
  1      4.3070000              1.0000000        
P   1
  1      0.0487000              1.0000000        
D   1
  1      0.4100000              1.0000000        
D   1
  1      1.2540000              1.0000000        
D   1
  1     20.7060000              1.0000000        
D   1
  1      6.6810000              1.0000000        
D   1
  1      0.1690000              1.0000000        
F   1
  1      0.8900000              1.0000000        
F   1
  1     13.6740000              1.0000000        
F   1
  1      0.4060000              1.0000000        
$


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: Al
data:
ALUMINUM
S   1
  1      0.0173700              1.0000000        
P   1
  1      0.0102100              1.0000000        
D   1
  1      0.0237000              1.0000000        
F   1
  1      0.0462500              1.0000000        
G   1
  1      0.0854500              1.0000000        
H   1
  1      0.1655000              1.0000000        
I   1
  1      0.2990000              1.0000000


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: Si
data:
SILICON
S   1
  1      0.0253900              1.0000000        
P   1
  1      0.0169400              1.0000000        
D   1
  1      0.0370000              1.0000000        
F   1
  1      0.0688400              1.0000000        
G   1
  1      0.1164000              1.0000000        
H   1
  1      0.2351000              1.0000000        
I   1
  1      0.4271000              1.0000000


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: P
data:
PHOSPHORUS
S   1
  1      0.0322800              1.0000000        
P   1
  1      0.0219700              1.0000000        
D   1
  1      0.0507000              1.0000000        
F   1
  1      0.0871000              1.0000000        
G   1
  1      0.1470000              1.0000000        
H   1
  1      0.2874000              1.0000000        
I   1
  1      0.5151000              1.0000000


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: S
data:
SULFUR
S   1
  1      0.0389300              1.0000000        
P   1
  1      0.0264800              1.0000000        
D   1
  1      0.0609000              1.0000000        
F   1
  1      0.1100000              1.0000000        
G   1
  1      0.1799000              1.0000000        
H   1
  1      0.3465000              1.0000000        
I   1
  1      0.6222000              1.0000000


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: Cl
data:
CHLORINE
S   1
  1      0.0462500              1.0000000        
P   1
  1      0.0316300              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      0.1465000              1.0000000        
G   1
  1      0.2177000              1.0000000        
H   1
  1      0.4365000              1.0000000        
I   1
  1      0.8074000              1.0000000


name: aug-cc-pV(6+d)Z Diffuse
description: 1D Diffuse Functions
elt: Ar
data:
ARGON
S   1
  1      0.0535700              1.0000000        
P   1
  1      0.0367800              1.0000000        
D   1
  1      0.0898000              1.0000000        
F   1
  1      0.1830000              1.0000000        
G   1
  1      0.2555000              1.0000000        
H   1
  1      0.5265000              1.0000000        
I   1
  1      0.9926000              1.0000000        
$


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: Al
data:
ALUMINUM
S   1
  1      0.0231000              1.0000000        
P   1
  1      0.0153000              1.0000000        
D   1
  1      0.0552000              1.0000000


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: Si
data:
SILICON
S   1
  1      0.0332000              1.0000000        
P   1
  1      0.0250000              1.0000000        
D   1
  1      0.0840000              1.0000000


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: P
data:
PHOSPHORUS
S   1
  1      0.0417000              1.0000000        
P   1
  1      0.0343000              1.0000000        
D   1
  1      0.1160000              1.0000000


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: S
data:
SULFUR
S   1
  1      0.0507000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   1
  1      0.1550000              1.0000000


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: Cl
data:
CHLORINE
S   1
  1      0.0608000              1.0000000        
P   1
  1      0.0466000              1.0000000        
D   1
  1      0.1980000              1.0000000


name: aug-cc-pV(D+d)Z Diffuse
description: 1D Diffuse Functions
elt: Ar
data:
ARGON
S   1
  1      0.0709000              1.0000000        
P   1
  1      0.0533000              1.0000000        
D   1
  1      0.2380000              1.0000000        
$


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: Al
data:
ALUMINUM
S   16
  1 3652000.0000000             0.0000019        
  2 546800.0000000              0.0000145        
  3 124500.0000000              0.0000762        
  4  35440.0000000              0.0003158        
  5  11840.0000000              0.0010974        
  6   4434.0000000              0.0033697        
  7   1812.0000000              0.0093222        
  8    791.5000000              0.0237992        
  9    361.0000000              0.0568191        
 10    169.5000000              0.1224680        
 11     81.6800000              0.2238970        
 12     40.2800000              0.3134460        
 13     20.2500000              0.2749750        
 14     10.2300000              0.1105640        
 15      4.8020000              0.0119215        
 16      2.3390000              0.0006528        
S   16
  1 3652000.0000000            -0.0000005        
  2 546800.0000000             -0.0000038        
  3 124500.0000000             -0.0000198        
  4  35440.0000000             -0.0000821        
  5  11840.0000000             -0.0002858        
  6   4434.0000000             -0.0008785        
  7   1812.0000000             -0.0024482        
  8    791.5000000             -0.0063100        
  9    361.0000000             -0.0154854        
 10    169.5000000             -0.0349589        
 11     81.6800000             -0.0707729        
 12     40.2800000             -0.1194230        
 13     20.2500000             -0.1488420        
 14     10.2300000             -0.0590465        
 15      4.8020000              0.2166930        
 16      2.3390000              0.4765570        
S   16
  1 3652000.0000000             0.0000001        
  2 546800.0000000              0.0000009        
  3 124500.0000000              0.0000046        
  4  35440.0000000              0.0000190        
  5  11840.0000000              0.0000659        
  6   4434.0000000              0.0002031        
  7   1812.0000000              0.0005647        
  8    791.5000000              0.0014620        
  9    361.0000000              0.0035794        
 10    169.5000000              0.0081516        
 11     81.6800000              0.0165276        
 12     40.2800000              0.0285467        
 13     20.2500000              0.0361484        
 14     10.2300000              0.0153804        
 15      4.8020000             -0.0612141        
 16      2.3390000             -0.1512630        
S   1
  1      1.1630000              1.0000000        
S   1
  1      0.5882000              1.0000000        
S   1
  1      0.2311000              1.0000000        
S   1
  1      0.1027000              1.0000000        
S   1
  1      0.0452100              1.0000000        
S   1
  1      0.0173700              1.0000000        
P   9
  1   2884.0000000              0.0000638        
  2    683.2000000              0.0005631        
  3    222.0000000              0.0031691        
  4     84.8200000              0.0132401        
  5     35.8100000              0.0433403        
  6     16.2200000              0.1119500        
  7      7.7020000              0.2177960        
  8      3.7410000              0.3116750        
  9      1.8310000              0.3167220        
P   9
  1   2884.0000000             -0.0000080        
  2    683.2000000             -0.0000651        
  3    222.0000000             -0.0003999        
  4     84.8200000             -0.0015369        
  5     35.8100000             -0.0055644        
  6     16.2200000             -0.0131106        
  7      7.7020000             -0.0297200        
  8      3.7410000             -0.0347195        
  9      1.8310000             -0.0551621        
P   1
  1      0.8878000              1.0000000        
P   1
  1      0.3989000              1.0000000        
P   1
  1      0.1718000              1.0000000        
P   1
  1      0.0729800              1.0000000        
P   1
  1      0.0306900              1.0000000        
P   1
  1      0.0102100              1.0000000        
D   1
  1      4.2400000              1.0000000        
D   1
  1      0.8500000              1.0000000        
D   1
  1      0.7490000              1.0000000        
D   1
  1      0.3500000              1.0000000        
D   1
  1      0.1560000              1.0000000        
D   1
  1      0.0661000              1.0000000        
D   1
  1      0.0237000              1.0000000        
F   1
  1      0.8756000              1.0000000        
F   1
  1      0.4472000              1.0000000        
F   1
  1      0.2284000              1.0000000        
F   1
  1      0.1167000              1.0000000        
F   1
  1      0.0462500              1.0000000        
G   1
  1      0.6952000              1.0000000        
G   1
  1      0.3771000              1.0000000        
G   1
  1      0.2046000              1.0000000        
G   1
  1      0.0854500              1.0000000        
H   1
  1      0.6560000              1.0000000        
H   1
  1      0.3300000              1.0000000        
H   1
  1      0.1655000              1.0000000        
I   1
  1      0.5302000              1.0000000        
I   1
  1      0.2990000              1.0000000


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: Si
data:
SILICON
S   16
  1 4465000.0000000             0.0000017        
  2 668500.0000000              0.0000136        
  3 152200.0000000              0.0000714        
  4  43300.0000000              0.0002973        
  5  14410.0000000              0.0010383        
  6   5394.0000000              0.0031747        
  7   2212.0000000              0.0087324        
  8    968.1000000              0.0223830        
  9    441.2000000              0.0537273        
 10    207.1000000              0.1166490        
 11     99.8000000              0.2159780        
 12     49.2400000              0.3095660        
 13     24.7400000              0.2839450        
 14     12.4700000              0.1222320        
 15      5.7950000              0.0141952        
 16      2.8300000              0.0003121        
S   16
  1 4465000.0000000            -0.0000005        
  2 668500.0000000             -0.0000036        
  3 152200.0000000             -0.0000190        
  4  43300.0000000             -0.0000791        
  5  14410.0000000             -0.0002769        
  6   5394.0000000             -0.0008472        
  7   2212.0000000             -0.0023478        
  8    968.1000000             -0.0060705        
  9    441.2000000             -0.0149711        
 10    207.1000000             -0.0339729        
 11     99.8000000             -0.0694584        
 12     49.2400000             -0.1190010        
 13     24.7400000             -0.1536450        
 14     12.4700000             -0.0704684        
 15      5.7950000              0.2131490        
 16      2.8300000              0.4915960        
S   16
  1 4465000.0000000             0.0000001        
  2 668500.0000000              0.0000009        
  3 152200.0000000              0.0000049        
  4  43300.0000000              0.0000203        
  5  14410.0000000              0.0000709        
  6   5394.0000000              0.0002172        
  7   2212.0000000              0.0006013        
  8    968.1000000              0.0015591        
  9    441.2000000              0.0038443        
 10    207.1000000              0.0087797        
 11     99.8000000              0.0180388        
 12     49.2400000              0.0315224        
 13     24.7400000              0.0416905        
 14     12.4700000              0.0200973        
 15      5.7950000             -0.0667484        
 16      2.8300000             -0.1819060        
S   1
  1      1.4070000              1.0000000        
S   1
  1      0.6995000              1.0000000        
S   1
  1      0.3083000              1.0000000        
S   1
  1      0.1385000              1.0000000        
S   1
  1      0.0614500              1.0000000        
S   1
  1      0.0253900              1.0000000        
P   9
  1   3572.0000000              0.0000599        
  2    846.0000000              0.0005296        
  3    274.8000000              0.0029958        
  4    105.0000000              0.0126335        
  5     44.3500000              0.0419044        
  6     20.0800000              0.1102590        
  7      9.5300000              0.2188310        
  8      4.6340000              0.3178280        
  9      2.2800000              0.3194250        
P   9
  1   3572.0000000             -0.0000128        
  2    846.0000000             -0.0001126        
  3    274.8000000             -0.0006402        
  4    105.0000000             -0.0027029        
  5     44.3500000             -0.0090789        
  6     20.0800000             -0.0242348        
  7      9.5300000             -0.0493460        
  8      4.6340000             -0.0725859        
  9      2.2800000             -0.0804258        
P   1
  1      1.1160000              1.0000000        
P   1
  1      0.4991000              1.0000000        
P   1
  1      0.2254000              1.0000000        
P   1
  1      0.1001000              1.0000000        
P   1
  1      0.0433200              1.0000000        
P   1
  1      0.0169400              1.0000000        
D   1
  1      6.8250000              1.0000000        
D   1
  1      1.7630000              1.0000000        
D   1
  1      0.8350000              1.0000000        
D   1
  1      0.5070000              1.0000000        
D   1
  1      0.2320000              1.0000000        
D   1
  1      0.0977000              1.0000000        
D   1
  1      0.0370000              1.0000000        
F   1
  1      1.3510000              1.0000000        
F   1
  1      0.6600000              1.0000000        
F   1
  1      0.3225000              1.0000000        
F   1
  1      0.1575000              1.0000000        
F   1
  1      0.0688400              1.0000000        
G   1
  1      0.8528000              1.0000000        
G   1
  1      0.4631000              1.0000000        
G   1
  1      0.2515000              1.0000000        
G   1
  1      0.1164000              1.0000000        
H   1
  1      0.8557000              1.0000000        
H   1
  1      0.4231000              1.0000000        
H   1
  1      0.2351000              1.0000000        
I   1
  1      0.6946000              1.0000000        
I   1
  1      0.4271000              1.0000000


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: P
data:
PHOSPHORUS
S   16
  1 5384000.0000000             0.0000016        
  2 806200.0000000              0.0000128        
  3 183600.0000000              0.0000672        
  4  52250.0000000              0.0002797        
  5  17390.0000000              0.0009767        
  6   6523.0000000              0.0029684        
  7   2687.0000000              0.0081240        
  8   1178.0000000              0.0209200        
  9    536.2000000              0.0505590        
 10    251.5000000              0.1104790        
 11    121.3000000              0.2069570        
 12     59.8800000              0.3047370        
 13     30.0500000              0.2929520        
 14     15.1200000              0.1355610        
 15      7.0100000              0.0173208        
 16      3.4410000             -0.0000352        
S   16
  1 5384000.0000000            -0.0000004        
  2 806200.0000000             -0.0000035        
  3 183600.0000000             -0.0000183        
  4  52250.0000000             -0.0000759        
  5  17390.0000000             -0.0002657        
  6   6523.0000000             -0.0008080        
  7   2687.0000000             -0.0022273        
  8   1178.0000000             -0.0057833        
  9    536.2000000             -0.0143438        
 10    251.5000000             -0.0327061        
 11    121.3000000             -0.0673716        
 12     59.8800000             -0.1176470        
 13     30.0500000             -0.1572800        
 14     15.1200000             -0.0838544        
 15      7.0100000              0.1997180        
 16      3.4410000              0.4986050        
S   16
  1 5384000.0000000             0.0000001        
  2 806200.0000000              0.0000010        
  3 183600.0000000              0.0000050        
  4  52250.0000000              0.0000209        
  5  17390.0000000              0.0000730        
  6   6523.0000000              0.0002221        
  7   2687.0000000              0.0006122        
  8   1178.0000000              0.0015918        
  9    536.2000000              0.0039534        
 10    251.5000000              0.0090572        
 11    121.3000000              0.0187909        
 12     59.8800000              0.0333831        
 13     30.0500000              0.0459484        
 14     15.1200000              0.0255240        
 15      7.0100000             -0.0669496        
 16      3.4410000             -0.2036450        
S   1
  1      1.7120000              1.0000000        
S   1
  1      0.8337000              1.0000000        
S   1
  1      0.3912000              1.0000000        
S   1
  1      0.1777000              1.0000000        
S   1
  1      0.0793900              1.0000000        
S   1
  1      0.0322800              1.0000000        
P   9
  1   4552.0000000              0.0000520        
  2   1078.0000000              0.0004604        
  3    350.1000000              0.0026208        
  4    133.8000000              0.0111873        
  5     56.5200000              0.0378229        
  6     25.5800000              0.1021160        
  7     12.1400000              0.2103140        
  8      5.9020000              0.3173830        
  9      2.9100000              0.3271650        
P   9
  1   4552.0000000             -0.0000124        
  2   1078.0000000             -0.0001094        
  3    350.1000000             -0.0006256        
  4    133.8000000             -0.0026734        
  5     56.5200000             -0.0091552        
  6     25.5800000             -0.0250993        
  7     12.1400000             -0.0531810        
  8      5.9020000             -0.0815888        
  9      2.9100000             -0.0919725        
P   1
  1      1.4350000              1.0000000        
P   1
  1      0.6570000              1.0000000        
P   1
  1      0.3005000              1.0000000        
P   1
  1      0.1340000              1.0000000        
P   1
  1      0.0578300              1.0000000        
P   1
  1      0.0219700              1.0000000        
D   1
  1      9.4730000              1.0000000        
D   1
  1      2.4820000              1.0000000        
D   1
  1      1.0880000              1.0000000        
D   1
  1      0.6920000              1.0000000        
D   1
  1      0.3190000              1.0000000        
D   1
  1      0.1340000              1.0000000        
D   1
  1      0.0507000              1.0000000        
F   1
  1      1.8160000              1.0000000        
F   1
  1      0.8806000              1.0000000        
F   1
  1      0.4270000              1.0000000        
F   1
  1      0.2070000              1.0000000        
F   1
  1      0.0871000              1.0000000        
G   1
  1      1.0616000              1.0000000        
G   1
  1      0.5791000              1.0000000        
G   1
  1      0.3159000              1.0000000        
G   1
  1      0.1470000              1.0000000        
H   1
  1      1.0850000              1.0000000        
H   1
  1      0.5277000              1.0000000        
H   1
  1      0.2874000              1.0000000        
I   1
  1      0.8890000              1.0000000        
I   1
  1      0.5151000              1.0000000


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: S
data:
SULFUR
S   16
  1 6297000.0000000             0.0000016        
  2 943100.0000000              0.0000124        
  3 214900.0000000              0.0000649        
  4  61250.0000000              0.0002693        
  5  20450.0000000              0.0009347        
  6   7719.0000000              0.0028083        
  7   3198.0000000              0.0076740        
  8   1402.0000000              0.0198898        
  9    637.2000000              0.0482589        
 10    298.9000000              0.1057570        
 11    144.3000000              0.2002230        
 12     71.2100000              0.3007280        
 13     35.7300000              0.2986880        
 14     17.9700000              0.1463470        
 15      8.3410000              0.0201159        
 16      4.1120000             -0.0002488        
S   16
  1 6297000.0000000            -0.0000004        
  2 943100.0000000             -0.0000034        
  3 214900.0000000             -0.0000179        
  4  61250.0000000             -0.0000744        
  5  20450.0000000             -0.0002587        
  6   7719.0000000             -0.0007777        
  7   3198.0000000             -0.0021396        
  8   1402.0000000             -0.0055906        
  9    637.2000000             -0.0139076        
 10    298.9000000             -0.0317689        
 11    144.3000000             -0.0659302        
 12     71.2100000             -0.1168320        
 13     35.7300000             -0.1597870        
 14     17.9700000             -0.0945322        
 15      8.3410000              0.1878280        
 16      4.1120000              0.5046830        
S   16
  1 6297000.0000000             0.0000001        
  2 943100.0000000              0.0000010        
  3 214900.0000000              0.0000052        
  4  61250.0000000              0.0000216        
  5  20450.0000000              0.0000751        
  6   7719.0000000              0.0002258        
  7   3198.0000000              0.0006217        
  8   1402.0000000              0.0016251        
  9    637.2000000              0.0040535        
 10    298.9000000              0.0092902        
 11    144.3000000              0.0194561        
 12     71.2100000              0.0350040        
 13     35.7300000              0.0494897        
 14     17.9700000              0.0303443        
 15      8.3410000             -0.0663661        
 16      4.1120000             -0.2231540        
S   1
  1      2.0450000              1.0000000        
S   1
  1      0.9770000              1.0000000        
S   1
  1      0.4766000              1.0000000        
S   1
  1      0.2185000              1.0000000        
S   1
  1      0.0975900              1.0000000        
S   1
  1      0.0389300              1.0000000        
P   9
  1   5266.0000000              0.0000523        
  2   1247.0000000              0.0004635        
  3    405.0000000              0.0026410        
  4    154.8000000              0.0113169        
  5     65.3800000              0.0384704        
  6     29.5900000              0.1043390        
  7     14.0400000              0.2156840        
  8      6.8240000              0.3252600        
  9      3.3690000              0.3261780        
P   9
  1   5266.0000000             -0.0000133        
  2   1247.0000000             -0.0001179        
  3    405.0000000             -0.0006759        
  4    154.8000000             -0.0028973        
  5     65.3800000             -0.0099980        
  6     29.5900000             -0.0275416        
  7     14.0400000             -0.0587943        
  8      6.8240000             -0.0903761        
  9      3.3690000             -0.0999891        
P   1
  1      1.6660000              1.0000000        
P   1
  1      0.7681000              1.0000000        
P   1
  1      0.3504000              1.0000000        
P   1
  1      0.1556000              1.0000000        
P   1
  1      0.0668100              1.0000000        
P   1
  1      0.0264800              1.0000000        
D   1
  1     11.5330000              1.0000000        
D   1
  1      2.9880000              1.0000000        
D   1
  1      1.2590000              1.0000000        
D   1
  1      0.8040000              1.0000000        
D   1
  1      0.3800000              1.0000000        
D   1
  1      0.1600000              1.0000000        
D   1
  1      0.0609000              1.0000000        
F   1
  1      2.2120000              1.0000000        
F   1
  1      1.0630000              1.0000000        
F   1
  1      0.5100000              1.0000000        
F   1
  1      0.2450000              1.0000000        
F   1
  1      0.1100000              1.0000000        
G   1
  1      1.3473000              1.0000000        
G   1
  1      0.7009000              1.0000000        
G   1
  1      0.3647000              1.0000000        
G   1
  1      0.1799000              1.0000000        
H   1
  1      1.2861000              1.0000000        
H   1
  1      0.6115000              1.0000000        
H   1
  1      0.3465000              1.0000000        
I   1
  1      1.0409000              1.0000000        
I   1
  1      0.6222000              1.0000000


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: Cl
data:
CHLORINE
S   16
  1 7733000.0000000             0.14347400E-05   
  2 1158000.0000000             0.11148600E-04   
  3 263700.0000000              0.58586500E-04   
  4  75010.0000000              0.24451800E-03   
  5  24890.0000000              0.85828700E-03   
  6   9318.0000000              0.26101900E-02   
  7   3840.0000000              0.71378400E-02   
  8   1684.0000000              0.18456400E-01   
  9    766.3000000              0.44894400E-01   
 10    359.5000000              0.99382200E-01   
 11    173.4000000              0.19078200       
 12     85.6100000              0.29356500       
 13     42.9300000              0.30647700       
 14     21.5500000              0.16220900       
 15     10.0500000              0.24938300E-01   
 16      4.9780000             -0.51314200E-03   
S   16
  1 7733000.0000000            -0.40222700E-06   
  2 1158000.0000000            -0.31244800E-05   
  3 263700.0000000             -0.16429000E-04   
  4  75010.0000000             -0.68542100E-04   
  5  24890.0000000             -0.24100100E-03   
  6   9318.0000000             -0.73353800E-03   
  7   3840.0000000             -0.20183000E-02   
  8   1684.0000000             -0.52610700E-02   
  9    766.3000000             -0.13098600E-01   
 10    359.5000000             -0.30179400E-01   
 11    173.4000000             -0.63188800E-01   
 12     85.6100000             -0.11385900       
 13     42.9300000             -0.16125100       
 14     21.5500000             -0.10923400       
 15     10.0500000              0.16299900       
 16      4.9780000              0.50141300       
S   16
  1 7733000.0000000             0.12169600E-06   
  2 1158000.0000000             0.94514100E-06   
  3 263700.0000000              0.49711900E-05   
  4  75010.0000000              0.20732300E-04   
  5  24890.0000000              0.72940200E-04   
  6   9318.0000000              0.22189900E-03   
  7   3840.0000000              0.61135500E-03   
  8   1684.0000000              0.15933700E-02   
  9    766.3000000              0.39800100E-02   
 10    359.5000000              0.91937500E-02   
 11    173.4000000              0.19439900E-01   
 12     85.6100000              0.35518700E-01   
 13     42.9300000              0.52067400E-01   
 14     21.5500000              0.36564400E-01   
 15     10.0500000             -0.59750000E-01   
 16      4.9780000             -0.23164100       
S   1
  1      2.4780000              1.0000000        
S   1
  1      1.1800000              1.0000000        
S   1
  1      0.5828000              1.0000000        
S   1
  1      0.2668000              1.0000000        
S   1
  1      0.1183000              1.0000000        
S   1
  1      0.0462500              1.0000000        
P   9
  1   6091.0000000              0.51619400E-04   
  2   1442.0000000              0.45846800E-03   
  3    468.3000000              0.26150900E-02   
  4    179.0000000              0.11255400E-01   
  5     75.6100000              0.38457700E-01   
  6     34.2200000              0.10508100E+00   
  7     16.2300000              0.21860300E+00   
  8      7.8900000              0.33087400E+00   
  9      3.8980000              0.32587900E+00   
P   9
  1   6091.0000000             -0.13925900E-04   
  2   1442.0000000             -0.12332400E-03   
  3    468.3000000             -0.70755100E-03   
  4    179.0000000             -0.30493900E-02   
  5     75.6100000             -0.10575200E-01   
  6     34.2200000             -0.29409400E-01   
  7     16.2300000             -0.63229600E-01   
  8      7.8900000             -0.98187000E-01   
  9      3.8980000             -0.10587000E+00   
P   1
  1      1.9330000              1.0000000        
P   1
  1      0.9057000              1.0000000        
P   1
  1      0.4140000              1.0000000        
P   1
  1      0.1836000              1.0000000        
P   1
  1      0.0785900              1.0000000        
P   1
  1      0.0316300              1.0000000        
D   1
  1     14.7720000              1.0000000        
D   1
  1      3.8200000              1.0000000        
D   1
  1      1.5830000              1.0000000        
D   1
  1      1.0360000              1.0000000        
D   1
  1      0.4880000              1.0000000        
D   1
  1      0.2030000              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      2.5327000              1.0000000        
F   1
  1      1.2406000              1.0000000        
F   1
  1      0.6077000              1.0000000        
F   1
  1      0.2977000              1.0000000        
F   1
  1      0.1465000              1.0000000        
G   1
  1      1.5388000              1.0000000        
G   1
  1      0.8050000              1.0000000        
G   1
  1      0.4212000              1.0000000        
G   1
  1      0.2177000              1.0000000        
H   1
  1      1.5613000              1.0000000        
H   1
  1      0.7397000              1.0000000        
H   1
  1      0.4365000              1.0000000        
I   1
  1      1.2572000              1.0000000        
I   1
  1      0.8074000              1.0000000


name: aug-cc-pV(6+d)Z
description: V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
elt: Ar
data:
ARGON
S   16
  1 9149000.0000000             0.0000013        
  2 1370000.0000000             0.0000104        
  3 311900.0000000              0.0000549        
  4  88650.0000000              0.0002296        
  5  29330.0000000              0.0008103        
  6  10930.0000000              0.0024853        
  7   4480.0000000              0.0068369        
  8   1962.0000000              0.0176199        
  9    894.1000000              0.0428752        
 10    419.6000000              0.0954853        
 11    202.3000000              0.1850640        
 12     99.8400000              0.2890420        
 13     50.0700000              0.3101660        
 14     25.1400000              0.1721830        
 15     11.8100000              0.0285227        
 16      5.8820000             -0.0005757        
S   16
  1 9149000.0000000            -0.0000004        
  2 1370000.0000000            -0.0000030        
  3 311900.0000000             -0.0000156        
  4  88650.0000000             -0.0000652        
  5  29330.0000000             -0.0002304        
  6  10930.0000000             -0.0007075        
  7   4480.0000000             -0.0019573        
  8   1962.0000000             -0.0050856        
  9    894.1000000             -0.0126528        
 10    419.6000000             -0.0293065        
 11    202.3000000             -0.0617712        
 12     99.8400000             -0.1125410        
 13     50.0700000             -0.1622930        
 14     25.1400000             -0.1184120        
 15     11.8100000              0.1461480        
 16      5.8820000              0.4977520        
S   16
  1 9149000.0000000             0.0000001        
  2 1370000.0000000             0.0000009        
  3 311900.0000000              0.0000049        
  4  88650.0000000              0.0000204        
  5  29330.0000000              0.0000720        
  6  10930.0000000              0.0002210        
  7   4480.0000000              0.0006125        
  8   1962.0000000              0.0015908        
  9    894.1000000              0.0039722        
 10    419.6000000              0.0092204        
 11    202.3000000              0.0196367        
 12     99.8400000              0.0362570        
 13     50.0700000              0.0541725        
 14     25.1400000              0.0409996        
 15     11.8100000             -0.0551744        
 16      5.8820000             -0.2387540        
S   1
  1      2.9390000              1.0000000        
S   1
  1      1.4050000              1.0000000        
S   1
  1      0.6963000              1.0000000        
S   1
  1      0.3188000              1.0000000        
S   1
  1      0.1410000              1.0000000        
S   1
  1      0.0535700              1.0000000        
P   9
  1   7050.0000000              0.0000502        
  2   1669.0000000              0.0004454        
  3    542.1000000              0.0025480        
  4    207.1000000              0.0110155        
  5     87.5200000              0.0378490        
  6     39.6100000              0.1043550        
  7     18.7800000              0.2193350        
  8      9.1300000              0.3346150        
  9      4.5160000              0.3267710        
P   9
  1   7050.0000000             -0.0000140        
  2   1669.0000000             -0.0001243        
  3    542.1000000             -0.0007147        
  4    207.1000000             -0.0030968        
  5     87.5200000             -0.0107961        
  6     39.6100000             -0.0303536        
  7     18.7800000             -0.0659785        
  8      9.1300000             -0.1038770        
  9      4.5160000             -0.1099560        
P   1
  1      2.2450000              1.0000000        
P   1
  1      1.0650000              1.0000000        
P   1
  1      0.4885000              1.0000000        
P   1
  1      0.2166000              1.0000000        
P   1
  1      0.0925500              1.0000000        
P   1
  1      0.0367800              1.0000000        
D   1
  1     17.7430000              1.0000000        
D   1
  1      4.5800000              1.0000000        
D   1
  1      1.8890000              1.0000000        
D   1
  1      1.2520000              1.0000000        
D   1
  1      0.5940000              1.0000000        
D   1
  1      0.2470000              1.0000000        
D   1
  1      0.0898000              1.0000000        
F   1
  1      3.0582000              1.0000000        
F   1
  1      1.5292000              1.0000000        
F   1
  1      0.7647000              1.0000000        
F   1
  1      0.3824000              1.0000000        
F   1
  1      0.1830000              1.0000000        
G   1
  1      1.8450000              1.0000000        
G   1
  1      0.9657000              1.0000000        
G   1
  1      0.5055000              1.0000000        
G   1
  1      0.2555000              1.0000000        
H   1
  1      1.8743000              1.0000000        
H   1
  1      0.8871000              1.0000000        
H   1
  1      0.5265000              1.0000000        
I   1
  1      1.5066000              1.0000000        
I   1
  1      0.9926000              1.0000000        
$


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: Al
data:
ALUMINUM
S   11
  1  64150.0000000              0.290250D-03     
  2   9617.0000000              0.225064D-02     
  3   2189.0000000              0.116459D-01     
  4    620.5000000              0.467377D-01     
  5    202.7000000              0.146299D+00     
  6     73.1500000              0.330283D+00     
  7     28.5500000              0.415861D+00     
  8     11.7700000              0.189253D+00     
  9      3.3000000              0.115889D-01     
 10      1.1730000             -0.128385D-02     
 11      0.1752000              0.425883D-03     
S   11
  1  64150.0000000             -0.758048D-04     
  2   9617.0000000             -0.581791D-03     
  3   2189.0000000             -0.308113D-02     
  4    620.5000000             -0.123112D-01     
  5    202.7000000             -0.419781D-01     
  6     73.1500000             -0.103371D+00     
  7     28.5500000             -0.196308D+00     
  8     11.7700000             -0.830002D-01     
  9      3.3000000              0.541040D+00     
 10      1.1730000              0.578796D+00     
 11      0.1752000              0.288147D-01     
S   11
  1  64150.0000000              0.175078D-04     
  2   9617.0000000              0.134208D-03     
  3   2189.0000000              0.712442D-03     
  4    620.5000000              0.284330D-02     
  5    202.7000000              0.976842D-02     
  6     73.1500000              0.241850D-01     
  7     28.5500000              0.474993D-01     
  8     11.7700000              0.203621D-01     
  9      3.3000000             -0.158788D+00     
 10      1.1730000             -0.311694D+00     
 11      0.1752000              0.620147D+00     
S   1
  1      0.0647300              1.0000000        
S   1
  1      0.0231000              1.0000000        
P   7
  1    258.8000000              0.406847D-02     
  2     60.8900000              0.306815D-01     
  3     19.1400000              0.129149D+00     
  4      6.8810000              0.320831D+00     
  5      2.5740000              0.453815D+00     
  6      0.9572000              0.275066D+00     
  7      0.2099000              0.190807D-01     
P   7
  1    258.8000000             -0.748053D-03     
  2     60.8900000             -0.545796D-02     
  3     19.1400000             -0.245371D-01     
  4      6.8810000             -0.582138D-01     
  5      2.5740000             -0.983756D-01     
  6      0.9572000             -0.260064D-01     
  7      0.2099000              0.464020D+00     
P   1
  1      0.0598600              1.0000000        
P   1
  1      0.0153000              1.0000000        
D   1
  1      1.1950000              1.0000000        
D   1
  1      0.1900000              1.0000000        
D   1
  1      0.0552000              1.0000000


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: Si
data:
SILICON
S   11
  1  78860.0000000              0.270443D-03     
  2  11820.0000000              0.209717D-02     
  3   2692.0000000              0.108506D-01     
  4    763.4000000              0.436754D-01     
  5    249.6000000              0.137653D+00     
  6     90.2800000              0.316644D+00     
  7     35.2900000              0.418581D+00     
  8     14.5100000              0.210212D+00     
  9      4.0530000              0.144952D-01     
 10      1.4820000             -0.203590D-02     
 11      0.2517000              0.624186D-03     
S   11
  1  78860.0000000             -0.723177D-04     
  2  11820.0000000             -0.555116D-03     
  3   2692.0000000             -0.293805D-02     
  4    763.4000000             -0.117687D-01     
  5    249.6000000             -0.402907D-01     
  6     90.2800000             -0.100609D+00     
  7     35.2900000             -0.196528D+00     
  8     14.5100000             -0.102382D+00     
  9      4.0530000              0.527190D+00     
 10      1.4820000              0.593251D+00     
 11      0.2517000              0.332652D-01     
S   11
  1  78860.0000000              0.185113D-04     
  2  11820.0000000              0.142236D-03     
  3   2692.0000000              0.752185D-03     
  4    763.4000000              0.302279D-02     
  5    249.6000000              0.103677D-01     
  6     90.2800000              0.262563D-01     
  7     35.2900000              0.523989D-01     
  8     14.5100000              0.290959D-01     
  9      4.0530000             -0.178003D+00     
 10      1.4820000             -0.346874D+00     
 11      0.2517000              0.623020D+00     
S   1
  1      0.0924300              1.0000000        
S   1
  1      0.0332000              1.0000000        
P   7
  1    315.9000000              0.392656D-02     
  2     74.4200000              0.298811D-01     
  3     23.4800000              0.127212D+00     
  4      8.4880000              0.320943D+00     
  5      3.2170000              0.455429D+00     
  6      1.2290000              0.268563D+00     
  7      0.2964000              0.188336D-01     
P   7
  1    315.9000000             -0.858302D-03     
  2     74.4200000             -0.630328D-02     
  3     23.4800000             -0.288255D-01     
  4      8.4880000             -0.694560D-01     
  5      3.2170000             -0.119493D+00     
  6      1.2290000             -0.199581D-01     
  7      0.2964000              0.510268D+00     
P   1
  1      0.0876800              1.0000000        
P   1
  1      0.0250000              1.0000000        
D   1
  1      1.8030000              1.0000000        
D   1
  1      0.2750000              1.0000000        
D   1
  1      0.0840000              1.0000000


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: P
data:
PHOSPHORUS
S   11
  1  94840.0000000              0.255509D-03     
  2  14220.0000000              0.198193D-02     
  3   3236.0000000              0.102760D-01     
  4    917.1000000              0.414823D-01     
  5    299.5000000              0.131984D+00     
  6    108.1000000              0.308662D+00     
  7     42.1800000              0.420647D+00     
  8     17.2800000              0.222878D+00     
  9      4.8580000              0.164035D-01     
 10      1.8180000             -0.254255D-02     
 11      0.3372000              0.748050D-03     
S   11
  1  94840.0000000             -0.696939D-04     
  2  14220.0000000             -0.535266D-03     
  3   3236.0000000             -0.283709D-02     
  4    917.1000000             -0.113983D-01     
  5    299.5000000             -0.392929D-01     
  6    108.1000000             -0.996364D-01     
  7     42.1800000             -0.197983D+00     
  8     17.2800000             -0.114860D+00     
  9      4.8580000              0.518595D+00     
 10      1.8180000              0.601847D+00     
 11      0.3372000              0.368612D-01     
S   11
  1  94840.0000000              0.191199D-04     
  2  14220.0000000              0.147223D-03     
  3   3236.0000000              0.777912D-03     
  4    917.1000000              0.314546D-02     
  5    299.5000000              0.108200D-01     
  6    108.1000000              0.279957D-01     
  7     42.1800000              0.563978D-01     
  8     17.2800000              0.358190D-01     
  9      4.8580000             -0.193387D+00     
 10      1.8180000             -0.372097D+00     
 11      0.3372000              0.624246D+00     
S   1
  1      0.1232000              1.0000000        
S   1
  1      0.0417000              1.0000000        
P   7
  1    370.5000000              0.395005D-02     
  2     87.3300000              0.302492D-01     
  3     27.5900000              0.129554D+00     
  4     10.0000000              0.327594D+00     
  5      3.8250000              0.456992D+00     
  6      1.4940000              0.253086D+00     
  7      0.3921000              0.168798D-01     
P   7
  1    370.5000000             -0.959832D-03     
  2     87.3300000             -0.711177D-02     
  3     27.5900000             -0.327122D-01     
  4     10.0000000             -0.795784D-01     
  5      3.8250000             -0.135016D+00     
  6      1.4940000             -0.910585D-02     
  7      0.3921000              0.537802D+00     
P   1
  1      0.1186000              1.0000000        
P   1
  1      0.0343000              1.0000000        
D   1
  1      2.5060000              1.0000000        
D   1
  1      0.3740000              1.0000000        
D   1
  1      0.1160000              1.0000000


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: S
data:
SULFUR
S   11
  1 110800.0000000              0.247635D-03     
  2  16610.0000000              0.192026D-02     
  3   3781.0000000              0.996192D-02     
  4   1071.0000000              0.402975D-01     
  5    349.8000000              0.128604D+00     
  6    126.3000000              0.303480D+00     
  7     49.2600000              0.421432D+00     
  8     20.1600000              0.230781D+00     
  9      5.7200000              0.178971D-01     
 10      2.1820000             -0.297516D-02     
 11      0.4327000              0.849522D-03     
S   11
  1 110800.0000000             -0.687039D-04     
  2  16610.0000000             -0.527681D-03     
  3   3781.0000000             -0.279671D-02     
  4   1071.0000000             -0.112651D-01     
  5    349.8000000             -0.388834D-01     
  6    126.3000000             -0.995025D-01     
  7     49.2600000             -0.199740D+00     
  8     20.1600000             -0.123360D+00     
  9      5.7200000              0.513194D+00     
 10      2.1820000              0.607120D+00     
 11      0.4327000              0.396753D-01     
S   11
  1 110800.0000000              0.199077D-04     
  2  16610.0000000              0.153483D-03     
  3   3781.0000000              0.809503D-03     
  4   1071.0000000              0.328974D-02     
  5    349.8000000              0.112967D-01     
  6    126.3000000              0.296385D-01     
  7     49.2600000              0.599851D-01     
  8     20.1600000              0.413248D-01     
  9      5.7200000             -0.207474D+00     
 10      2.1820000             -0.392889D+00     
 11      0.4327000              0.632840D+00     
S   1
  1      0.1570000              1.0000000        
S   1
  1      0.0507000              1.0000000        
P   7
  1    399.7000000              0.447541D-02     
  2     94.1900000              0.341708D-01     
  3     29.7500000              0.144250D+00     
  4     10.7700000              0.353928D+00     
  5      4.1190000              0.459085D+00     
  6      1.6250000              0.206383D+00     
  7      0.4726000              0.102141D-01     
P   7
  1    399.7000000             -0.116251D-02     
  2     94.1900000             -0.865664D-02     
  3     29.7500000             -0.390886D-01     
  4     10.7700000             -0.934625D-01     
  5      4.1190000             -0.147994D+00     
  6      1.6250000              0.301904D-01     
  7      0.4726000              0.561573D+00     
P   1
  1      0.1407000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   1
  1      2.9940000              1.0000000        
D   1
  1      0.4810000              1.0000000        
D   1
  1      0.1550000              1.0000000


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: Cl
data:
CHLORINE
S   11
  1 127900.0000000              0.241153D-03     
  2  19170.0000000              0.187095D-02     
  3   4363.0000000              0.970827D-02     
  4   1236.0000000              0.393153D-01     
  5    403.6000000              0.125932D+00     
  6    145.7000000              0.299341D+00     
  7     56.8100000              0.421886D+00     
  8     23.2300000              0.237201D+00     
  9      6.6440000              0.191531D-01     
 10      2.5750000             -0.334792D-02     
 11      0.5371000              0.929883D-03     
S   11
  1 127900.0000000             -0.678922D-04     
  2  19170.0000000             -0.521836D-03     
  3   4363.0000000             -0.276513D-02     
  4   1236.0000000             -0.111537D-01     
  5    403.6000000             -0.385919D-01     
  6    145.7000000             -0.994848D-01     
  7     56.8100000             -0.201392D+00     
  8     23.2300000             -0.130313D+00     
  9      6.6440000              0.509443D+00     
 10      2.5750000              0.610725D+00     
 11      0.5371000              0.421549D-01     
S   11
  1 127900.0000000              0.204986D-04     
  2  19170.0000000              0.158298D-03     
  3   4363.0000000              0.833639D-03     
  4   1236.0000000              0.339880D-02     
  5    403.6000000              0.116738D-01     
  6    145.7000000              0.309622D-01     
  7     56.8100000              0.629533D-01     
  8     23.2300000              0.460257D-01     
  9      6.6440000             -0.219312D+00     
 10      2.5750000             -0.408773D+00     
 11      0.5371000              0.638465D+00     
S   1
  1      0.1938000              1.0000000        
S   1
  1      0.0608000              1.0000000        
P   7
  1    417.6000000              0.525982D-02     
  2     98.3300000              0.398332D-01     
  3     31.0400000              0.164655D+00     
  4     11.1900000              0.387322D+00     
  5      4.2490000              0.457072D+00     
  6      1.6240000              0.151636D+00     
  7      0.5322000              0.181615D-02     
P   7
  1    417.6000000             -0.143570D-02     
  2     98.3300000             -0.107796D-01     
  3     31.0400000             -0.470075D-01     
  4     11.1900000             -0.111030D+00     
  5      4.2490000             -0.153275D+00     
  6      1.6240000              0.894609D-01     
  7      0.5322000              0.579444D+00     
P   1
  1      0.1620000              1.0000000        
P   1
  1      0.0466000              1.0000000        
D   1
  1      3.6520000              1.0000000        
D   1
  1      0.6030000              1.0000000        
D   1
  1      0.1980000              1.0000000


name: aug-cc-pV(D+d)Z
description: VDZ2PD Valence Double Zeta + Polarization + Diffuse
elt: Ar
data:
ARGON
S   11
  1 145700.0000000              0.236700D-03     
  2  21840.0000000              0.183523D-02     
  3   4972.0000000              0.952860D-02     
  4   1408.0000000              0.386283D-01     
  5    459.7000000              0.124081D+00     
  6    165.9000000              0.296471D+00     
  7     64.6900000              0.422068D+00     
  8     26.4400000              0.241711D+00     
  9      7.6280000              0.200509D-01     
 10      2.9960000             -0.361000D-02     
 11      0.6504000              0.975607D-03     
S   11
  1 145700.0000000             -0.674910D-04     
  2  21840.0000000             -0.518522D-03     
  3   4972.0000000             -0.274825D-02     
  4   1408.0000000             -0.111007D-01     
  5    459.7000000             -0.384820D-01     
  6    165.9000000             -0.997599D-01     
  7     64.6900000             -0.203088D+00     
  8     26.4400000             -0.135608D+00     
  9      7.6280000              0.507195D+00     
 10      2.9960000              0.612898D+00     
 11      0.6504000              0.442968D-01     
S   11
  1 145700.0000000              0.210457D-04     
  2  21840.0000000              0.162565D-03     
  3   4972.0000000              0.855463D-03     
  4   1408.0000000              0.349745D-02     
  5    459.7000000              0.120156D-01     
  6    165.9000000              0.321368D-01     
  7     64.6900000              0.655279D-01     
  8     26.4400000              0.499370D-01     
  9      7.6280000             -0.229769D+00     
 10      2.9960000             -0.421006D+00     
 11      0.6504000              0.642331D+00     
S   1
  1      0.2337000              1.0000000        
S   1
  1      0.0709000              1.0000000        
P   7
  1    453.7000000              0.570555D-02     
  2    106.8000000              0.430460D-01     
  3     33.7300000              0.176591D+00     
  4     12.1300000              0.406863D+00     
  5      4.5940000              0.452549D+00     
  6      1.6780000              0.122801D+00     
  7      0.5909000             -0.445996D-02     
P   7
  1    453.7000000             -0.160655D-02     
  2    106.8000000             -0.121714D-01     
  3     33.7300000             -0.520789D-01     
  4     12.1300000             -0.123737D+00     
  5      4.5940000             -0.151619D+00     
  6      1.6780000              0.142425D+00     
  7      0.5909000              0.584501D+00     
P   1
  1      0.1852000              1.0000000        
P   1
  1      0.0533000              1.0000000        
D   1
  1      4.3900000              1.0000000        
D   1
  1      0.7390000              1.0000000        
D   1
  1      0.2380000              1.0000000        
$


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: Al
data:
ALUMINUM
S   13
  1 419600.0000000              0.278219D-04     
  2  62830.0000000              0.216330D-03     
  3  14290.0000000              0.113754D-02     
  4   4038.0000000              0.479635D-02     
  5   1312.0000000              0.172389D-01     
  6    470.5000000              0.538066D-01     
  7    181.8000000              0.141326D+00     
  8     74.4600000              0.289268D+00     
  9     31.9000000              0.384825D+00     
 10     13.9600000              0.232852D+00     
 11      5.1800000              0.293330D-01     
 12      2.2650000             -0.300574D-02     
 13      0.9664000              0.166673D-02     
S   13
  1 419600.0000000             -0.723754D-05     
  2  62830.0000000             -0.561733D-04     
  3  14290.0000000             -0.296528D-03     
  4   4038.0000000             -0.124913D-02     
  5   1312.0000000             -0.455101D-02     
  6    470.5000000             -0.144393D-01     
  7    181.8000000             -0.403464D-01     
  8     74.4600000             -0.922618D-01     
  9     31.9000000             -0.164510D+00     
 10     13.9600000             -0.141296D+00     
 11      5.1800000              0.195365D+00     
 12      2.2650000              0.572475D+00     
 13      0.9664000              0.374041D+00     
S   13
  1 419600.0000000              0.167150D-05     
  2  62830.0000000              0.129641D-04     
  3  14290.0000000              0.685101D-04     
  4   4038.0000000              0.288274D-03     
  5   1312.0000000              0.105276D-02     
  6    470.5000000              0.333878D-02     
  7    181.8000000              0.939217D-02     
  8     74.4600000              0.216047D-01     
  9     31.9000000              0.395873D-01     
 10     13.9600000              0.349180D-01     
 11      5.1800000             -0.528415D-01     
 12      2.2650000             -0.191878D+00     
 13      0.9664000             -0.254115D+00     
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1184000              1.0000000        
S   1
  1      0.0502100              1.0000000        
S   1
  1      0.0183000              1.0000000        
P   8
  1    891.3000000              0.491755D-03     
  2    211.3000000              0.415843D-02     
  3     68.2800000              0.212538D-01     
  4     25.7000000              0.764058D-01     
  5     10.6300000              0.194277D+00     
  6      4.6020000              0.334428D+00     
  7      2.0150000              0.375026D+00     
  8      0.8706000              0.204041D+00     
P   8
  1    891.3000000             -0.888695D-04     
  2    211.3000000             -0.745823D-03     
  3     68.2800000             -0.387025D-02     
  4     25.7000000             -0.139350D-01     
  5     10.6300000             -0.366860D-01     
  6      4.6020000             -0.627797D-01     
  7      2.0150000             -0.789602D-01     
  8      0.8706000             -0.288589D-01     
P   1
  1      0.2972000              1.0000000        
P   1
  1      0.1100000              1.0000000        
P   1
  1      0.0398900              1.0000000        
P   1
  1      0.0121000              1.0000000        
D   1
  1      1.9700000              1.0000000        
D   1
  1      0.4370000              1.0000000        
D   1
  1      0.1950000              1.0000000        
D   1
  1      0.0800000              1.0000000        
D   1
  1      0.0274000              1.0000000        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
F   1
  1      0.0582000              1.0000000        
G   1
  1      0.3570000              1.0000000        
G   1
  1      0.1530000              1.0000000


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: Si
data:
SILICON
S   13
  1 513000.0000000              0.260920D-04     
  2  76820.0000000              0.202905D-03     
  3  17470.0000000              0.106715D-02     
  4   4935.0000000              0.450597D-02     
  5   1602.0000000              0.162359D-01     
  6    574.1000000              0.508913D-01     
  7    221.5000000              0.135155D+00     
  8     90.5400000              0.281292D+00     
  9     38.7400000              0.385336D+00     
 10     16.9500000              0.245651D+00     
 11      6.4520000              0.343145D-01     
 12      2.8740000             -0.334884D-02     
 13      1.2500000              0.187625D-02     
S   13
  1 513000.0000000             -0.694880D-05     
  2  76820.0000000             -0.539641D-04     
  3  17470.0000000             -0.284716D-03     
  4   4935.0000000             -0.120203D-02     
  5   1602.0000000             -0.438397D-02     
  6    574.1000000             -0.139776D-01     
  7    221.5000000             -0.393516D-01     
  8     90.5400000             -0.914283D-01     
  9     38.7400000             -0.165609D+00     
 10     16.9500000             -0.152505D+00     
 11      6.4520000              0.168524D+00     
 12      2.8740000              0.569284D+00     
 13      1.2500000              0.398056D+00     
S   13
  1 513000.0000000              0.178068D-05     
  2  76820.0000000              0.138148D-04     
  3  17470.0000000              0.730005D-04     
  4   4935.0000000              0.307666D-03     
  5   1602.0000000              0.112563D-02     
  6    574.1000000              0.358435D-02     
  7    221.5000000              0.101728D-01     
  8     90.5400000              0.237520D-01     
  9     38.7400000              0.443483D-01     
 10     16.9500000              0.419041D-01     
 11      6.4520000             -0.502504D-01     
 12      2.8740000             -0.216578D+00     
 13      1.2500000             -0.286448D+00     
S   1
  1      0.3599000              1.0000000        
S   1
  1      0.1699000              1.0000000        
S   1
  1      0.0706600              1.0000000        
S   1
  1      0.0275000              1.0000000        
P   8
  1   1122.0000000              0.448143D-03     
  2    266.0000000              0.381639D-02     
  3     85.9200000              0.198105D-01     
  4     32.3300000              0.727017D-01     
  5     13.3700000              0.189839D+00     
  6      5.8000000              0.335672D+00     
  7      2.5590000              0.379365D+00     
  8      1.1240000              0.201193D+00     
P   8
  1   1122.0000000             -0.964883D-04     
  2    266.0000000             -0.811971D-03     
  3     85.9200000             -0.430087D-02     
  4     32.3300000             -0.157502D-01     
  5     13.3700000             -0.429541D-01     
  6      5.8000000             -0.752574D-01     
  7      2.5590000             -0.971446D-01     
  8      1.1240000             -0.227507D-01     
P   1
  1      0.3988000              1.0000000        
P   1
  1      0.1533000              1.0000000        
P   1
  1      0.0572800              1.0000000        
P   1
  1      0.0200000              1.0000000        
D   1
  1      2.6450000              1.0000000        
D   1
  1      0.6080000              1.0000000        
D   1
  1      0.2720000              1.0000000        
D   1
  1      0.1130000              1.0000000        
D   1
  1      0.0414000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
F   1
  1      0.0846000              1.0000000        
G   1
  1      0.4610000              1.0000000        
G   1
  1      0.2120000              1.0000000


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: P
data:
PHOSPHORUS
S   13
  1 615200.0000000              0.247450D-04     
  2  92120.0000000              0.192465D-03     
  3  20950.0000000              0.101202D-02     
  4   5920.0000000              0.427261D-02     
  5   1922.0000000              0.154161D-01     
  6    688.0000000              0.485976D-01     
  7    265.0000000              0.130060D+00     
  8    108.2000000              0.274514D+00     
  9     46.2200000              0.385402D+00     
 10     20.2300000              0.255934D+00     
 11      7.8590000              0.391237D-01     
 12      3.5470000             -0.368010D-02     
 13      1.5640000              0.208211D-02     
S   13
  1 615200.0000000             -0.672205D-05     
  2  92120.0000000             -0.522311D-04     
  3  20950.0000000             -0.275361D-03     
  4   5920.0000000             -0.116307D-02     
  5   1922.0000000             -0.424281D-02     
  6    688.0000000             -0.136114D-01     
  7    265.0000000             -0.385114D-01     
  8    108.2000000             -0.906643D-01     
  9     46.2200000             -0.166584D+00     
 10     20.2300000             -0.161447D+00     
 11      7.8590000              0.146781D+00     
 12      3.5470000              0.566682D+00     
 13      1.5640000              0.416433D+00     
S   13
  1 615200.0000000              0.184740D-05     
  2  92120.0000000              0.143380D-04     
  3  20950.0000000              0.757228D-04     
  4   5920.0000000              0.319205D-03     
  5   1922.0000000              0.116851D-02     
  6    688.0000000              0.374267D-02     
  7    265.0000000              0.106817D-01     
  8    108.2000000              0.252657D-01     
  9     46.2200000              0.479283D-01     
 10     20.2300000              0.477096D-01     
 11      7.8590000             -0.466525D-01     
 12      3.5470000             -0.234968D+00     
 13      1.5640000             -0.311337D+00     
S   1
  1      0.4888000              1.0000000        
S   1
  1      0.2266000              1.0000000        
S   1
  1      0.0933100              1.0000000        
S   1
  1      0.0354000              1.0000000        
P   8
  1   1367.0000000              0.421015D-03     
  2    324.0000000              0.360985D-02     
  3    104.6000000              0.189217D-01     
  4     39.3700000              0.705560D-01     
  5     16.2600000              0.188157D+00     
  6      7.0560000              0.338709D+00     
  7      3.1300000              0.381943D+00     
  8      1.3940000              0.195261D+00     
P   8
  1   1367.0000000             -0.100827D-03     
  2    324.0000000             -0.854499D-03     
  3    104.6000000             -0.457116D-02     
  4     39.3700000             -0.170327D-01     
  5     16.2600000             -0.475204D-01     
  6      7.0560000             -0.852786D-01     
  7      3.1300000             -0.109676D+00     
  8      1.3940000             -0.161181D-01     
P   1
  1      0.5179000              1.0000000        
P   1
  1      0.2032000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1      0.0272000              1.0000000        
D   1
  1      3.3430000              1.0000000        
D   1
  1      0.8070000              1.0000000        
D   1
  1      0.3650000              1.0000000        
D   1
  1      0.1540000              1.0000000        
D   1
  1      0.0570000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
F   1
  1      0.1090000              1.0000000        
G   1
  1      0.5970000              1.0000000        
G   1
  1      0.2500000              1.0000000


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: S
data:
SULFUR
S   13
  1 727800.0000000              0.236025D-04     
  2 109000.0000000              0.183482D-03     
  3  24800.0000000              0.964278D-03     
  4   7014.0000000              0.406537D-02     
  5   2278.0000000              0.146973D-01     
  6    814.7000000              0.465081D-01     
  7    313.4000000              0.125508D+00     
  8    127.7000000              0.268433D+00     
  9     54.4800000              0.384809D+00     
 10     23.8500000              0.265372D+00     
 11      9.4280000              0.437326D-01     
 12      4.2900000             -0.378807D-02     
 13      1.9090000              0.218083D-02     
S   13
  1 727800.0000000             -0.652179D-05     
  2 109000.0000000             -0.506631D-04     
  3  24800.0000000             -0.266833D-03     
  4   7014.0000000             -0.112601D-02     
  5   2278.0000000             -0.411186D-02     
  6    814.7000000             -0.132454D-01     
  7    313.4000000             -0.377004D-01     
  8    127.7000000             -0.898554D-01     
  9     54.4800000             -0.167098D+00     
 10     23.8500000             -0.169354D+00     
 11      9.4280000              0.127824D+00     
 12      4.2900000              0.564862D+00     
 13      1.9090000              0.431767D+00     
S   13
  1 727800.0000000              0.189406D-05     
  2 109000.0000000              0.146948D-04     
  3  24800.0000000              0.775460D-04     
  4   7014.0000000              0.326509D-03     
  5   2278.0000000              0.119686D-02     
  6    814.7000000              0.384799D-02     
  7    313.4000000              0.110539D-01     
  8    127.7000000              0.264645D-01     
  9     54.4800000              0.508771D-01     
 10     23.8500000              0.530030D-01     
 11      9.4280000             -0.425518D-01     
 12      4.2900000             -0.250853D+00     
 13      1.9090000             -0.333152D+00     
S   1
  1      0.6270000              1.0000000        
S   1
  1      0.2873000              1.0000000        
S   1
  1      0.1172000              1.0000000        
S   1
  1      0.0428000              1.0000000        
P   8
  1   1546.0000000              0.441183D-03     
  2    366.4000000              0.377571D-02     
  3    118.4000000              0.198360D-01     
  4     44.5300000              0.742063D-01     
  5     18.3800000              0.197327D+00     
  6      7.9650000              0.351851D+00     
  7      3.5410000              0.378687D+00     
  8      1.5910000              0.170931D+00     
P   8
  1   1546.0000000             -0.113110D-03     
  2    366.4000000             -0.958581D-03     
  3    118.4000000             -0.513471D-02     
  4     44.5300000             -0.192641D-01     
  5     18.3800000             -0.535980D-01     
  6      7.9650000             -0.960333D-01     
  7      3.5410000             -0.118183D+00     
  8      1.5910000              0.923194D-02     
P   1
  1      0.6205000              1.0000000        
P   1
  1      0.2420000              1.0000000        
P   1
  1      0.0901400              1.0000000        
P   1
  1      0.0317000              1.0000000        
D   1
  1      4.1590000              1.0000000        
D   1
  1      1.0190000              1.0000000        
D   1
  1      0.4640000              1.0000000        
D   1
  1      0.1940000              1.0000000        
D   1
  1      0.0722000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
F   1
  1      0.1400000              1.0000000        
G   1
  1      0.6830000              1.0000000        
G   1
  1      0.2970000              1.0000000


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: Cl
data:
CHLORINE
S   13
  1 834900.0000000              0.231688D-04     
  2 125000.0000000              0.180154D-03     
  3  28430.0000000              0.947782D-03     
  4   8033.0000000              0.400139D-02     
  5   2608.0000000              0.144629D-01     
  6    933.9000000              0.456586D-01     
  7    360.0000000              0.123248D+00     
  8    147.0000000              0.264369D+00     
  9     62.8800000              0.382989D+00     
 10     27.6000000              0.270934D+00     
 11     11.0800000              0.471404D-01     
 12      5.0750000             -0.371766D-02     
 13      2.2780000              0.219158D-02     
S   13
  1 834900.0000000             -0.649649D-05     
  2 125000.0000000             -0.504895D-04     
  3  28430.0000000             -0.266113D-03     
  4   8033.0000000             -0.112499D-02     
  5   2608.0000000             -0.410497D-02     
  6    933.9000000             -0.131987D-01     
  7    360.0000000             -0.375342D-01     
  8    147.0000000             -0.897233D-01     
  9     62.8800000             -0.167671D+00     
 10     27.6000000             -0.174763D+00     
 11     11.0800000              0.114909D+00     
 12      5.0750000              0.563618D+00     
 13      2.2780000              0.441606D+00     
S   13
  1 834900.0000000              0.196645D-05     
  2 125000.0000000              0.152620D-04     
  3  28430.0000000              0.806086D-04     
  4   8033.0000000              0.339960D-03     
  5   2608.0000000              0.124551D-02     
  6    933.9000000              0.399612D-02     
  7    360.0000000              0.114751D-01     
  8    147.0000000              0.275504D-01     
  9     62.8800000              0.532917D-01     
 10     27.6000000              0.571246D-01     
 11     11.0800000             -0.395201D-01     
 12      5.0750000             -0.264343D+00     
 13      2.2780000             -0.349291D+00     
S   1
  1      0.7775000              1.0000000        
S   1
  1      0.3527000              1.0000000        
S   1
  1      0.1431000              1.0000000        
S   1
  1      0.0519000              1.0000000        
P   8
  1   1703.0000000              0.474039D-03     
  2    403.6000000              0.406412D-02     
  3    130.3000000              0.213355D-01     
  4     49.0500000              0.794611D-01     
  5     20.2600000              0.208927D+00     
  6      8.7870000              0.364945D+00     
  7      3.9190000              0.371725D+00     
  8      1.7650000              0.146292D+00     
P   8
  1   1703.0000000             -0.128266D-03     
  2    403.6000000             -0.109356D-02     
  3    130.3000000             -0.583429D-02     
  4     49.0500000             -0.219258D-01     
  5     20.2600000             -0.601385D-01     
  6      8.7870000             -0.106929D+00     
  7      3.9190000             -0.122454D+00     
  8      1.7650000              0.383619D-01     
P   1
  1      0.7207000              1.0000000        
P   1
  1      0.2839000              1.0000000        
P   1
  1      0.1060000              1.0000000        
P   1
  1      0.0376000              1.0000000        
D   1
  1      5.1910000              1.0000000        
D   1
  1      1.2760000              1.0000000        
D   1
  1      0.5830000              1.0000000        
D   1
  1      0.2430000              1.0000000        
D   1
  1      0.0912000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
F   1
  1      0.2170000              1.0000000        
G   1
  1      0.8270000              1.0000000        
G   1
  1      0.3780000              1.0000000


name: aug-cc-pV(Q+d)Z
description: VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
elt: Ar
data:
ARGON
S   13
  1 950600.0000000              0.227545D-04     
  2 142300.0000000              0.176945D-03     
  3  32360.0000000              0.931282D-03     
  4   9145.0000000              0.392860D-02     
  5   2970.0000000              0.142064D-01     
  6   1064.0000000              0.448114D-01     
  7    410.8000000              0.121001D+00     
  8    168.0000000              0.260579D+00     
  9     71.9900000              0.381364D+00     
 10     31.6700000              0.276058D+00     
 11     12.8900000              0.505179D-01     
 12      5.9290000             -0.359866D-02     
 13      2.6780000              0.218798D-02     
S   13
  1 950600.0000000             -0.646201D-05     
  2 142300.0000000             -0.502346D-04     
  3  32360.0000000             -0.264804D-03     
  4   9145.0000000             -0.111895D-02     
  5   2970.0000000             -0.408276D-02     
  6   1064.0000000             -0.131216D-01     
  7    410.8000000             -0.372855D-01     
  8    168.0000000             -0.894709D-01     
  9     71.9900000             -0.168054D+00     
 10     31.6700000             -0.179594D+00     
 11     12.8900000              0.102953D+00     
 12      5.9290000              0.562630D+00     
 13      2.6780000              0.450355D+00     
S   13
  1 950600.0000000              0.202056D-05     
  2 142300.0000000              0.156851D-04     
  3  32360.0000000              0.828617D-04     
  4   9145.0000000              0.349264D-03     
  5   2970.0000000              0.127976D-02     
  6   1064.0000000              0.410365D-02     
  7    410.8000000              0.117789D-01     
  8    168.0000000              0.283868D-01     
  9     71.9900000              0.552406D-01     
 10     31.6700000              0.607492D-01     
 11     12.8900000             -0.362012D-01     
 12      5.9290000             -0.275398D+00     
 13      2.6780000             -0.362845D+00     
S   1
  1      0.9416000              1.0000000        
S   1
  1      0.4239000              1.0000000        
S   1
  1      0.1714000              1.0000000        
S   1
  1      0.0610000              1.0000000        
P   8
  1   1890.0000000              0.495752D-03     
  2    447.8000000              0.425172D-02     
  3    144.6000000              0.223277D-01     
  4     54.4600000              0.830878D-01     
  5     22.5100000              0.217110D+00     
  6      9.7740000              0.374507D+00     
  7      4.3680000              0.366445D+00     
  8      1.9590000              0.129245D+00     
P   8
  1   1890.0000000             -0.138863D-03     
  2    447.8000000             -0.118870D-02     
  3    144.6000000             -0.632553D-02     
  4     54.4600000             -0.238813D-01     
  5     22.5100000             -0.649238D-01     
  6      9.7740000             -0.115444D+00     
  7      4.3680000             -0.123651D+00     
  8      1.9590000              0.649055D-01     
P   1
  1      0.8260000              1.0000000        
P   1
  1      0.3297000              1.0000000        
P   1
  1      0.1242000              1.0000000        
P   1
  1      0.0435000              1.0000000        
D   1
  1      6.3150000              1.0000000        
D   1
  1      1.5620000              1.0000000        
D   1
  1      0.7150000              1.0000000        
D   1
  1      0.2970000              1.0000000        
D   1
  1      0.1080000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
F   1
  1      0.2940000              1.0000000        
G   1
  1      1.0070000              1.0000000        
G   1
  1      0.4590000              1.0000000        
$


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: Al
data:
ALUMINUM
S   1
  1      0.0183000              1.0000000        
P   1
  1      0.0121000              1.0000000        
D   1
  1      0.0274000              1.0000000        
F   1
  1      0.0582000              1.0000000        
G   1
  1      0.1530000              1.0000000


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: Si
data:
SILICON
S   1
  1      0.0275000              1.0000000        
P   1
  1      0.0200000              1.0000000        
D   1
  1      0.0414000              1.0000000        
F   1
  1      0.0846000              1.0000000        
G   1
  1      0.2120000              1.0000000


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: P
data:
PHOSPHORUS
S   1
  1      0.0354000              1.0000000        
P   1
  1      0.0272000              1.0000000        
D   1
  1      0.0570000              1.0000000        
F   1
  1      0.1090000              1.0000000        
G   1
  1      0.2500000              1.0000000


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: S
data:
SULFUR
S   1
  1      0.0428000              1.0000000        
P   1
  1      0.0317000              1.0000000        
D   1
  1      0.0722000              1.0000000        
F   1
  1      0.1400000              1.0000000        
G   1
  1      0.2970000              1.0000000


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: Cl
data:
CHLORINE
S   1
  1      0.0519000              1.0000000        
P   1
  1      0.0376000              1.0000000        
D   1
  1      0.0912000              1.0000000        
F   1
  1      0.2170000              1.0000000        
G   1
  1      0.3780000              1.0000000


name: aug-cc-pV(Q+d)Z Diffuse
description: 1D Diffuse Functions
elt: Ar
data:
ARGON
S   1
  1      0.0610000              1.0000000        
P   1
  1      0.0435000              1.0000000        
D   1
  1      0.1080000              1.0000000        
F   1
  1      0.2940000              1.0000000        
G   1
  1      0.4590000              1.0000000        
$


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: Al
data:
ALUMINUM
S   1
  1      0.0221000              1.0000000        
P   1
  1      0.0146000              1.0000000        
D   1
  1      0.0357000              1.0000000        
F   1
  1      0.0858000              1.0000000


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: Si
data:
SILICON
S   1
  1      0.0330000              1.0000000        
P   1
  1      0.0237000              1.0000000        
D   1
  1      0.0551000              1.0000000        
F   1
  1      0.1250000              1.0000000


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: P
data:
PHOSPHORUS
S   1
  1      0.0409000              1.0000000        
P   1
  1      0.0307000              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      0.1650000              1.0000000


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: S
data:
SULFUR
S   1
  1      0.0497000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   1
  1      0.1010000              1.0000000        
F   1
  1      0.2180000              1.0000000


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: Cl
data:
CHLORINE
S   1
  1      0.0591000              1.0000000        
P   1
  1      0.0419000              1.0000000        
D   1
  1      0.1300000              1.0000000        
F   1
  1      0.3120000              1.0000000


name: aug-cc-pV(T+d)Z Diffuse
description: 1D Diffuse Functions
elt: Ar
data:
ARGON
S   1
  1      0.0685000              1.0000000        
P   1
  1      0.0487000              1.0000000        
D   1
  1      0.1550000              1.0000000        
F   1
  1      0.4060000              1.0000000        
$


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Al
data:
ALUMINUM
S   13
  1 205500.0000000              0.678836D-04     
  2  30780.0000000              0.527149D-03     
  3   7006.0000000              0.276203D-02     
  4   1985.0000000              0.114728D-01     
  5    649.1000000              0.398188D-01     
  6    235.0000000              0.115040D+00     
  7     91.6200000              0.260887D+00     
  8     37.6700000              0.396386D+00     
  9     15.9100000              0.284597D+00     
 10      5.8500000              0.444583D-01     
 11      2.5420000             -0.489838D-02     
 12      1.0570000              0.261253D-02     
 13      0.1455000              0.722068D-03     
S   13
  1 205500.0000000             -0.176377D-04     
  2  30780.0000000             -0.137195D-03     
  3   7006.0000000             -0.718910D-03     
  4   1985.0000000             -0.301146D-02     
  5    649.1000000             -0.106014D-01     
  6    235.0000000             -0.321345D-01     
  7     91.6200000             -0.803156D-01     
  8     37.6700000             -0.156794D+00     
  9     15.9100000             -0.168376D+00     
 10      5.8500000              0.126879D+00     
 11      2.5420000              0.561494D+00     
 12      1.0570000              0.436613D+00     
 13      0.1455000             -0.114563D-01     
S   13
  1 205500.0000000              0.407315D-05     
  2  30780.0000000              0.316566D-04     
  3   7006.0000000              0.166116D-03     
  4   1985.0000000              0.694992D-03     
  5    649.1000000              0.245511D-02     
  6    235.0000000              0.744598D-02     
  7     91.6200000              0.188253D-01     
  8     37.6700000              0.372772D-01     
  9     15.9100000              0.419496D-01     
 10      5.8500000             -0.354375D-01     
 11      2.5420000             -0.175132D+00     
 12      1.0570000             -0.276203D+00     
 13      0.1455000              0.652809D+00     
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
S   1
  1      0.0221000              1.0000000        
P   7
  1    444.4000000              0.162786D-02     
  2    105.1000000              0.130687D-01     
  3     33.4700000              0.612341D-01     
  4     12.3300000              0.187870D+00     
  5      4.8690000              0.360452D+00     
  6      1.9610000              0.408454D+00     
  7      0.1888000              0.976514D-02     
P   7
  1    444.4000000             -0.286341D-03     
  2    105.1000000             -0.242308D-02     
  3     33.4700000             -0.108658D-01     
  4     12.3300000             -0.364307D-01     
  5      4.8690000             -0.641074D-01     
  6      1.9610000             -0.972239D-01     
  7      0.1888000              0.503448D+00     
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
P   1
  1      0.0146000              1.0000000        
D   1
  1      1.5700000              1.0000000        
D   1
  1      0.3330000              1.0000000        
D   1
  1      0.1110000              1.0000000        
D   1
  1      0.0357000              1.0000000        
F   1
  1      0.2440000              1.0000000        
F   1
  1      0.0858000              1.0000000


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Si
data:
SILICON
S   13
  1 254900.0000000              0.625101D-04     
  2  38190.0000000              0.485553D-03     
  3   8690.0000000              0.254516D-02     
  4   2462.0000000              0.105866D-01     
  5    804.8000000              0.368787D-01     
  6    291.3000000              0.107479D+00     
  7    113.6000000              0.247936D+00     
  8     46.7500000              0.390927D+00     
  9     19.8200000              0.302026D+00     
 10      7.7080000              0.559236D-01     
 11      3.3400000             -0.402406D-02     
 12      1.4020000              0.258030D-02     
 13      0.2070000              0.607930D-03     
S   13
  1 254900.0000000             -0.166370D-04     
  2  38190.0000000             -0.129310D-03     
  3   8690.0000000             -0.678828D-03     
  4   2462.0000000             -0.284117D-02     
  5    804.8000000             -0.100551D-01     
  6    291.3000000             -0.305774D-01     
  7    113.6000000             -0.777256D-01     
  8     46.7500000             -0.154236D+00     
  9     19.8200000             -0.180368D+00     
 10      7.7080000              0.798218D-01     
 11      3.3400000              0.547441D+00     
 12      1.4020000              0.480119D+00     
 13      0.2070000             -0.106996D-01     
S   13
  1 254900.0000000              0.426257D-05     
  2  38190.0000000              0.331062D-04     
  3   8690.0000000              0.174015D-03     
  4   2462.0000000              0.727574D-03     
  5    804.8000000              0.258333D-02     
  6    291.3000000              0.786354D-02     
  7    113.6000000              0.202155D-01     
  8     46.7500000              0.407320D-01     
  9     19.8200000              0.499358D-01     
 10      7.7080000             -0.249396D-01     
 11      3.3400000             -0.190350D+00     
 12      1.4020000             -0.318350D+00     
 13      0.2070000              0.681180D+00     
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
S   1
  1      0.0330000              1.0000000        
P   7
  1    481.5000000              0.192045D-02     
  2    113.9000000              0.153552D-01     
  3     36.2300000              0.713991D-01     
  4     13.3400000              0.213052D+00     
  5      5.2520000              0.390354D+00     
  6      2.1200000              0.393721D+00     
  7      0.2528000              0.395630D-02     
P   7
  1    481.5000000             -0.405220D-03     
  2    113.9000000             -0.335896D-02     
  3     36.2300000             -0.152860D-01     
  4     13.3400000             -0.489218D-01     
  5      5.2520000             -0.855008D-01     
  6      2.1200000             -0.112137D+00     
  7      0.2528000              0.551919D+00     
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
P   1
  1      0.0237000              1.0000000        
D   1
  1      2.3030000              1.0000000        
D   1
  1      0.4760000              1.0000000        
D   1
  1      0.1600000              1.0000000        
D   1
  1      0.0551000              1.0000000        
F   1
  1      0.3360000              1.0000000        
F   1
  1      0.1250000              1.0000000


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: P
data:
PHOSPHORUS
S   13
  1 312400.0000000              0.576960D-04     
  2  46800.0000000              0.448296D-03     
  3  10650.0000000              0.234939D-02     
  4   3018.0000000              0.978265D-02     
  5    986.8000000              0.341467D-01     
  6    357.4000000              0.100204D+00     
  7    139.6000000              0.234372D+00     
  8     57.6300000              0.382434D+00     
  9     24.6000000              0.318088D+00     
 10     10.1200000              0.707788D-01     
 11      4.2830000             -0.181799D-02     
 12      1.8050000              0.216180D-02     
 13      0.2782000              0.432297D-03     
S   13
  1 312400.0000000             -0.156709D-04     
  2  46800.0000000             -0.121724D-03     
  3  10650.0000000             -0.639672D-03     
  4   3018.0000000             -0.267426D-02     
  5    986.8000000             -0.949831D-02     
  6    357.4000000             -0.289349D-01     
  7    139.6000000             -0.745121D-01     
  8     57.6300000             -0.149938D+00     
  9     24.6000000             -0.189467D+00     
 10     10.1200000              0.363270D-01     
 11      4.2830000              0.528816D+00     
 12      1.8050000              0.519115D+00     
 13      0.2782000             -0.925695D-02     
S   13
  1 312400.0000000              0.430631D-05     
  2  46800.0000000              0.334194D-04     
  3  10650.0000000              0.175885D-03     
  4   3018.0000000              0.734340D-03     
  5    986.8000000              0.261775D-02     
  6    357.4000000              0.797852D-02     
  7    139.6000000              0.207940D-01     
  8     57.6300000              0.424446D-01     
  9     24.6000000              0.563436D-01     
 10     10.1200000             -0.127358D-01     
 11      4.2830000             -0.196495D+00     
 12      1.8050000             -0.353555D+00     
 13      0.2782000              0.700912D+00     
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
S   1
  1      0.0409000              1.0000000        
P   7
  1    504.9000000              0.233728D-02     
  2    119.4000000              0.185410D-01     
  3     37.9600000              0.849693D-01     
  4     13.9500000              0.244615D+00     
  5      5.4570000              0.422766D+00     
  6      2.1770000              0.368439D+00     
  7      0.2877000             -0.379005D-02     
P   7
  1    504.9000000             -0.555236D-03     
  2    119.4000000             -0.445913D-02     
  3     37.9600000             -0.206350D-01     
  4     13.9500000             -0.617694D-01     
  5      5.4570000             -0.108924D+00     
  6      2.1770000             -0.105599D+00     
  7      0.2877000              0.576981D+00     
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
P   1
  1      0.0307000              1.0000000        
D   1
  1      3.1200000              1.0000000        
D   1
  1      0.6480000              1.0000000        
D   1
  1      0.2180000              1.0000000        
D   1
  1      0.0775000              1.0000000        
F   1
  1      0.4520000              1.0000000        
F   1
  1      0.1650000              1.0000000


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: S
data:
SULFUR
S   13
  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      0.3490000              0.301306D-03     
S   13
  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      0.3490000             -0.918072D-02     
S   13
  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      0.3490000              0.714147D+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
S   1
  1      0.0497000              1.0000000        
P   7
  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      0.3229000             -0.502977D-02     
P   7
  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      0.3229000              0.569394D+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   1
  1      3.7560000              1.0000000        
D   1
  1      0.8120000              1.0000000        
D   1
  1      0.2730000              1.0000000        
D   1
  1      0.1010000              1.0000000        
F   1
  1      0.5570000              1.0000000        
F   1
  1      0.2180000              1.0000000


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Cl
data:
CHLORINE
S   13
  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      0.4313000              0.156136D-03     
S   13
  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      0.4313000             -0.835091D-02     
S   13
  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      0.4313000              0.725661D+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
S   1
  1      0.0591000              1.0000000        
P   7
  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      0.3818000             -0.458423D-02     
P   7
  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      0.3818000              0.564667D+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
P   1
  1      0.0419000              1.0000000        
D   1
  1      4.6100000              1.0000000        
D   1
  1      1.0110000              1.0000000        
D   1
  1      0.3390000              1.0000000        
D   1
  1      0.1300000              1.0000000        
F   1
  1      0.7060000              1.0000000        
F   1
  1      0.3120000              1.0000000


name: aug-cc-pV(T+d)Z
description: VTZ2PD Valence Triple Zeta + Polarization + Diffuse
elt: Ar
data:
ARGON
S   13
  1 545000.0000000              0.455828D-04     
  2  81640.0000000              0.354108D-03     
  3  18580.0000000              0.185797D-02     
  4   5261.0000000              0.776851D-02     
  5   1717.0000000              0.274232D-01     
  6    619.9000000              0.823836D-01     
  7    241.6000000              0.201230D+00     
  8     99.7900000              0.356781D+00     
  9     43.1500000              0.349563D+00     
 10     19.1400000              0.118266D+00     
 11      7.4880000              0.560190D-02     
 12      3.2050000              0.483473D-03     
 13      0.5204000              0.292025D-04     
S   13
  1 545000.0000000             -0.129551D-04     
  2  81640.0000000             -0.100428D-03     
  3  18580.0000000             -0.529583D-03     
  4   5261.0000000             -0.221396D-02     
  5   1717.0000000             -0.796845D-02     
  6    619.9000000             -0.245803D-01     
  7    241.6000000             -0.657798D-01     
  8     99.7900000             -0.137942D+00     
  9     43.1500000             -0.201630D+00     
 10     19.1400000             -0.412834D-01     
 11      7.4880000              0.484680D+00     
 12      3.2050000              0.579224D+00     
 13      0.5204000             -0.727553D-02     
S   13
  1 545000.0000000              0.404990D-05     
  2  81640.0000000              0.313691D-04     
  3  18580.0000000              0.165646D-03     
  4   5261.0000000              0.691662D-03     
  5   1717.0000000              0.249790D-02     
  6    619.9000000              0.771074D-02     
  7    241.6000000              0.208714D-01     
  8     99.7900000              0.443965D-01     
  9     43.1500000              0.680224D-01     
 10     19.1400000              0.141350D-01     
 11      7.4880000             -0.207489D+00     
 12      3.2050000             -0.425045D+00     
 13      0.5204000              0.733627D+00     
S   1
  1      1.1960000              1.0000000        
S   1
  1      0.1954000              1.0000000        
S   1
  1      0.0685000              1.0000000        
P   7
  1    761.8000000              0.236976D-02     
  2    180.2000000              0.190199D-01     
  3     57.5000000              0.880807D-01     
  4     21.2400000              0.256377D+00     
  5      8.3880000              0.438711D+00     
  6      3.4160000              0.347569D+00     
  7      0.4523000             -0.523882D-02     
P   7
  1    761.8000000             -0.667211D-03     
  2    180.2000000             -0.532717D-02     
  3     57.5000000             -0.255494D-01     
  4     21.2400000             -0.757197D-01     
  5      8.3880000             -0.141133D+00     
  6      3.4160000             -0.932768D-01     
  7      0.4523000              0.562450D+00     
P   1
  1      1.2060000              1.0000000        
P   1
  1      0.1545000              1.0000000        
P   1
  1      0.0487000              1.0000000        
D   1
  1      5.5510000              1.0000000        
D   1
  1      1.2350000              1.0000000        
D   1
  1      0.4120000              1.0000000        
D   1
  1      0.1550000              1.0000000        
F   1
  1      0.8900000              1.0000000        
F   1
  1      0.4060000              1.0000000        
$


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: He
data:
HELIUM
S   17
  1 279303.6000000              3.27396332D-07   
  2  53480.6340000              2.00392190D-06   
  3  12179.0090000              1.16245413D-05   
  4   3255.9044000              5.36358606D-05   
  5   1005.0260000              2.08006490D-04   
  6    351.2840600              6.92671025D-04   
  7    136.1065800              2.04585843D-03   
  8     57.2135580              5.49689038D-03   
  9     25.5710160              1.37223886D-02   
 10     11.9389730              3.19304693D-02   
 11      5.7401136              6.83650763D-02   
 12      2.8110619              1.29772054D-01   
 13      1.3914291              2.10879246D-01   
 14      0.69261487             2.80469937D-01   
 15      0.34565755             2.72596155D-01   
 16      0.17267382             1.38076192D-01   
 17      0.86282949E-01         1.94005977D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   20
  1 483307.7200000              4.85854775D-07   
  2  90788.6100000              3.05140361D-06   
  3  20515.0980000              1.77366412D-05   
  4   5484.1328000              8.15223537D-05   
  5   1699.6534000              3.13627620D-04   
  6    597.0231400              1.03763269D-03   
  7    232.1520000              3.05101345D-03   
  8     97.6868580              8.19172329D-03   
  9     43.5833800              2.04004785D-02   
 10     20.2670210              4.71582355D-02   
 11      9.6913182              9.88177384D-02   
 12      4.7178658              1.80686934D-01   
 13      2.3217784              2.73481058D-01   
 14      1.1496894              3.06473526D-01   
 15      0.57116237             1.86976776D-01   
 16      0.28419885             3.50450457D-02   
 17      0.14150657             8.33426685D-04   
 18      0.70475145E-01         1.30139383D-04   
 19      0.35101438E-01         3.90821030D-04   
 20      0.17483139E-01         4.71149854D-05   
S   20
  1 483307.7200000              7.59166201D-08   
  2  90788.6100000              4.76665013D-07   
  3  20515.0980000              2.77168150D-06   
  4   5484.1328000              1.27351664D-05   
  5   1699.6534000              4.90295015D-05   
  6    597.0231400              1.62207357D-04   
  7    232.1520000              4.78032183D-04   
  8     97.6868580              1.28632742D-03   
  9     43.5833800              3.22959721D-03   
 10     20.2670210              7.55701887D-03   
 11      9.6913182              1.62748135D-02   
 12      4.7178658              3.11065765D-02   
 13      2.3217784              5.19926103D-02   
 14      1.1496894              7.55493709D-02   
 15      0.57116237             9.27545288D-02   
 16      0.28419885             6.03857299D-02   
 17      0.14150657            -1.07720377D-01   
 18      0.70475145E-01        -4.29047357D-01   
 19      0.35101438E-01        -4.76348120D-01   
 20      0.17483139E-01        -1.18268922D-01


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   20
  1 791926.4900000              5.48140344D-07   
  2 152594.3200000              3.32069560D-06   
  3  34946.4260000              1.91484686D-05   
  4   9374.5162000              8.81277018D-05   
  5   2894.0932000              3.42658648D-04   
  6   1007.9657000              1.14994107D-03   
  7    387.8318800              3.43310553D-03   
  8    161.4924800              9.32691868D-03   
  9     71.4057440              2.34161101D-02   
 10     32.9814900              5.41827509D-02   
 11     15.7027110              1.13044460D-01   
 12      7.6277240              2.03692661D-01   
 13      3.7522348              2.97434834D-01   
 14      1.8596241              2.96646520D-01   
 15      0.92543781             1.39229750D-01   
 16      0.46150028             1.55638630D-02   
 17      0.23035801             6.86681223D-04   
 18      0.11502470            -3.87797913D-04   
 19      0.57441599E-01         1.88032768D-04   
 20      0.28686125E-01        -4.94350080D-05   
S   20
  1 791926.4900000              9.98952369D-08   
  2 152594.3200000              6.05132040D-07   
  3  34946.4260000              3.48987360D-06   
  4   9374.5162000              1.60611948D-05   
  5   2894.0932000              6.24755975D-05   
  6   1007.9657000              2.09787198D-04   
  7    387.8318800              6.27620267D-04   
  8    161.4924800              1.71183305D-03   
  9     71.4057440              4.33797704D-03   
 10     32.9814900              1.02161098D-02   
 11     15.7027110              2.20662424D-02   
 12      7.6277240              4.23879348D-02   
 13      3.7522348              7.13885446D-02   
 14      1.8596241              1.01613147D-01   
 15      0.92543781             9.51667587D-02   
 16      0.46150028            -2.57674747D-02   
 17      0.23035801            -2.46614604D-01   
 18      0.11502470            -4.39722155D-01   
 19      0.57441599E-01        -3.48685098D-01   
 20      0.28686125E-01        -7.24784277D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   20
  1 1262544.2000000             5.37676932D-07   
  2 250189.7900000              3.12581394D-06   
  3  58235.6320000              1.78288693D-05   
  4  15710.1300000              8.19974451D-05   
  5   4833.6537000              3.22611070D-04   
  6   1665.9602000              1.10419692D-03   
  7    631.1431800              3.38241262D-03   
  8    257.9545800              9.44640979D-03   
  9    111.7793200              2.44075847D-02   
 10     50.5786730              5.79582590D-02   
 11     23.5982840              1.23596924D-01   
 12     11.2407660              2.24500726D-01   
 13      5.4263012              3.19658606D-01   
 14      2.6407828              2.83202769D-01   
 15      1.2911054              1.01211882D-01   
 16      0.63275517             6.52511095D-03   
 17      0.31045529             9.79948955D-04   
 18      0.15239109            -1.69136696D-04   
 19      0.74814128E-01         1.84886629D-04   
 20      0.36730086E-01        -3.40822067D-05   
S   20
  1 1262544.2000000             1.08556177D-07   
  2 250189.7900000              6.31230736D-07   
  3  58235.6320000              3.59956166D-06   
  4  15710.1300000              1.65612586D-05   
  5   4833.6537000              6.51550894D-05   
  6   1665.9602000              2.23276616D-04   
  7    631.1431800              6.84956106D-04   
  8    257.9545800              1.92298550D-03   
  9    111.7793200              5.01498134D-03   
 10     50.5786730              1.21685006D-02   
 11     23.5982840              2.69939880D-02   
 12     11.2407660              5.31508407D-02   
 13      5.4263012              9.03379101D-02   
 14      2.6407828              1.21263857D-01   
 15      1.2911054              7.46814636D-02   
 16      0.63275517            -1.17619472D-01   
 17      0.31045529            -3.55649007D-01   
 18      0.15239109            -4.41589642D-01   
 19      0.74814128E-01        -2.19497766D-01   
 20      0.36730086E-01        -1.99808910D-02   
P   13
  1    257.9545800              6.32588084D-05   
  2    111.7793200              1.31475027D-04   
  3     50.5786730              6.41739873D-04   
  4     23.5982840              1.99360592D-03   
  5     11.2407660              6.20698603D-03   
  6      5.4263012              1.65111193D-02   
  7      2.6407828              4.15906223D-02   
  8      1.2911054              9.79405490D-02   
  9      0.63275517             1.94106199D-01   
 10      0.31045529             2.92962157D-01   
 11      0.15239109             3.25530456D-01   
 12      0.74814128E-01         2.09049700D-01   
 13      0.36730086E-01         4.89645649D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   20
  1 2158490.7000000             4.37542282D-07   
  2 429550.7800000              2.53117057D-06   
  3  99951.3270000              1.44925361D-05   
  4  26848.2830000              6.72164725D-05   
  5   8199.1206000              2.67787129D-04   
  6   2798.3668000              9.30613357D-04   
  7   1048.2982000              2.89996391D-03   
  8    423.3698400              8.24881114D-03   
  9    181.2684300              2.17501411D-02   
 10     81.0682950              5.28872843D-02   
 11     37.4039310              1.16159545D-01   
 12     17.6295390              2.18247270D-01   
 13      8.4254263              3.21522561D-01   
 14      4.0611964              2.94250645D-01   
 15      1.9672294              1.09046393D-01   
 16      0.95541420             7.83077011D-03   
 17      0.46459041             1.37673618D-03   
 18      0.22603305            -1.05837123D-04   
 19      0.10998858             2.30029325D-04   
 20      0.53523003E-01        -3.91304302D-05   
S   20
  1 2158490.7000000             9.32156828D-08   
  2 429550.7800000              5.39401625D-07   
  3  99951.3270000              3.08743447D-06   
  4  26848.2830000              1.43262464D-05   
  5   8199.1206000              5.70642703D-05   
  6   2798.3668000              1.98560655D-04   
  7   1048.2982000              6.19483734D-04   
  8    423.3698400              1.77110898D-03   
  9    181.2684300              4.71049906D-03   
 10     81.0682950              1.16994030D-02   
 11     37.4039310              2.67177141D-02   
 12     17.6295390              5.44461247D-02   
 13      8.4254263              9.53868189D-02   
 14      4.0611964              1.29048397D-01   
 15      1.9672294              7.40343119D-02   
 16      0.95541420            -1.34232743D-01   
 17      0.46459041            -3.70134155D-01   
 18      0.22603305            -4.31397642D-01   
 19      0.10998858            -2.04799930D-01   
 20      0.53523003E-01        -1.82280210D-02   
P   13
  1    423.3698400              5.91351365D-05   
  2    181.2684300              1.30766550D-04   
  3     81.0682950              6.37251848D-04   
  4     37.4039310              2.06753359D-03   
  5     17.6295390              6.66686338D-03   
  6      8.4254263              1.85912741D-02   
  7      4.0611964              4.82526746D-02   
  8      1.9672294              1.12900938D-01   
  9      0.95541420             2.14229102D-01   
 10      0.46459041             3.03743679D-01   
 11      0.22603305             3.11196360D-01   
 12      0.10998858             1.84611355D-01   
 13      0.53523003E-01         4.05258192D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   20
  1 3260308.3000000             3.83143251D-07   
  2 666094.2500000              2.13354921D-06   
  3 157037.1600000              1.21435336D-05   
  4  42265.0550000              5.65738517D-05   
  5  12820.2600000              2.28899953D-04   
  6   4319.7754000              8.12953386D-04   
  7   1592.0629000              2.59658136D-03   
  8    631.8305400              7.57037908D-03   
  9    265.9899100              2.04305730D-02   
 10    117.1706200              5.07643188D-02   
 11     53.3730440              1.13825077D-01   
 12     24.8964120              2.17887284D-01   
 13     11.8013500              3.24868018D-01   
 14      5.6521249              2.97211399D-01   
 15      2.7239663              1.08999078D-01   
 16      1.3173740              8.11073444D-03   
 17      0.63824304             1.58108819D-03   
 18      0.30945957            -1.94452268D-05   
 19      0.15008774             2.33712012D-04   
 20      0.72797882E-01        -3.60414137D-05   
S   20
  1 3260308.3000000             8.44229218D-08   
  2 666094.2500000              4.70264188D-07   
  3 157037.1600000              2.67561787D-06   
  4  42265.0550000              1.24713937D-05   
  5  12820.2600000              5.04467276D-05   
  6   4319.7754000              1.79388402D-04   
  7   1592.0629000              5.73564695D-04   
  8    631.8305400              1.68053765D-03   
  9    265.9899100              4.57364727D-03   
 10    117.1706200              1.16071814D-02   
 11     53.3730440              2.70770001D-02   
 12     24.8964120              5.63381000D-02   
 13     11.8013500              1.00145137D-01   
 14      5.6521249              1.34159477D-01   
 15      2.7239663              6.89750751D-02   
 16      1.3173740             -1.50847915D-01   
 17      0.63824304            -3.80055345D-01   
 18      0.30945957            -4.20653530D-01   
 19      0.15008774            -1.92369675D-01   
 20      0.72797882E-01        -1.69241653D-02   
P   13
  1    631.8305400              5.55726511D-05   
  2    265.9899100              1.32627868D-04   
  3    117.1706200              6.44451907D-04   
  4     53.3730440              2.16969432D-03   
  5     24.8964120              7.16169272D-03   
  6     11.8013500              2.05499096D-02   
  7      5.6521249              5.41282537D-02   
  8      2.7239663              1.24924721D-01   
  9      1.3173740              2.28051753D-01   
 10      0.63824304             3.07888050D-01   
 11      0.30945957             2.98446695D-01   
 12      0.15008774             1.68692665D-01   
 13      0.72797882E-01         3.62965476D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   20
  1 4585516.2000000             3.52527752D-07   
  2 925486.9200000              2.00319362D-06   
  3 215772.2900000              1.15459235D-05   
  4  57480.7490000              5.45076427D-05   
  5  17270.1670000              2.23236045D-04   
  6   5766.9282000              8.02110168D-04   
  7   2107.0076000              2.59165271D-03   
  8    829.0675800              7.64175497D-03   
  9    346.0479100              2.08617462D-02   
 10    151.1214700              5.24042260D-02   
 11     68.2332500              1.18631345D-01   
 12     31.5427730              2.27880005D-01   
 13     14.8153000              3.34810125D-01   
 14      7.0298236              2.88522185D-01   
 15      3.3561489              9.28025917D-02   
 16      1.6077662              5.82708287D-03   
 17      0.77153240             1.44418931D-03   
 18      0.37052330             1.02087001D-04   
 19      0.17799002             1.70372339D-04   
 20      0.85507949E-01        -1.89613194D-05   
S   20
  1 4585516.2000000             7.99650859D-08   
  2 925486.9200000              4.54559143D-07   
  3 215772.2900000              2.61885582D-06   
  4  57480.7490000              1.23704765D-05   
  5  17270.1670000              5.06468737D-05   
  6   5766.9282000              1.82221513D-04   
  7   2107.0076000              5.89349945D-04   
  8    829.0675800              1.74676922D-03   
  9    346.0479100              4.81022977D-03   
 10    151.1214700              1.23557448D-02   
 11     68.2332500              2.91754648D-02   
 12     31.5427730              6.13291172D-02   
 13     14.8153000              1.09017944D-01   
 14      7.0298236              1.39498251D-01   
 15      3.3561489              4.91181071D-02   
 16      1.6077662             -1.95740338D-01   
 17      0.77153240            -4.11233262D-01   
 18      0.37052330            -3.95834318D-01   
 19      0.17799002            -1.46588982D-01   
 20      0.85507949E-01        -8.93794951D-03   
P   13
  1    829.0675800              5.83562879D-05   
  2    346.0479100              1.44612089D-04   
  3    151.1214700              7.04058240D-04   
  4     68.2332500              2.42428669D-03   
  5     31.5427730              8.14150584D-03   
  6     14.8153000              2.38707314D-02   
  7      7.0298236              6.35883554D-02   
  8      3.3561489              1.42759623D-01   
  9      1.6077662              2.43593963D-01   
 10      0.77153240             3.04921032D-01   
 11      0.37052330             2.80584163D-01   
 12      0.17799002             1.57170157D-01   
 13      0.85507949E-01         3.55116239D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   20
  1 6059261.1000000             3.34744155D-07   
  2 1228911.8000000             1.88978276D-06   
  3 286871.9700000              1.09056629D-05   
  4  76276.7390000              5.17214942D-05   
  5  22815.9150000              2.13481544D-04   
  6   7570.7705000              7.74669751D-04   
  7   2745.2997000              2.53084695D-03   
  8   1071.4758000              7.54798282D-03   
  9    443.5640000              2.08373297D-02   
 10    192.1714000              5.28959489D-02   
 11     86.1207250              1.20845187D-01   
 12     39.5368790              2.33333748D-01   
 13     18.4518010              3.40374661D-01   
 14      8.7036210              2.83528246D-01   
 15      4.1321847              8.47789382D-02   
 16      1.9690336              5.12618990D-03   
 17      0.94003492             1.35511999D-03   
 18      0.44916062             1.99456561D-04   
 19      0.21468142             1.26433711D-04   
 20      0.10261793            -6.87286569D-06   
S   20
  1 6059261.1000000             7.74628633D-08   
  2 1228911.8000000             4.37472318D-07   
  3 286871.9700000              2.52353411D-06   
  4  76276.7390000              1.19748063D-05   
  5  22815.9150000              4.94108838D-05   
  6   7570.7705000              1.79531797D-04   
  7   2745.2997000              5.87131004D-04   
  8   1071.4758000              1.76009070D-03   
  9    443.5640000              4.90245162D-03   
 10    192.1714000              1.27315547D-02   
 11     86.1207250              3.03908667D-02   
 12     39.5368790              6.44713453D-02   
 13     18.4518010              1.14739036D-01   
 14      8.7036210              1.42199237D-01   
 15      4.1321847              3.54093970D-02   
 16      1.9690336             -2.21903896D-01   
 17      0.94003492            -4.24246038D-01   
 18      0.44916062            -3.77078659D-01   
 19      0.21468142            -1.24954252D-01   
 20      0.10261793            -6.47856385D-03   
P   13
  1   1071.4758000              5.89513874D-05   
  2    443.5640000              1.51228834D-04   
  3    192.1714000              7.38029255D-04   
  4     86.1207250              2.58990973D-03   
  5     39.5368790              8.82169099D-03   
  6     18.4518010              2.62771107D-02   
  7      8.7036210              7.03151435D-02   
  8      4.1321847              1.54439236D-01   
  9      1.9690336              2.52782412D-01   
 10      0.94003492             3.02850673D-01   
 11      0.44916062             2.69236455D-01   
 12      0.21468142             1.48605055D-01   
 13      0.10261793             3.42894227D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ne
data:
NEON
S   20
  1 8133616.4000000             3.02773315D-07   
  2 1642270.4000000             1.72438322D-06   
  3 380773.8000000              1.00483687D-05   
  4 100383.5800000              4.82585233D-05   
  5  29737.5270000              2.01887523D-04   
  6   9767.4661000              7.42808895D-04   
  7   3506.2154000              2.45907748D-03   
  8   1355.4374000              7.42394482D-03   
  9    556.2762900              2.07155215D-02   
 10    239.1820400              5.30800919D-02   
 11    106.4971800              1.22187397D-01   
 12     48.6267980              2.36959445D-01   
 13     22.5913360              3.43961392D-01   
 14     10.6154760              2.80062532D-01   
 15      5.0231969              7.99610430D-02   
 16      2.3865241              4.88203348D-03   
 17      1.1362163              1.29634730D-03   
 18      0.54146718             2.74256732D-04   
 19      0.25813094             9.49920454D-05   
 20      0.12306969             1.88609681D-06   
S   20
  1 8133616.4000000             7.10919635D-08   
  2 1642270.4000000             4.05023643D-07   
  3 380773.8000000              2.35927505D-06   
  4 100383.5800000              1.13363830D-05   
  5  29737.5270000              4.74129867D-05   
  6   9767.4661000              1.74658355D-04   
  7   3506.2154000              5.78839961D-04   
  8   1355.4374000              1.75633156D-03   
  9    556.2762900              4.94563775D-03   
 10    239.1820400              1.29669601D-02   
 11    106.4971800              3.12288350D-02   
 12     48.6267980              6.67239968D-02   
 13     22.5913360              1.18817413D-01   
 14     10.6154760              1.43637856D-01   
 15      5.0231969              2.53183824D-02   
 16      2.3865241             -2.38582396D-01   
 17      1.1362163             -4.29930830D-01   
 18      0.54146718            -3.63850398D-01   
 19      0.25813094            -1.13395509D-01   
 20      0.12306969            -5.49246214D-03   
P   13
  1   1355.4374000              5.86664618D-05   
  2    556.2762900              1.55757176D-04   
  3    239.1820400              7.61271357D-04   
  4    106.4971800              2.71419149D-03   
  5     48.6267980              9.34580606D-03   
  6     22.5913360              2.81554493D-02   
  7     10.6154760              7.54163342D-02   
  8      5.0231969              1.62767112D-01   
  9      2.3865241              2.58888439D-01   
 10      1.1362163              3.01226781D-01   
 11      0.54146718             2.61126125D-01   
 12      0.25813094             1.41945715D-01   
 13      0.12306969             3.30682749D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   23
  1 10841861.0000000            2.68835285D-07   
  2 2193388.9000000             1.52650424D-06   
  3 509121.7000000              8.89079173D-06   
  4 134196.4200000              4.27549043D-05   
  5  39688.0420000              1.79488085D-04   
  6  12995.6240000              6.63995397D-04   
  7   4645.6061000              2.21307050D-03   
  8   1787.4459000              6.73185075D-03   
  9    730.1903900              1.89332227D-02   
 10    312.7465900              4.89525790D-02   
 11    138.8966100              1.14042456D-01   
 12     63.3674510              2.25240376D-01   
 13     29.4721510              3.37712290D-01   
 14     13.8913650              2.94366417D-01   
 15      6.6057465              9.63045626D-02   
 16      3.1589144              6.70079079D-03   
 17      1.5157244              1.65241126D-03   
 18      0.72866576             7.09636229D-05   
 19      0.35064238             2.24015568D-04   
 20      0.16881043            -9.69280444D-05   
 21      0.81285587E-01         5.45612505D-05   
 22      0.39142914E-01        -2.51936328D-05   
 23      0.18849437E-01         5.97147087D-06   
S   23
  1 10841861.0000000           -6.56311534D-08   
  2 2193388.9000000            -3.72847812D-07   
  3 509121.7000000             -2.17034869D-06   
  4 134196.4200000             -1.04442388D-05   
  5  39688.0420000             -4.38238333D-05   
  6  12995.6240000             -1.62349842D-04   
  7   4645.6061000             -5.41479503D-04   
  8   1787.4459000             -1.65551144D-03   
  9    730.1903900             -4.69429184D-03   
 10    312.7465900             -1.24107892D-02   
 11    138.8966100             -3.01706869D-02   
 12     63.3674510             -6.53966789D-02   
 13     29.4721510             -1.18740970D-01   
 14     13.8913650             -1.50657318D-01   
 15      6.6057465             -4.44482773D-02   
 16      3.1589144              2.21521635D-01   
 17      1.5157244              4.45897014D-01   
 18      0.72866576             3.82584806D-01   
 19      0.35064238             1.02813648D-01   
 20      0.16881043             2.01909766D-03   
 21      0.81285587E-01         6.71674188D-04   
 22      0.39142914E-01        -3.01464426D-05   
 23      0.18849437E-01         1.12959839D-04   
S   23
  1 10841861.0000000           -9.86644772D-09   
  2 2193388.9000000            -5.60334414D-08   
  3 509121.7000000             -3.26294377D-07   
  4 134196.4200000             -1.56956914D-06   
  5  39688.0420000             -6.58898331D-06   
  6  12995.6240000             -2.43976667D-05   
  7   4645.6061000             -8.14293586D-05   
  8   1787.4459000             -2.48845193D-04   
  9    730.1903900             -7.06566359D-04   
 10    312.7465900             -1.86857931D-03   
 11    138.8966100             -4.55907766D-03   
 12     63.3674510             -9.92314586D-03   
 13     29.4721510             -1.82618452D-02   
 14     13.8913650             -2.36569657D-02   
 15      6.6057465             -7.18305160D-03   
 16      3.1589144              3.89483188D-02   
 17      1.5157244              8.49458916D-02   
 18      0.72866576             1.12925521D-01   
 19      0.35064238             1.13483247D-01   
 20      0.16881043             1.33824105D-02   
 21      0.81285587E-01        -3.24562772D-01   
 22      0.39142914E-01        -5.73347782D-01   
 23      0.18849437E-01        -2.31694227D-01   
P   13
  1   1787.4459000              5.55067993D-05   
  2    730.1903900              1.50098770D-04   
  3    312.7465900              7.35659674D-04   
  4    138.8966100              2.65050948D-03   
  5     63.3674510              9.22086086D-03   
  6     29.4721510              2.80883880D-02   
  7     13.8913650              7.59539562D-02   
  8      6.6057465              1.65953470D-01   
  9      3.1589144              2.68309605D-01   
 10      1.5157244              3.15579133D-01   
 11      0.72866576             2.60538054D-01   
 12      0.35064238             1.10002562D-01   
 13      0.16881043             1.61711305D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   23
  1 13213988.0000000            2.59078550D-07   
  2 2744119.2000000             1.41526907D-06   
  3 645993.8700000              8.17840012D-06   
  4 170972.5900000              3.93596093D-05   
  5  50385.2600000              1.66893350D-04   
  6  16355.2370000              6.26853553D-04   
  7   5780.0158000              2.12458457D-03   
  8   2197.3623000              6.56644130D-03   
  9    887.9872700              1.86993644D-02   
 10    377.1629100              4.87610975D-02   
 11    166.6381000              1.14008459D-01   
 12     75.8906310              2.25181736D-01   
 13     35.3522960              3.36509779D-01   
 14     16.7386850              2.93628174D-01   
 15      8.0156338              9.81653251D-02   
 16      3.8674577              7.30180756D-03   
 17      1.8749364              1.59946030D-03   
 18      0.91156004             5.17747099D-05   
 19      0.44388387             1.97034476D-04   
 20      0.21632024            -9.15367482D-05   
 21      0.10545696             5.13364744D-05   
 22      0.51417029E-01        -2.26532602D-05   
 23      0.25069891E-01         5.77564002D-06   
S   23
  1 13213988.0000000           -6.54481945D-08   
  2 2744119.2000000            -3.57692684D-07   
  3 645993.8700000             -2.06586320D-06   
  4 170972.5900000             -9.94883493D-06   
  5  50385.2600000             -4.21656572D-05   
  6  16355.2370000             -1.58585012D-04   
  7   5780.0158000             -5.37887342D-04   
  8   2197.3623000             -1.67070194D-03   
  9    887.9872700             -4.79743397D-03   
 10    377.1629100             -1.27932404D-02   
 11    166.6381000             -3.12399081D-02   
 12     75.8906310             -6.78109831D-02   
 13     35.3522960             -1.22890321D-01   
 14     16.7386850             -1.55254149D-01   
 15      8.0156338             -4.65475846D-02   
 16      3.8674577              2.25955800D-01   
 17      1.8749364              4.65742182D-01   
 18      0.91156004             3.78453879D-01   
 19      0.44388387             8.30086177D-02   
 20      0.21632024             1.94693743D-03   
 21      0.10545696            -2.57216506D-04   
 22      0.51417029E-01         1.97114943D-04   
 23      0.25069891E-01        -6.14080877D-05   
S   23
  1 13213988.0000000           -1.26111487D-08   
  2 2744119.2000000            -6.88980160D-08   
  3 645993.8700000             -3.98100189D-07   
  4 170972.5900000             -1.91627573D-06   
  5  50385.2600000             -8.12601846D-06   
  6  16355.2370000             -3.05452454D-05   
  7   5780.0158000             -1.03683295D-04   
  8   2197.3623000             -3.21884776D-04   
  9    887.9872700             -9.25696460D-04   
 10    377.1629100             -2.46956308D-03   
 11    166.6381000             -6.05595571D-03   
 12     75.8906310             -1.32108385D-02   
 13     35.3522960             -2.43219814D-02   
 14     16.7386850             -3.14754914D-02   
 15      8.0156338             -9.77780694D-03   
 16      3.8674577              5.18756831D-02   
 17      1.8749364              1.20145636D-01   
 18      0.91156004             1.70469958D-01   
 19      0.44388387             1.13744503D-01   
 20      0.21632024            -1.34037966D-01   
 21      0.10545696            -4.42827199D-01   
 22      0.51417029E-01        -4.70641408D-01   
 23      0.25069891E-01        -1.29850578D-01   
P   13
  1   2197.3623000              5.64586423D-05   
  2    887.9872700              1.58909797D-04   
  3    377.1629100              7.78738887D-04   
  4    166.6381000              2.83566708D-03   
  5     75.8906310              9.87700143D-03   
  6     35.3522960              3.00721985D-02   
  7     16.7386850              8.07851530D-02   
  8      8.0156338              1.74543554D-01   
  9      3.8674577              2.79423292D-01   
 10      1.8749364              3.23996477D-01   
 11      0.91156004             2.45565980D-01   
 12      0.44388387             8.16888903D-02   
 13      0.21632024             1.03046689D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   23
  1 17742122.0000000            2.22092075D-07   
  2 3557452.1000000             1.28100342D-06   
  3 817621.3600000              7.55387154D-06   
  4 213296.1200000              3.68404391D-05   
  5  62436.9360000              1.56727810D-04   
  6  20246.9100000              5.87035995D-04   
  7   7174.6847000              1.97800787D-03   
  8   2739.9513000              6.07432660D-03   
  9   1112.5550000              1.72315051D-02   
 10    474.3496300              4.49770125D-02   
 11    210.0073600              1.06173456D-01   
 12     95.6309080              2.14061355D-01   
 13     44.4427190              3.31842770D-01   
 14     20.9491280              3.07464307D-01   
 15      9.9692277              1.12054616D-01   
 16      4.7731270              8.66374334D-03   
 17      2.2937812              1.86925162D-03   
 18      1.1046295             -1.84788590D-04   
 19      0.53255201             3.23300683D-04   
 20      0.25688228            -1.88046348D-04   
 21      0.12393628             1.02964725D-04   
 22      0.59798846E-01        -4.75463031D-05   
 23      0.28853202E-01         1.20516381D-05   
S   23
  1 17742122.0000000           -5.77113999D-08   
  2 3557452.1000000            -3.33083729D-07   
  3 817621.3600000             -1.96268459D-06   
  4 213296.1200000             -9.58047224D-06   
  5  62436.9360000             -4.07281872D-05   
  6  20246.9100000             -1.52794519D-04   
  7   7174.6847000             -5.15006365D-04   
  8   2739.9513000             -1.58975539D-03   
  9   1112.5550000             -4.54309032D-03   
 10    474.3496300             -1.21196048D-02   
 11    210.0073600             -2.97939917D-02   
 12     95.6309080             -6.57589222D-02   
 13     44.4427190             -1.22302040D-01   
 14     20.9491280             -1.62141060D-01   
 15      9.9692277             -6.12910323D-02   
 16      4.7731270              2.24210357D-01   
 17      2.2937812              4.93519578D-01   
 18      1.1046295              3.76629267D-01   
 19      0.53255201             6.31299132D-02   
 20      0.25688228             2.53722431D-03   
 21      0.12393628            -1.03565895D-03   
 22      0.59798846E-01         6.84276421D-04   
 23      0.28853202E-01        -1.70732137D-04   
S   23
  1 17742122.0000000           -1.33263134D-08   
  2 3557452.1000000            -7.68887585D-08   
  3 817621.3600000             -4.53239973D-07   
  4 213296.1200000             -2.21149097D-06   
  5  62436.9360000             -9.40592391D-06   
  6  20246.9100000             -3.52698327D-05   
  7   7174.6847000             -1.18965609D-04   
  8   2739.9513000             -3.67077515D-04   
  9   1112.5550000             -1.05056222D-03   
 10    474.3496300             -2.80421233D-03   
 11    210.0073600             -6.92324663D-03   
 12     95.6309080             -1.53649303D-02   
 13     44.4427190             -2.90449264D-02   
 14     20.9491280             -3.95540640D-02   
 15      9.9692277             -1.55576205D-02   
 16      4.7731270              6.23463204D-02   
 17      2.2937812              1.60844002D-01   
 18      1.1046295              2.29381238D-01   
 19      0.53255201             7.74375900D-02   
 20      0.25688228            -2.99795263D-01   
 21      0.12393628            -5.39219539D-01   
 22      0.59798846E-01        -3.24463506D-01   
 23      0.28853202E-01        -3.52609864D-02   
P   16
  1   2739.9513000              5.38592503D-05   
  2   1112.5550000              1.49600574D-04   
  3    474.3496300              7.31669775D-04   
  4    210.0073600              2.67892319D-03   
  5     95.6309080              9.42919545D-03   
  6     44.4427190              2.93253497D-02   
  7     20.9491280              8.04973116D-02   
  8      9.9692277              1.78742505D-01   
  9      4.7731270              2.91631753D-01   
 10      2.2937812              3.38506448D-01   
 11      1.1046295              2.32128771D-01   
 12      0.53255201             6.09824820D-02   
 13      0.25688228             4.52879346D-03   
 14      0.12393628             6.01316209D-04   
 15      0.59798846E-01         1.81672657D-04   
 16      0.28853202E-01         1.85948165D-05   
P   16
  1   2739.9513000              9.70315400D-06   
  2   1112.5550000              2.67851382D-05   
  3    474.3496300              1.32037826D-04   
  4    210.0073600              4.81477215D-04   
  5     95.6309080              1.70721506D-03   
  6     44.4427190              5.32449087D-03   
  7     20.9491280              1.48516051D-02   
  8      9.9692277              3.34645152D-02   
  9      4.7731270              5.56172166D-02   
 10      2.2937812              6.70652756D-02   
 11      1.1046295              5.23815545D-02   
 12      0.53255201            -4.13111487D-02   
 13      0.25688228            -2.15774349D-01   
 14      0.12393628            -3.88585501D-01   
 15      0.59798846E-01        -3.62204428D-01   
 16      0.28853202E-01        -1.44262558D-01


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   23
  1 23376525.0000000            1.89509624D-07   
  2 4694045.0000000             1.09239919D-06   
  3 1076689.7000000             6.47199679D-06   
  4 279605.1500000              3.18067434D-05   
  5  81349.1250000              1.36513443D-04   
  6  26204.7080000              5.16032076D-04   
  7   9227.7394000              1.75236074D-03   
  8   3505.9512000              5.41589544D-03   
  9   1418.7245000              1.54314657D-02   
 10    604.0517500              4.04670361D-02   
 11    267.6328300              9.62393896D-02   
 12    122.2156300              1.97366439D-01   
 13     57.0628310              3.17716571D-01   
 14     27.0655430              3.21628754D-01   
 15     12.9761490              1.39634959D-01   
 16      6.2650213              1.43254034D-02   
 17      3.0380195              2.20351113D-03   
 18      1.4769351             -3.11505349D-04   
 19      0.71899652             4.62417617D-04   
 20      0.35025254            -2.89658829D-04   
 21      0.17067018             1.56786918D-04   
 22      0.83171700E-01        -7.39614966D-05   
 23      0.40532515E-01         1.85340174D-05   
S   23
  1 23376525.0000000            5.04224275D-08   
  2 4694045.0000000             2.90857110D-07   
  3 1076689.7000000             1.72177824D-06   
  4 279605.1500000              8.46981167D-06   
  5  81349.1250000              3.63220361D-05   
  6  26204.7080000              1.37526172D-04   
  7   9227.7394000              4.67059240D-04   
  8   3505.9512000              1.45074710D-03   
  9   1418.7245000              4.16067835D-03   
 10    604.0517500              1.11370454D-02   
 11    267.6328300              2.74905748D-02   
 12    122.2156300              6.13201437D-02   
 13     57.0628310              1.16468025D-01   
 14     27.0655430              1.64363180D-01   
 15     12.9761490              8.96256388D-02   
 16      6.2650213             -1.79643745D-01   
 17      3.0380195             -4.84111666D-01   
 18      1.4769351             -4.15864957D-01   
 19      0.71899652            -8.34901230D-02   
 20      0.35025254            -3.21862978D-03   
 21      0.17067018             5.20877220D-04   
 22      0.83171700E-01        -6.21396315D-04   
 23      0.40532515E-01         1.33593449D-04   
S   23
  1 23376525.0000000           -1.29179562D-08   
  2 4694045.0000000            -7.44881434D-08   
  3 1076689.7000000            -4.41144233D-07   
  4 279605.1500000             -2.16904716D-06   
  5  81349.1250000             -9.30687712D-06   
  6  26204.7080000             -3.52188067D-05   
  7   9227.7394000             -1.19704913D-04   
  8   3505.9512000             -3.71625716D-04   
  9   1418.7245000             -1.06751437D-03   
 10    604.0517500             -2.85870898D-03   
 11    267.6328300             -7.08794510D-03   
 12    122.2156300             -1.58941957D-02   
 13     57.0628310             -3.06826551D-02   
 14     27.0655430             -4.44651241D-02   
 15     12.9761490             -2.54103935D-02   
 16      6.2650213              5.56015864D-02   
 17      3.0380195              1.74400611D-01   
 18      1.4769351              2.66151485D-01   
 19      0.71899652             8.56274950D-02   
 20      0.35025254            -3.27081385D-01   
 21      0.17067018            -5.40657687D-01   
 22      0.83171700E-01        -3.12448683D-01   
 23      0.40532515E-01        -3.52809290D-02   
P   16
  1   3505.9512000              4.76724701D-05   
  2   1418.7245000              1.34090311D-04   
  3    604.0517500              6.54503826D-04   
  4    267.6328300              2.40348016D-03   
  5    122.2156300              8.48174291D-03   
  6     57.0628310              2.65569581D-02   
  7     27.0655430              7.36630013D-02   
  8     12.9761490              1.67848814D-01   
  9      6.2650213              2.84330892D-01   
 10      3.0380195              3.43568825D-01   
 11      1.4769351              2.43292456D-01   
 12      0.71899652             6.57742629D-02   
 13      0.35025254             5.08094691D-03   
 14      0.17067018             6.10553832D-04   
 15      0.83171700E-01         2.27608459D-04   
 16      0.40532515E-01         2.02150365D-05   
P   16
  1   3505.9512000              1.02050000D-05   
  2   1418.7245000              2.85780320D-05   
  3    604.0517500              1.40326086D-04   
  4    267.6328300              5.14025309D-04   
  5    122.2156300              1.82563016D-03   
  6     57.0628310              5.73964797D-03   
  7     27.0655430              1.61788340D-02   
  8     12.9761490              3.75411849D-02   
  9      6.2650213              6.49503895D-02   
 10      3.0380195              8.17334780D-02   
 11      1.4769351              6.26954086D-02   
 12      0.71899652            -5.73269797D-02   
 13      0.35025254            -2.59067625D-01   
 14      0.17067018            -4.06824496D-01   
 15      0.83171700E-01        -3.24624270D-01   
 16      0.40532515E-01        -1.06952516D-01


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHORUS
S   23
  1 28578316.0000000            1.74753230D-07   
  2 5799845.8000000             9.92035878D-07   
  3 1337455.4000000             5.86195945D-06   
  4 347673.6100000              2.88487018D-05   
  5 100925.8800000              1.24453471D-04   
  6  32369.2290000              4.73902603D-04   
  7  11337.5320000              1.62168218D-03   
  8   4284.5562000              5.04863895D-03   
  9   1726.0005000              1.44675914D-02   
 10    732.6285600              3.81310068D-02   
 11    324.1830200              9.11519610D-02   
 12    148.1304400              1.88633602D-01   
 13     69.3320800              3.09218551D-01   
 14     33.0196770              3.27040342D-01   
 15     15.9174040              1.55435079D-01   
 16      7.7354733              1.88683076D-02   
 17      3.7786579              2.28820199D-03   
 18      1.8515197             -3.07894176D-04   
 19      0.90879143             4.78347506D-04   
 20      0.44645285            -3.16690044D-04   
 21      0.21940782             1.66280550D-04   
 22      0.10784200            -8.04187894D-05   
 23      0.53007719E-01         1.98444917D-05   
S   23
  1 28578316.0000000            4.74340373D-08   
  2 5799845.8000000             2.69463300D-07   
  3 1337455.4000000             1.59094130D-06   
  4 347673.6100000              7.83700298D-06   
  5 100925.8800000              3.37809146D-05   
  6  32369.2290000              1.28838332D-04   
  7  11337.5320000              4.40903905D-04   
  8   4284.5562000              1.37923104D-03   
  9   1726.0005000              3.97707398D-03   
 10    732.6285600              1.06911865D-02   
 11    324.1830200              2.64888532D-02   
 12    148.1304400              5.94389231D-02   
 13     69.3320800              1.14088954D-01   
 14     33.0196770              1.65759644D-01   
 15     15.9174040              1.04262956D-01   
 16      7.7354733             -1.55585656D-01   
 17      3.7786579             -4.79667833D-01   
 18      1.8515197             -4.34922296D-01   
 19      0.90879143            -9.36872356D-02   
 20      0.44645285            -4.31800947D-03   
 21      0.21940782             2.72261836D-04   
 22      0.10784200            -6.75420715D-04   
 23      0.53007719E-01         1.28564885D-04   
S   23
  1 28578316.0000000           -1.30319188D-08   
  2 5799845.8000000            -7.40082103D-08   
  3 1337455.4000000            -4.37119746D-07   
  4 347673.6100000             -2.15239309D-06   
  5 100925.8800000             -9.28203002D-06   
  6  32369.2290000             -3.53848437D-05   
  7  11337.5320000             -1.21175256D-04   
  8   4284.5562000             -3.78917900D-04   
  9   1726.0005000             -1.09420910D-03   
 10    732.6285600             -2.94339305D-03   
 11    324.1830200             -7.32423878D-03   
 12    148.1304400             -1.65286954D-02   
 13     69.3320800             -3.22403540D-02   
 14     33.0196770             -4.81487927D-02   
 15     15.9174040             -3.17762786D-02   
 16      7.7354733              5.17478015D-02   
 17      3.7786579              1.87213331D-01   
 18      1.8515197              2.93994764D-01   
 19      0.90879143             8.19697854D-02   
 20      0.44645285            -3.50297927D-01   
 21      0.21940782            -5.39448109D-01   
 22      0.10784200            -3.00265283D-01   
 23      0.53007719E-01        -3.39506941D-02   
P   16
  1   4284.5562000              4.45566997D-05   
  2   1726.0005000              1.27393493D-04   
  3    732.6285600              6.21771106D-04   
  4    324.1830200              2.29364482D-03   
  5    148.1304400              8.11241774D-03   
  6     69.3320800              2.54923203D-02   
  7     33.0196770              7.10126092D-02   
  8     15.9174040              1.63552122D-01   
  9      7.7354733              2.82033482D-01   
 10      3.7786579              3.46783423D-01   
 11      1.8515197              2.45606872D-01   
 12      0.90879143             6.53254802D-02   
 13      0.44645285             5.10886065D-03   
 14      0.21940782             3.84314049D-04   
 15      0.10784200             1.75327147D-04   
 16      0.53007719E-01        -2.29049810D-05   
P   16
  1   4284.5562000              1.06031434D-05   
  2   1726.0005000              3.02355004D-05   
  3    732.6285600              1.48177120D-04   
  4    324.1830200              5.46109963D-04   
  5    148.1304400              1.94214956D-03   
  6     69.3320800              6.13643467D-03   
  7     33.0196770              1.73730818D-02   
  8     15.9174040              4.08679464D-02   
  9      7.7354733              7.21453789D-02   
 10      3.7786579              9.27782548D-02   
 11      1.8515197              6.78925307D-02   
 12      0.90879143            -7.56205817D-02   
 13      0.44645285            -2.91266552D-01   
 14      0.21940782            -4.11228792D-01   
 15      0.10784200            -2.94136557D-01   
 16      0.53007719E-01        -8.55927616D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   23
  1 32280958.0000000            1.76030531D-07   
  2 6606575.8000000             9.87410232D-07   
  3 1529008.4000000             5.83020353D-06   
  4 397307.3400000              2.87793362D-05   
  5 114926.0400000              1.25009740D-04   
  6  36648.6950000              4.80340986D-04   
  7  12747.3240000              1.66012039D-03   
  8   4782.2340000              5.21709389D-03   
  9   1913.2413000              1.50665033D-02   
 10    807.3228900              3.98970900D-02   
 11    355.6173000              9.54038798D-02   
 12    162.0091300              1.96157247D-01   
 13     75.7200530              3.15892182D-01   
 14     36.0628470              3.21527912D-01   
 15     17.4065730              1.43123952D-01   
 16      8.4785591              1.56511515D-02   
 17      4.1543358              2.07443866D-03   
 18      2.0429558             -3.46138837D-04   
 19      1.0067406              4.17731847D-04   
 20      0.49664328            -2.94296715D-04   
 21      0.24512368             1.47935459D-04   
 22      0.12100584            -7.27763823D-05   
 23      0.59737830E-01         1.77240665D-05   
S   23
  1 32280958.0000000           -4.86096599D-08   
  2 6606575.8000000            -2.72822926D-07   
  3 1529008.4000000            -1.60981980D-06   
  4 397307.3400000             -7.95258996D-06   
  5 114926.0400000             -3.45224656D-05   
  6  36648.6950000             -1.32831285D-04   
  7  12747.3240000             -4.59248720D-04   
  8   4782.2340000             -1.44987259D-03   
  9   1913.2413000             -4.21626219D-03   
 10    807.3228900             -1.13923897D-02   
 11    355.6173000             -2.83048613D-02   
 12    162.0091300             -6.33368825D-02   
 13     75.7200530             -1.20559116D-01   
 14     36.0628470             -1.70147261D-01   
 15     17.4065730             -9.50939802D-02   
 16      8.4785591              1.84547819D-01   
 17      4.1543358              5.07540599D-01   
 18      2.0429558              4.04268844D-01   
 19      1.0067406              6.88612269D-02   
 20      0.49664328             5.22668719D-03   
 21      0.24512368            -1.03349703D-03   
 22      0.12100584             1.06334387D-03   
 23      0.59737830E-01        -2.22113293D-04   
S   23
  1 32280958.0000000           -1.41091775D-08   
  2 6606575.8000000            -7.92013869D-08   
  3 1529008.4000000            -4.67243054D-07   
  4 397307.3400000             -2.30870310D-06   
  5 114926.0400000             -1.00199950D-05   
  6  36648.6950000             -3.85653153D-05   
  7  12747.3240000             -1.33312608D-04   
  8   4782.2340000             -4.21147437D-04   
  9   1913.2413000             -1.22514928D-03   
 10    807.3228900             -3.31746755D-03   
 11    355.6173000             -8.26823330D-03   
 12    162.0091300             -1.86552207D-02   
 13     75.7200530             -3.60597224D-02   
 14     36.0628470             -5.26479150D-02   
 15     17.4065730             -3.06049932D-02   
 16      8.4785591              6.49579639D-02   
 17      4.1543358              2.23528859D-01   
 18      2.0429558              3.13076801D-01   
 19      1.0067406              1.19464582D-02   
 20      0.49664328            -4.24659315D-01   
 21      0.24512368            -5.25079416D-01   
 22      0.12100584            -2.33068294D-01   
 23      0.59737830E-01        -1.94438761D-02   
P   16
  1   4782.2340000              4.77633605D-05   
  2   1913.2413000              1.39691082D-04   
  3    807.3228900              6.84509276D-04   
  4    355.6173000              2.53951669D-03   
  5    162.0091300              9.00488557D-03   
  6     75.7200530              2.82140420D-02   
  7     36.0628470              7.80722577D-02   
  8     17.4065730              1.76297812D-01   
  9      8.4785591              2.96765447D-01   
 10      4.1543358              3.48646742D-01   
 11      2.0429558              2.19943506D-01   
 12      1.0067406              4.76309675D-02   
 13      0.49664328             3.93619809D-03   
 14      0.24512368             2.89282462D-04   
 15      0.12100584             4.74735422D-04   
 16      0.59737830E-01        -6.32700233D-06   
P   16
  1   4782.2340000              1.21525159D-05   
  2   1913.2413000              3.56479282D-05   
  3    807.3228900              1.74337893D-04   
  4    355.6173000              6.49458726D-04   
  5    162.0091300              2.30782560D-03   
  6     75.7200530              7.30213097D-03   
  7     36.0628470              2.05224800D-02   
  8     17.4065730              4.75644961D-02   
  9      8.4785591              8.19736469D-02   
 10      4.1543358              1.02657039D-01   
 11      2.0429558              5.52054579D-02   
 12      1.0067406             -1.28660380D-01   
 13      0.49664328            -3.27899080D-01   
 14      0.24512368            -3.88587065D-01   
 15      0.12100584            -2.53698884D-01   
 16      0.59737830E-01        -7.10414125D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   23
  1 36414299.0000000            1.75659213D-07   
  2 7544906.8000000             9.67052410D-07   
  3 1759266.2000000             5.68042603D-06   
  4 458649.4800000              2.79903975D-05   
  5 132659.6100000              1.21890812D-04   
  6  42194.5170000              4.70814228D-04   
  7  14614.8160000              1.63811777D-03   
  8   5455.7400000              5.18417186D-03   
  9   2171.9126000              1.50650984D-02   
 10    912.5077500              4.00845281D-02   
 11    400.6316100              9.61042973D-02   
 12    182.1553100              1.97610497D-01   
 13     85.0861920              3.17072651D-01   
 14     40.5546250              3.20244786D-01   
 15     19.6133330              1.41186619D-01   
 16      9.5820439              1.52773061D-02   
 17      4.7128247              1.97705392D-03   
 18      2.3277462             -3.67284758D-04   
 19      1.1525590              3.88550939D-04   
 20      0.57143297            -2.90676308D-04   
 21      0.28349078             1.40800476D-04   
 22      0.14067574            -7.05347339D-05   
 23      0.69812057E-01         1.69668918D-05   
S   23
  1 36414299.0000000           -4.92300299D-08   
  2 7544906.8000000            -2.71147251D-07   
  3 1759266.2000000            -1.59187682D-06   
  4 458649.4800000             -7.84879787D-06   
  5 132659.6100000             -3.41641568D-05   
  6  42194.5170000             -1.32115241D-04   
  7  14614.8160000             -4.59943949D-04   
  8   5455.7400000             -1.46189563D-03   
  9   2171.9126000             -4.27943251D-03   
 10    912.5077500             -1.16167564D-02   
 11    400.6316100             -2.89681074D-02   
 12    182.1553100             -6.48837535D-02   
 13     85.0861920             -1.23438218D-01   
 14     40.5546250             -1.72929423D-01   
 15     19.6133330             -9.43800805D-02   
 16      9.5820439              1.94368683D-01   
 17      4.7128247              5.20266384D-01   
 18      2.3277462              3.91104097D-01   
 19      1.1525590              6.06665752D-02   
 20      0.57143297             5.95290509D-03   
 21      0.28349078            -1.20323620D-03   
 22      0.14067574             1.19935287D-03   
 23      0.69812057E-01        -2.48019655D-04   
S   23
  1 36414299.0000000           -1.48907070D-08   
  2 7544906.8000000            -8.20534823D-08   
  3 1759266.2000000            -4.81454592D-07   
  4 458649.4800000             -2.37525521D-06   
  5 132659.6100000             -1.03324630D-05   
  6  42194.5170000             -3.99867184D-05   
  7  14614.8160000             -1.39114994D-04   
  8   5455.7400000             -4.42716539D-04   
  9   2171.9126000             -1.29561775D-03   
 10    912.5077500             -3.52762512D-03   
 11    400.6316100             -8.81807375D-03   
 12    182.1553100             -1.99459132D-02   
 13     85.0861920             -3.85152006D-02   
 14     40.5546250             -5.60372289D-02   
 15     19.6133330             -3.16507039D-02   
 16      9.5820439              7.15050140D-02   
 17      4.7128247              2.48551064D-01   
 18      2.3277462              3.23751461D-01   
 19      1.1525590             -3.04450802D-02   
 20      0.57143297            -4.57896088D-01   
 21      0.28349078            -5.09466649D-01   
 22      0.14067574            -2.03375639D-01   
 23      0.69812057E-01        -1.53100276D-02   
P   16
  1   5455.7400000              4.83649934D-05   
  2   2171.9126000              1.43781207D-04   
  3    912.5077500              7.07105990D-04   
  4    400.6316100              2.63689697D-03   
  5    182.1553100              9.38268931D-03   
  6     85.0861920              2.94023740D-02   
  7     40.5546250              8.12287573D-02   
  8     19.6133330              1.82042736D-01   
  9      9.5820439              3.04085256D-01   
 10      4.7128247              3.48852034D-01   
 11      2.3277462              2.06025883D-01   
 12      1.1525590              4.01698380D-02   
 13      0.57143297             3.73365066D-03   
 14      0.28349078             4.05960354D-04   
 15      0.14067574             6.54597500D-04   
 16      0.69812057E-01         2.12226118D-05   
P   16
  1   5455.7400000              1.29978700D-05   
  2   2171.9126000              3.88677325D-05   
  3    912.5077500              1.90194381D-04   
  4    400.6316100              7.14037666D-04   
  5    182.1553100              2.54201595D-03   
  6     85.0861920              8.06368119D-03   
  7     40.5546250              2.26246665D-02   
  8     19.6133330              5.22045535D-02   
  9      9.5820439              8.94331087D-02   
 10      4.7128247              1.10307310D-01   
 11      2.3277462              4.44497948D-02   
 12      1.1525590             -1.61593638D-01   
 13      0.57143297            -3.44386399D-01   
 14      0.28349078            -3.73608438D-01   
 15      0.14067574            -2.29905721D-01   
 16      0.69812057E-01        -6.24540079D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ar
data:
ARGON
S   23
  1 42167954.0000000            1.68684940D-07   
  2 8762963.1000000             9.24938332D-07   
  3 2044974.7000000             5.43624430D-06   
  4 532637.4400000              2.68503834D-05   
  5 153710.2400000              1.17380437D-04   
  6  48735.8910000              4.55571143D-04   
  7  16820.0840000              1.59301084D-03   
  8   6256.4667000              5.06553649D-03   
  9   2482.6632000              1.47800687D-02   
 10   1040.3915000              3.94597555D-02   
 11    455.9942700              9.48755860D-02   
 12    207.1676400              1.95695430D-01   
 13     96.7881310              3.15364753D-01   
 14     46.1825850              3.21550503D-01   
 15     22.3773990              1.44681475D-01   
 16     10.9603360              1.62235783D-02   
 17      5.4072874              1.95149954D-03   
 18      2.6799809             -3.95165165D-04   
 19      1.3318957              3.82503153D-04   
 20      0.66290901            -3.02207484D-04   
 21      0.33017812             1.42444803D-04   
 22      0.16450060            -7.24345077D-05   
 23      0.81964165E-01         1.72815550D-05   
S   23
  1 42167954.0000000           -4.78857809D-08   
  2 8762963.1000000            -2.62667335D-07   
  3 2044974.7000000            -1.54313921D-06   
  4 532637.4400000             -7.62569066D-06   
  5 153710.2400000             -3.33253823D-05   
  6  48735.8910000             -1.29474001D-04   
  7  16820.0840000             -4.53056270D-04   
  8   6256.4667000             -1.44660114D-03   
  9   2482.6632000             -4.25231334D-03   
 10   1040.3915000             -1.15786013D-02   
 11    455.9942700             -2.89577249D-02   
 12    207.1676400             -6.50282665D-02   
 13     96.7881310             -1.24172702D-01   
 14     46.1825850             -1.74953325D-01   
 15     22.3773990             -9.85826564D-02   
 16     10.9603360              1.93437255D-01   
 17      5.4072874              5.26755866D-01   
 18      2.6799809              3.88761632D-01   
 19      1.3318957              5.89886870D-02   
 20      0.66290901             6.55371792D-03   
 21      0.33017812            -1.18394491D-03   
 22      0.16450060             1.26192205D-03   
 23      0.81964165E-01        -2.55394355D-04   
S   23
  1 42167954.0000000           -1.49605952D-08   
  2 8762963.1000000            -8.21172905D-08   
  3 2044974.7000000            -4.82051196D-07   
  4 532637.4400000             -2.38411233D-06   
  5 153710.2400000             -1.04098364D-05   
  6  48735.8910000             -4.04851231D-05   
  7  16820.0840000             -1.41528865D-04   
  8   6256.4667000             -4.52615326D-04   
  9   2482.6632000             -1.32962661D-03   
 10   1040.3915000             -3.63313338D-03   
 11    455.9942700             -9.10477630D-03   
 12    207.1676400             -2.06659109D-02   
 13     96.7881310             -4.00397399D-02   
 14     46.1825850             -5.87160967D-02   
 15     22.3773990             -3.41972231D-02   
 16     10.9603360              7.36411905D-02   
 17      5.4072874              2.65969154D-01   
 18      2.6799809              3.32750621D-01   
 19      1.3318957             -5.47497974D-02   
 20      0.66290901            -4.74255314D-01   
 21      0.33017812            -4.99567255D-01   
 22      0.16450060            -1.89369185D-01   
 23      0.81964165E-01        -1.37909879D-02   
P   16
  1   6256.4667000              4.77838280D-05   
  2   2482.6632000              1.43532626D-04   
  3   1040.3915000              7.07402623D-04   
  4    455.9942700              2.64651240D-03   
  5    207.1676400              9.44508415D-03   
  6     96.7881310              2.96495859D-02   
  7     46.1825850              8.20548916D-02   
  8     22.3773990              1.83954462D-01   
  9     10.9603360              3.07863500D-01   
 10      5.4072874              3.49884080D-01   
 11      2.6799809              1.99277871D-01   
 12      1.3318957              3.64698939D-02   
 13      0.66290901             2.98519986D-03   
 14      0.33017812            -2.42533690D-04   
 15      0.16450060             2.97396001D-04   
 16      0.81964165E-01        -8.04164883D-05   
P   16
  1   6256.4667000              1.33087186D-05   
  2   2482.6632000              4.02680988D-05   
  3   1040.3915000              1.97187336D-04   
  4    455.9942700              7.43644064D-04   
  5    207.1676400              2.65352147D-03   
  6     96.7881310              8.44333638D-03   
  7     46.1825850              2.37391272D-02   
  8     22.3773990              5.49191423D-02   
  9     10.9603360              9.44951241D-02   
 10      5.4072874              1.15817445D-01   
 11      2.6799809              3.65287605D-02   
 12      1.3318957             -1.82883300D-01   
 13      0.66290901            -3.53984379D-01   
 14      0.33017812            -3.63855717D-01   
 15      0.16450060            -2.14166136D-01   
 16      0.81964165E-01        -5.63510565D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   26
  1 45541929.0000000            1.74040033D-07   
  2 9727872.5000000             9.12389454D-07   
  3 2319268.4000000             5.25592910D-06   
  4 613552.7000000              2.55256299D-05   
  5 178871.6200000              1.10579284D-04   
  6  57024.9640000              4.27711170D-04   
  7  19713.5360000              1.49718655D-03   
  8   7324.4672000              4.78092869D-03   
  9   2898.3116000              1.40307116D-02   
 10   1210.4578000              3.77089483D-02   
 11    528.9550700              9.12958546D-02   
 12    239.9027400              1.89891121D-01   
 13    112.1023100              3.09896409D-01   
 14     53.6236210              3.24873324D-01   
 15     26.1135430              1.55296746D-01   
 16     12.8870570              1.97309687D-02   
 17      6.4211480              2.01935435D-03   
 18      3.2209352             -4.00943873D-04   
 19      1.6229457              4.29857318D-04   
 20      0.82011791            -3.81726006D-04   
 21      0.41514963             2.29594008D-04   
 22      0.21035757            -1.68690532D-04   
 23      0.10664212             1.05250077D-04   
 24      0.54075001E-01        -5.92558848D-05   
 25      0.27422050E-01         2.60299374D-05   
 26      0.13906338E-01        -6.42668512D-06   
S   26
  1 45541929.0000000           -4.99844042D-08   
  2 9727872.5000000            -2.62133424D-07   
  3 2319268.4000000            -1.50942336D-06   
  4 613552.7000000             -7.33418321D-06   
  5 178871.6200000             -3.17619706D-05   
  6  57024.9640000             -1.22972727D-04   
  7  19713.5360000             -4.30758833D-04   
  8   7324.4672000             -1.38094963D-03   
  9   2898.3116000             -4.08197408D-03   
 10   1210.4578000             -1.11813760D-02   
 11    528.9550700             -2.81298027D-02   
 12    239.9027400             -6.35536686D-02   
 13    112.1023100             -1.22294570D-01   
 14     53.6236210             -1.75517492D-01   
 15     26.1135430             -1.09172207D-01   
 16     12.8870570              1.71668243D-01   
 17      6.4211480              5.15098664D-01   
 18      3.2209352              4.08995013D-01   
 19      1.6229457              7.28207453D-02   
 20      0.82011791             7.82800067D-03   
 21      0.41514963            -1.80577072D-03   
 22      0.21035757             2.33047543D-03   
 23      0.10664212            -1.40883200D-03   
 24      0.54075001E-01         8.20451373D-04   
 25      0.27422050E-01        -3.68978363D-04   
 26      0.13906338E-01         9.05368239D-05   
S   26
  1 45541929.0000000           -1.64663235D-08   
  2 9727872.5000000            -8.64180617D-08   
  3 2319268.4000000            -4.97176829D-07   
  4 613552.7000000             -2.41797831D-06   
  5 178871.6200000             -1.04613516D-05   
  6  57024.9640000             -4.05484652D-05   
  7  19713.5360000             -1.41885590D-04   
  8   7324.4672000             -4.55627568D-04   
  9   2898.3116000             -1.34581103D-03   
 10   1210.4578000             -3.69980330D-03   
 11    528.9550700             -9.32592064D-03   
 12    239.9027400             -2.13016634D-02   
 13    112.1023100             -4.15853871D-02   
 14     53.6236210             -6.21507444D-02   
 15     26.1135430             -4.00580660D-02   
 16     12.8870570              6.87422121D-02   
 17      6.4211480              2.73504653D-01   
 18      3.2209352              3.57383849D-01   
 19      1.6229457             -2.76849585D-02   
 20      0.82011791            -4.89019895D-01   
 21      0.41514963            -5.31002124D-01   
 22      0.21035757            -1.73606598D-01   
 23      0.10664212            -6.36779177D-03   
 24      0.54075001E-01        -1.42309921D-03   
 25      0.27422050E-01         1.86245879D-04   
 26      0.13906338E-01        -2.33894583D-04   
S   26
  1 45541929.0000000            3.17952098D-09   
  2 9727872.5000000             1.66855872D-08   
  3 2319268.4000000             9.60022815D-08   
  4 613552.7000000              4.66861691D-07   
  5 178871.6200000              2.02004884D-06   
  6  57024.9640000              7.82906192D-06   
  7  19713.5360000              2.73983845D-05   
  8   7324.4672000              8.79752675D-05   
  9   2898.3116000              2.59914342D-04   
 10   1210.4578000              7.14565758D-04   
 11    528.9550700              1.80226439D-03   
 12    239.9027400              4.11940058D-03   
 13    112.1023100              8.05924973D-03   
 14     53.6236210              1.20850325D-02   
 15     26.1135430              7.84107916D-03   
 16     12.8870570             -1.35762027D-02   
 17      6.4211480             -5.57294740D-02   
 18      3.2209352             -7.68042099D-02   
 19      1.6229457              1.08045746D-02   
 20      0.82011791             1.19976199D-01   
 21      0.41514963             1.68254333D-01   
 22      0.21035757             1.70865946D-01   
 23      0.10664212             5.86831417D-02   
 24      0.54075001E-01        -3.45250979D-01   
 25      0.27422050E-01        -6.06215493D-01   
 26      0.13906338E-01        -2.37236435D-01   
P   16
  1   7324.4672000              4.48595446D-05   
  2   2898.3116000              1.36310820D-04   
  3   1210.4578000              6.74334008D-04   
  4    528.9550700              2.54183735D-03   
  5    239.9027400              9.11314301D-03   
  6    112.1023100              2.87040476D-02   
  7     53.6236210              7.95638101D-02   
  8     26.1135430              1.79131175D-01   
  9     12.8870570              3.02580364D-01   
 10      6.4211480              3.49339500D-01   
 11      3.2209352              2.06020272D-01   
 12      1.6229457              4.12207846D-02   
 13      0.82011791             3.30286560D-03   
 14      0.41514963            -1.97278522D-04   
 15      0.21035757             2.60641399D-04   
 16      0.10664212            -8.41735878D-05   
P   16
  1   7324.4672000              1.36360556D-05   
  2   2898.3116000              4.16963919D-05   
  3   1210.4578000              2.05180493D-04   
  4    528.9550700              7.79011906D-04   
  5    239.9027400              2.79486570D-03   
  6    112.1023100              8.92047809D-03   
  7     53.6236210              2.51455090D-02   
  8     26.1135430              5.84699675D-02   
  9     12.8870570              1.01806138D-01   
 10      6.4211480              1.26536979D-01   
 11      3.2209352              4.31085900D-02   
 12      1.6229457             -1.89972171D-01   
 13      0.82011791            -3.75470665D-01   
 14      0.41514963            -3.79212886D-01   
 15      0.21035757            -1.80003858D-01   
 16      0.10664212            -3.40695477D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   26
  1 53505253.0000000            1.62160749D-07   
  2 11371432.0000000            8.57361463D-07   
  3 2699633.4000000             4.95983961D-06   
  4 711711.5300000              2.41874355D-05   
  5 206930.7100000              1.05082125D-04   
  6  65841.1220000              4.07285754D-04   
  7  22732.1380000              1.42733354D-03   
  8   8440.3762000              4.56091549D-03   
  9   3339.4469000              1.33899126D-02   
 10   1395.1510000              3.60243617D-02   
 11    610.0917100              8.74666744D-02   
 12    276.9778000              1.83242588D-01   
 13    129.5852200              3.03621314D-01   
 14     62.0725250              3.28764577D-01   
 15     30.2733760              1.66818285D-01   
 16     14.9634950              2.34130820D-02   
 17      7.4678575              2.08454603D-03   
 18      3.7521526             -3.97522858D-04   
 19      1.8937514              4.35142267D-04   
 20      0.95855642            -3.99781804D-04   
 21      0.48603616             2.41150379D-04   
 22      0.24668572            -1.76399414D-04   
 23      0.12526678             1.10807662D-04   
 24      0.63624508E-01        -6.23907513D-05   
 25      0.32318284E-01         2.73283503D-05   
 26      0.16416536E-01        -6.77098112D-06   
S   26
  1 53505253.0000000           -4.70634118D-08   
  2 11371432.0000000           -2.48924268D-07   
  3 2699633.4000000            -1.43939411D-06   
  4 711711.5300000             -7.02305087D-06   
  5 206930.7100000             -3.05006538D-05   
  6  65841.1220000             -1.18334304D-04   
  7  22732.1380000             -4.14958440D-04   
  8   8440.3762000             -1.33110188D-03   
  9   3339.4469000             -3.93490170D-03   
 10   1395.1510000             -1.07842591D-02   
 11    610.0917100             -2.71733050D-02   
 12    276.9778000             -6.16837636D-02   
 13    129.5852200             -1.19818045D-01   
 14     62.0725250             -1.75997661D-01   
 15     30.2733760             -1.19626531D-01   
 16     14.9634950              1.54214033D-01   
 17      7.4678575              5.11859502D-01   
 18      3.7521526              4.23297791D-01   
 19      1.8937514              7.97447622D-02   
 20      0.95855642             8.17901154D-03   
 21      0.48603616            -1.76318617D-03   
 22      0.24668572             2.23959188D-03   
 23      0.12526678            -1.39172988D-03   
 24      0.63624508E-01         8.10349079D-04   
 25      0.32318284E-01        -3.60878276D-04   
 26      0.16416536E-01         9.02653466D-05   
S   26
  1 53505253.0000000           -1.62238145D-08   
  2 11371432.0000000           -8.58860966D-08   
  3 2699633.4000000            -4.96106055D-07   
  4 711711.5300000             -2.42327908D-06   
  5 206930.7100000             -1.05118324D-05   
  6  65841.1220000             -4.08377361D-05   
  7  22732.1380000             -1.43016478D-04   
  8   8440.3762000             -4.59667967D-04   
  9   3339.4469000             -1.35739739D-03   
 10   1395.1510000             -3.73507544D-03   
 11    610.0917100             -9.42546571D-03   
 12    276.9778000             -2.16427911D-02   
 13    129.5852200             -4.26198094D-02   
 14     62.0725250             -6.52536228D-02   
 15     30.2733760             -4.59785606D-02   
 16     14.9634950              6.43291717D-02   
 17      7.4678575              2.85600262D-01   
 18      3.7521526              3.81600165D-01   
 19      1.8937514             -2.31031796D-02   
 20      0.95855642            -5.34759005D-01   
 21      0.48603616            -5.41928818D-01   
 22      0.24668572            -1.31521440D-01   
 23      0.12526678            -4.43552536D-03   
 24      0.63624508E-01         4.50308369D-04   
 25      0.32318284E-01        -3.16987066D-04   
 26      0.16416536E-01         9.43869985D-05   
S   26
  1 53505253.0000000            3.87383788D-09   
  2 11371432.0000000            2.05047778D-08   
  3 2699633.4000000             1.18460642D-07   
  4 711711.5300000              5.78539630D-07   
  5 206930.7100000              2.51005959D-06   
  6  65841.1220000              9.74962268D-06   
  7  22732.1380000              3.41515372D-05   
  8   8440.3762000              1.09744553D-04   
  9   3339.4469000              3.24195155D-04   
 10   1395.1510000              8.91992369D-04   
 11    610.0917100              2.25287415D-03   
 12    276.9778000              5.17614516D-03   
 13    129.5852200              1.02208429D-02   
 14     62.0725250              1.57039600D-02   
 15     30.2733760              1.11623449D-02   
 16     14.9634950             -1.57776556D-02   
 17      7.4678575             -7.25464644D-02   
 18      3.7521526             -1.03031611D-01   
 19      1.8937514              1.29422955D-02   
 20      0.95855642             1.66132828D-01   
 21      0.48603616             2.63515713D-01   
 22      0.24668572             1.88069313D-01   
 23      0.12526678            -1.40008170D-01   
 24      0.63624508E-01        -5.03590722D-01   
 25      0.32318284E-01        -4.82697939D-01   
 26      0.16416536E-01        -1.02274416D-01   
P   16
  1   8440.3762000              4.27821556D-05   
  2   3339.4469000              1.30018455D-04   
  3   1395.1510000              6.43070566D-04   
  4    610.0917100              2.42432287D-03   
  5    276.9778000              8.70931826D-03   
  6    129.5852200              2.75441964D-02   
  7     62.0725250              7.68661602D-02   
  8     30.2733760              1.75115695D-01   
  9     14.9634950              3.00538876D-01   
 10      7.4678575              3.52182741D-01   
 11      3.7521526              2.10043505D-01   
 12      1.8937514              4.25134300D-02   
 13      0.95855642             3.26696303D-03   
 14      0.48603616            -2.42728962D-04   
 15      0.24668572             2.38585758D-04   
 16      0.12526678            -9.71284328D-05   
P   16
  1   8440.3762000              1.38888133D-05   
  2   3339.4469000              4.25481722D-05   
  3   1395.1510000              2.08944579D-04   
  4    610.0917100              7.94595459D-04   
  5    276.9778000              2.85340138D-03   
  6    129.5852200              9.15469536D-03   
  7     62.0725250              2.59682108D-02   
  8     30.2733760              6.12196970D-02   
  9     14.9634950              1.08438954D-01   
 10      7.4678575              1.36984232D-01   
 11      3.7521526              4.52639942D-02   
 12      1.8937514             -2.07219652D-01   
 13      0.95855642            -4.07447550D-01   
 14      0.48603616            -3.77995890D-01   
 15      0.24668572            -1.37308303D-01   
 16      0.12526678            -2.16010684D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Sc
data:
SCANDIUM
S   26
  1 27624024.0000000            4.19417704D-07   
  2 5892699.9000000             2.18725725D-06   
  3 1424192.1000000             1.22595609D-05   
  4 386819.1700000              5.69967190D-05   
  5 116960.9700000              2.33594769D-04   
  6  38960.3140000              8.47419613D-04   
  7  14138.2140000              2.76738814D-03   
  8   5525.3488000              8.22157448D-03   
  9   2299.1501000              2.23914861D-02   
 10   1007.6090000              5.56170011D-02   
 11    460.4504700              1.23236986D-01   
 12    217.4553600              2.30471471D-01   
 13    105.3232100              3.25458681D-01   
 14     51.9840080              2.75441734D-01   
 15     26.0114450              9.69356474D-02   
 16     13.1416580              8.26044084D-03   
 17      6.6832952              1.13438232D-03   
 18      3.4135234             -1.96409863D-04   
 19      1.7481912              1.14040752D-04   
 20      0.89675308            -1.46308436D-04   
 21      0.46041065             6.85746347D-05   
 22      0.23649218            -5.23966399D-05   
 23      0.12150088             3.21762633D-05   
 24      0.62427778E-01        -1.79307028D-05   
 25      0.32076543E-01         7.76848770D-06   
 26      0.16481611E-01        -1.90054988D-06   
S   26
  1 27624024.0000000           -1.22911867D-07   
  2 5892699.9000000            -6.40800037D-07   
  3 1424192.1000000            -3.59305661D-06   
  4 386819.1700000             -1.66997542D-05   
  5 116960.9700000             -6.84909084D-05   
  6  38960.3140000             -2.48546530D-04   
  7  14138.2140000             -8.13866864D-04   
  8   5525.3488000             -2.42889571D-03   
  9   2299.1501000             -6.69993315D-03   
 10   1007.6090000             -1.70617051D-02   
 11    460.4504700             -3.99257383D-02   
 12    217.4553600             -8.29469531D-02   
 13    105.3232100             -1.44677407D-01   
 14     51.9840080             -1.72370177D-01   
 15     26.0114450             -4.69396707D-02   
 16     13.1416580              2.86993688D-01   
 17      6.6832952              5.44436951D-01   
 18      3.4135234              2.95896960D-01   
 19      1.7481912              3.44208457D-02   
 20      0.89675308             5.13111218D-03   
 21      0.46041065            -1.10160097D-03   
 22      0.23649218             1.30069835D-03   
 23      0.12150088            -7.83338450D-04   
 24      0.62427778E-01         4.46437606D-04   
 25      0.32076543E-01        -1.95388625D-04   
 26      0.16481611E-01         4.81108634D-05   
S   26
  1 27624024.0000000           -4.32822283D-08   
  2 5892699.9000000            -2.25807069D-07   
  3 1424192.1000000            -1.26507008D-06   
  4 386819.1700000             -5.88516953D-06   
  5 116960.9700000             -2.41132487D-05   
  6  38960.3140000             -8.76129898D-05   
  7  14138.2140000             -2.86570738D-04   
  8   5525.3488000             -8.57069215D-04   
  9   2299.1501000             -2.36277414D-03   
 10   1007.6090000             -6.04719457D-03   
 11    460.4504700             -1.41952580D-02   
 12    217.4553600             -2.99406132D-02   
 13    105.3232100             -5.32589939D-02   
 14     51.9840080             -6.67921091D-02   
 15     26.0114450             -1.83652602D-02   
 16     13.1416580              1.32147112D-01   
 17      6.6832952              3.64962612D-01   
 18      3.4135234              3.02815317D-01   
 19      1.7481912             -2.12610748D-01   
 20      0.89675308            -6.06212706D-01   
 21      0.46041065            -4.17518380D-01   
 22      0.23649218            -5.87785951D-02   
 23      0.12150088            -5.12281600D-03   
 24      0.62427778E-01         2.34546307D-03   
 25      0.32076543E-01        -1.12378238D-03   
 26      0.16481611E-01         2.88325164D-04   
S   26
  1 27624024.0000000           -1.02686298D-08   
  2 5892699.9000000            -5.35771206D-08   
  3 1424192.1000000            -3.00129691D-07   
  4 386819.1700000             -1.39638507D-06   
  5 116960.9700000             -5.72066353D-06   
  6  38960.3140000             -2.07887819D-05   
  7  14138.2140000             -6.79875065D-05   
  8   5525.3488000             -2.03391544D-04   
  9   2299.1501000             -5.60664876D-04   
 10   1007.6090000             -1.43586311D-03   
 11    460.4504700             -3.37184632D-03   
 12    217.4553600             -7.12551300D-03   
 13    105.3232100             -1.27062131D-02   
 14     51.9840080             -1.60380827D-02   
 15     26.0114450             -4.42261278D-03   
 16     13.1416580              3.24370685D-02   
 17      6.6832952              9.45356317D-02   
 18      3.4135234              8.12880198D-02   
 19      1.7481912             -6.75908863D-02   
 20      0.89675308            -2.03645762D-01   
 21      0.46041065            -2.59434790D-01   
 22      0.23649218            -1.04934173D-01   
 23      0.12150088             2.27631922D-01   
 24      0.62427778E-01         5.22909073D-01   
 25      0.32076543E-01         4.04945042D-01   
 26      0.16481611E-01         6.67092763D-02   
P   17
  1  14138.2140000              2.10038753D-05   
  2   5525.3488000              6.67230197D-05   
  3   2299.1501000              3.25509981D-04   
  4   1007.6090000              1.24001120D-03   
  5    460.4504700              4.46794965D-03   
  6    217.4553600              1.45402792D-02   
  7    105.3232100              4.23467083D-02   
  8     51.9840080              1.07597126D-01   
  9     26.0114450              2.17927319D-01   
 10     13.1416580              3.30383543D-01   
 11      6.6832952              3.18626547D-01   
 12      3.4135234              1.39708412D-01   
 13      1.7481912              1.94434694D-02   
 14      0.89675308             1.40572354D-03   
 15      0.46041065            -2.69133218D-05   
 16      0.23649218             9.76205675D-05   
 17      0.12150088            -3.67339887D-05   
P   17
  1  14138.2140000              7.05572058D-06   
  2   5525.3488000              2.23611170D-05   
  3   2299.1501000              1.09494218D-04   
  4   1007.6090000              4.16823361D-04   
  5    460.4504700              1.50988273D-03   
  6    217.4553600              4.93965027D-03   
  7    105.3232100              1.46061157D-02   
  8     51.9840080              3.80189240D-02   
  9     26.0114450              7.96465337D-02   
 10     13.1416580              1.26291658D-01   
 11      6.6832952              1.27125917D-01   
 12      3.4135234             -3.24214238D-02   
 13      1.7481912             -2.94563472D-01   
 14      0.89675308            -4.24340784D-01   
 15      0.46041065            -3.02039818D-01   
 16      0.23649218            -7.92859311D-02   
 17      0.12150088            -1.12365509D-02   
D   13
  1    217.4553600              1.78423697D-04   
  2    105.3232100              4.58764056D-04   
  3     51.9840080              2.28250239D-03   
  4     26.0114450              7.68398786D-03   
  5     13.1416580              2.24516901D-02   
  6      6.6832952              5.55668856D-02   
  7      3.4135234              1.22409706D-01   
  8      1.7481912              2.04487084D-01   
  9      0.89675308             2.66232286D-01   
 10      0.46041065             2.78619098D-01   
 11      0.23649218             2.30960503D-01   
 12      0.12150088             1.25642900D-01   
 13      0.62427778E-01         4.82123941D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ti
data:
TITANIUM
S   26
  1 31974270.0000000            3.92301821D-07   
  2 6845386.9000000             2.03408572D-06   
  3 1658413.9000000             1.13803759D-05   
  4 451045.7100000              5.28479386D-05   
  5 136451.1600000              2.16591940D-04   
  6  45447.7520000              7.86295282D-04   
  7  16484.0280000              2.57107161D-03   
  8   6437.5646000              7.65196252D-03   
  9   2676.7878000              2.08949108D-02   
 10   1172.4007000              5.21258434D-02   
 11    535.5498300              1.16423176D-01   
 12    252.8952000              2.20923438D-01   
 13    122.5117800              3.20802421D-01   
 14     60.4969480              2.86270245D-01   
 15     30.2937540              1.10305645D-01   
 16     15.3201120              1.05801393D-02   
 17      7.8001886              1.29619102D-03   
 18      3.9891568             -2.82044585D-04   
 19      2.0458573              1.95531158D-04   
 20      1.0509883             -2.09516570D-04   
 21      0.54041627             1.12827836D-04   
 22      0.27801570            -8.31537465D-05   
 23      0.14305645             5.17112920D-05   
 24      0.73618023E-01        -2.88816475D-05   
 25      0.37885504E-01         1.25237762D-05   
 26      0.19496860E-01        -3.06259005D-06   
S   26
  1 31974270.0000000           -1.15931078D-07   
  2 6845386.9000000            -6.00970600D-07   
  3 1658413.9000000            -3.36334232D-06   
  4 451045.7100000             -1.56152847D-05   
  5 136451.1600000             -6.40359902D-05   
  6  45447.7520000             -2.32561264D-04   
  7  16484.0280000             -7.62313512D-04   
  8   6437.5646000             -2.27884254D-03   
  9   2676.7878000             -6.29756394D-03   
 10   1172.4007000             -1.60901252D-02   
 11    535.5498300             -3.78467906D-02   
 12    252.8952000             -7.94055878D-02   
 13    122.5117800             -1.40942473D-01   
 14     60.4969480             -1.75624112D-01   
 15     30.2937540             -6.52431888D-02   
 16     15.3201120              2.61391267D-01   
 17      7.8001886              5.45327766D-01   
 18      3.9891568              3.20451034D-01   
 19      2.0458573              4.14477736D-02   
 20      1.0509883              5.74527650D-03   
 21      0.54041627            -1.25566844D-03   
 22      0.27801570             1.49900705D-03   
 23      0.14305645            -9.06252496D-04   
 24      0.73618023E-01         5.19093658D-04   
 25      0.37885504E-01        -2.27479352D-04   
 26      0.19496860E-01         5.60028477D-05   
S   26
  1 31974270.0000000           -4.14278610D-08   
  2 6845386.9000000            -2.14911541D-07   
  3 1658413.9000000            -1.20169735D-06   
  4 451045.7100000             -5.58458488D-06   
  5 136451.1600000             -2.28780224D-05   
  6  45447.7520000             -8.31937017D-05   
  7  16484.0280000             -2.72380940D-04   
  8   6437.5646000             -8.16030390D-04   
  9   2676.7878000             -2.25351704D-03   
 10   1172.4007000             -5.78668590D-03   
 11    535.5498300             -1.36505358D-02   
 12    252.8952000             -2.90696540D-02   
 13    122.5117800             -5.25790172D-02   
 14     60.4969480             -6.89136201D-02   
 15     30.2937540             -2.62496413D-02   
 16     15.3201120              1.21341083D-01   
 17      7.8001886              3.63541349D-01   
 18      3.9891568              3.24434393D-01   
 19      2.0458573             -1.90642105D-01   
 20      1.0509883             -5.99632202D-01   
 21      0.54041627            -4.34242421D-01   
 22      0.27801570            -7.05746913D-02   
 23      0.14305645            -4.99418697D-03   
 24      0.73618023E-01         1.94261386D-03   
 25      0.37885504E-01        -9.57353362D-04   
 26      0.19496860E-01         2.47693896D-04   
S   26
  1 31974270.0000000           -9.62223301D-09   
  2 6845386.9000000            -4.99199191D-08   
  3 1658413.9000000            -2.79107679D-07   
  4 451045.7100000             -1.29720482D-06   
  5 136451.1600000             -5.31364737D-06   
  6  45447.7520000             -1.93250437D-05   
  7  16484.0280000             -6.32644175D-05   
  8   6437.5646000             -1.89578381D-04   
  9   2676.7878000             -5.23514806D-04   
 10   1172.4007000             -1.34507145D-03   
 11    535.5498300             -3.17437149D-03   
 12    252.8952000             -6.77210630D-03   
 13    122.5117800             -1.22798466D-02   
 14     60.4969480             -1.61945153D-02   
 15     30.2937540             -6.20140405D-03   
 16     15.3201120              2.91448317D-02   
 17      7.8001886              9.19444078D-02   
 18      3.9891568              8.54155400D-02   
 19      2.0458573             -6.00548207D-02   
 20      1.0509883             -1.95799178D-01   
 21      0.54041627            -2.49146465D-01   
 22      0.27801570            -1.15790814D-01   
 23      0.14305645             1.88862789D-01   
 24      0.73618023E-01         4.88868747D-01   
 25      0.37885504E-01         4.38238609D-01   
 26      0.19496860E-01         1.01259865D-01   
P   17
  1  16484.0280000              1.92243426D-05   
  2   6437.5646000              6.12424566D-05   
  3   2676.7878000              2.99100134D-04   
  4   1172.4007000              1.14243706D-03   
  5    535.5498300              4.13089025D-03   
  6    252.8952000              1.35215233D-02   
  7    122.5117800              3.96912957D-02   
  8     60.4969480              1.02108126D-01   
  9     30.2937540              2.10859112D-01   
 10     15.3201120              3.27042937D-01   
 11      7.8001886              3.25064320D-01   
 12      3.9891568              1.48922382D-01   
 13      2.0458573              2.20046836D-02   
 14      1.0509883              1.70514834D-03   
 15      0.54041627             8.19543368D-06   
 16      0.27801570             1.37885820D-04   
 17      0.14305645            -3.74843658D-05   
P   17
  1  16484.0280000              6.59867952D-06   
  2   6437.5646000              2.09598301D-05   
  3   2676.7878000              1.02806308D-04   
  4   1172.4007000              3.92205977D-04   
  5    535.5498300              1.42620957D-03   
  6    252.8952000              4.69103151D-03   
  7    122.5117800              1.39806850D-02   
  8     60.4969480              3.68324964D-02   
  9     30.2937540              7.87627880D-02   
 10     15.3201120              1.27746738D-01   
 11      7.8001886              1.32693655D-01   
 12      3.9891568             -2.46563791D-02   
 13      2.0458573             -2.91210592D-01   
 14      1.0509883             -4.23232335D-01   
 15      0.54041627            -3.06265282D-01   
 16      0.27801570            -8.44581752D-02   
 17      0.14305645            -1.20421136D-02   
D   13
  1    252.8952000              1.83269753D-04   
  2    122.5117800              4.75408785D-04   
  3     60.4969480              2.37072246D-03   
  4     30.2937540              8.10157773D-03   
  5     15.3201120              2.40370692D-02   
  6      7.8001886              6.01371743D-02   
  7      3.9891568              1.31912730D-01   
  8      2.0458573              2.18230014D-01   
  9      1.0509883              2.77281228D-01   
 10      0.54041627             2.78826795D-01   
 11      0.27801570             2.13793524D-01   
 12      0.14305645             1.05798294D-01   
 13      0.73618023E-01         3.33607341D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: V
data:
VANADIUM
S   26
  1 36641923.0000000            3.70089325D-07   
  2 7842176.5000000             1.91991380D-06   
  3 1899441.1000000             1.07440720D-05   
  4 516500.1200000              4.99050514D-05   
  5 156226.8300000              2.04578764D-04   
  6  52025.9230000              7.42914128D-04   
  7  18866.4420000              2.43044500D-03   
  8   7366.2961000              7.23994538D-03   
  9   3062.0876000              1.98038753D-02   
 10   1340.6858000              4.95692672D-02   
 11    612.1638000              1.11420664D-01   
 12    288.9317000              2.13881083D-01   
 13    139.8915500              3.17151041D-01   
 14     69.0369530              2.93927162D-01   
 15     34.5473730              1.20413257D-01   
 16     17.4590620              1.24995473D-02   
 17      8.8827648              1.39404438D-03   
 18      4.5394020             -3.42250495D-04   
 19      2.3262725              2.51308330D-04   
 20      1.1941154             -2.52259151D-04   
 21      0.61353198             1.43788749D-04   
 22      0.31538196            -1.04372244D-04   
 23      0.16215594             6.52531159D-05   
 24      0.83380992E-01        -3.64846584D-05   
 25      0.42875910E-01         1.58376810D-05   
 26      0.22047649E-01        -3.87702297D-06   
S   26
  1 36641923.0000000           -1.10190965D-07   
  2 7842176.5000000            -5.71529954D-07   
  3 1899441.1000000            -3.19918755D-06   
  4 516500.1200000             -1.48572706D-05   
  5 156226.8300000             -6.09383363D-05   
  6  52025.9230000             -2.21384823D-04   
  7  18866.4420000             -7.25941795D-04   
  8   7366.2961000             -2.17180270D-03   
  9   3062.0876000             -6.00895671D-03   
 10   1340.6858000             -1.53914983D-02   
 11    612.1638000             -3.63642858D-02   
 12    288.9317000             -7.69179258D-02   
 13    139.8915500             -1.38428544D-01   
 14     69.0369530             -1.78003975D-01   
 15     34.5473730             -7.77672282D-02   
 16     17.4590620              2.45843169D-01   
 17      8.8827648              5.47026361D-01   
 18      4.5394020              3.34505566D-01   
 19      2.3262725              4.53795556D-02   
 20      1.1941154              6.11289957D-03   
 21      0.61353198            -1.34705419D-03   
 22      0.31538196             1.60694951D-03   
 23      0.16215594            -9.73083631D-04   
 24      0.83380992E-01         5.58829017D-04   
 25      0.42875910E-01        -2.45215129D-04   
 26      0.22047649E-01         6.04437936D-05   
S   26
  1 36641923.0000000           -3.98309202D-08   
  2 7842176.5000000            -2.06746258D-07   
  3 1899441.1000000            -1.15622701D-06   
  4 516500.1200000             -5.37493262D-06   
  5 156226.8300000             -2.20222891D-05   
  6  52025.9230000             -8.01114915D-05   
  7  18866.4420000             -2.62371746D-04   
  8   7366.2961000             -7.86687597D-04   
  9   3062.0876000             -2.17490573D-03   
 10   1340.6858000             -5.59900107D-03   
 11    612.1638000             -1.32642096D-02   
 12    288.9317000             -2.84734802D-02   
 13    139.8915500             -5.21933589D-02   
 14     69.0369530             -7.05621080D-02   
 15     34.5473730             -3.18349405D-02   
 16     17.4590620              1.15276595D-01   
 17      8.8827648              3.65760449D-01   
 18      4.5394020              3.36343449D-01   
 19      2.3262725             -1.84676920D-01   
 20      1.1941154             -5.97987180D-01   
 21      0.61353198            -4.38390026D-01   
 22      0.31538196            -7.53735082D-02   
 23      0.16215594            -4.91377721D-03   
 24      0.83380992E-01         1.71975763D-03   
 25      0.42875910E-01        -8.64456281D-04   
 26      0.22047649E-01         2.25035553D-04   
S   26
  1 36641923.0000000           -9.04705333D-09   
  2 7842176.5000000            -4.69622070D-08   
  3 1899441.1000000            -2.62618155D-07   
  4 516500.1200000             -1.22091870D-06   
  5 156226.8300000             -5.00198771D-06   
  6  52025.9230000             -1.81978233D-05   
  7  18866.4420000             -5.95946533D-05   
  8   7366.2961000             -1.78721280D-04   
  9   3062.0876000             -4.94102641D-04   
 10   1340.6858000             -1.27265382D-03   
 11    612.1638000             -3.01644654D-03   
 12    288.9317000             -6.48616362D-03   
 13    139.8915500             -1.19202303D-02   
 14     69.0369530             -1.62118741D-02   
 15     34.5473730             -7.36187897D-03   
 16     17.4590620              2.70794878D-02   
 17      8.8827648              9.03301165D-02   
 18      4.5394020              8.66182976D-02   
 19      2.3262725             -5.71670504D-02   
 20      1.1941154             -1.90747159D-01   
 21      0.61353198            -2.39818550D-01   
 22      0.31538196            -1.17005101D-01   
 23      0.16215594             1.66557209D-01   
 24      0.83380992E-01         4.65778247D-01   
 25      0.42875910E-01         4.50570449D-01   
 26      0.22047649E-01         1.27951711D-01   
P   17
  1  18866.4420000              1.80110077D-05   
  2   7366.2961000              5.74505705D-05   
  3   3062.0876000              2.80719303D-04   
  4   1340.6858000              1.07453982D-03   
  5    612.1638000              3.89740614D-03   
  6    288.9317000              1.28290155D-02   
  7    139.8915500              3.79403855D-02   
  8     69.0369530              9.86661779D-02   
  9     34.5473730              2.06885687D-01   
 10     17.4590620              3.26135669D-01   
 11      8.8827648              3.29224310D-01   
 12      4.5394020              1.53301780D-01   
 13      2.3262725              2.30799362D-02   
 14      1.1941154              1.88903650D-03   
 15      0.61353198             4.36798743D-05   
 16      0.31538196             1.65402866D-04   
 17      0.16215594            -3.58163146D-05   
P   17
  1  18866.4420000              6.28862577D-06   
  2   7366.2961000              1.99946221D-05   
  3   3062.0876000              9.81506736D-05   
  4   1340.6858000              3.75153378D-04   
  5    612.1638000              1.36865580D-03   
  6    288.9317000              4.52614289D-03   
  7    139.8915500              1.35900975D-02   
  8     69.0369530              3.61912967D-02   
  9     34.5473730              7.86577593D-02   
 10     17.4590620              1.29756396D-01   
 11      8.8827648              1.36563110D-01   
 12      4.5394020             -2.31553115D-02   
 13      2.3262725             -2.93939054D-01   
 14      1.1941154             -4.23386236D-01   
 15      0.61353198            -3.04593950D-01   
 16      0.31538196            -8.48822597D-02   
 17      0.16215594            -1.19323556D-02   
D   13
  1    288.9317000              1.85719738D-04   
  2    139.8915500              4.86991482D-04   
  3     69.0369530              2.43542650D-03   
  4     34.5473730              8.43610256D-03   
  5     17.4590620              2.53731492D-02   
  6      8.8827648              6.41186364D-02   
  7      4.5394020              1.39843628D-01   
  8      2.3262725              2.27955072D-01   
  9      1.1941154              2.82658413D-01   
 10      0.61353198             2.75081331D-01   
 11      0.31538196             2.02148089D-01   
 12      0.16215594             9.54780442D-02   
 13      0.83380992E-01         2.79455133D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Cr
data:
CHROMIUM
S   26
  1 39452193.0000000            3.79596174D-07   
  2 8183165.5000000             2.06888094D-06   
  3 1941276.7000000             1.17669999D-05   
  4 521633.5900000              5.52292939D-05   
  5 157005.1500000              2.26704588D-04   
  6  52286.9280000              8.20171309D-04   
  7  19017.8730000              2.66649262D-03   
  8   7456.0343000              7.89041073D-03   
  9   3110.8782000              2.14675449D-02   
 10   1364.9391000              5.35034771D-02   
 11    623.0999100              1.19720380D-01   
 12    293.2272900              2.27457115D-01   
 13    141.1577000              3.27816747D-01   
 14     69.0803280              2.82127493D-01   
 15     34.2010640              9.83456800D-02   
 16     17.0670600              7.34778359D-03   
 17      8.5612492              1.10122545D-03   
 18      4.3086647             -3.29127888D-04   
 19      2.1727396              1.74545720D-04   
 20      1.0968856             -1.77995024D-04   
 21      0.55408178             9.86324142D-05   
 22      0.27997009            -6.96349003D-05   
 23      0.14148265             4.33952359D-05   
 24      0.71501358E-01        -2.41671349D-05   
 25      0.36135240E-01         1.06771815D-05   
 26      0.18262014E-01        -2.62390228D-06   
S   26
  1 39452193.0000000           -1.13808093D-07   
  2 8183165.5000000            -6.19967541D-07   
  3 1941276.7000000            -3.52841406D-06   
  4 521633.5900000             -1.65511353D-05   
  5 157005.1500000             -6.80097614D-05   
  6  52286.9280000             -2.46027263D-04   
  7  19017.8730000             -8.02379133D-04   
  8   7456.0343000             -2.38360133D-03   
  9   3110.8782000             -6.57095460D-03   
 10   1364.9391000             -1.67696836D-02   
 11    623.0999100             -3.96343251D-02   
 12    293.2272900             -8.34998448D-02   
 13    141.1577000             -1.48725423D-01   
 14     69.0803280             -1.80072057D-01   
 15     34.2010640             -4.60682903D-02   
 16     17.0670600              3.27057716D-01   
 17      8.5612492              5.63280412D-01   
 18      4.3086647              2.52657233D-01   
 19      2.1727396              2.19802278D-02   
 20      1.0968856              3.99209884D-03   
 21      0.55408178            -6.94644773D-04   
 22      0.27997009             8.11185342D-04   
 23      0.14148265            -4.25228009D-04   
 24      0.71501358E-01         3.55078592D-04   
 25      0.36135240E-01        -3.70824876D-05   
 26      0.18262014E-01         4.24531199D-05   
S   26
  1 39452193.0000000           -4.11833912D-08   
  2 8183165.5000000            -2.24470533D-07   
  3 1941276.7000000            -1.27666322D-06   
  4 521633.5900000             -5.99308218D-06   
  5 157005.1500000             -2.46062620D-05   
  6  52286.9280000             -8.91073800D-05   
  7  19017.8730000             -2.90352470D-04   
  8   7456.0343000             -8.64190181D-04   
  9   3110.8782000             -2.38177063D-03   
 10   1364.9391000             -6.10742496D-03   
 11    623.0999100             -1.44906534D-02   
 12    293.2272900             -3.09897896D-02   
 13    141.1577000             -5.64272484D-02   
 14     69.0803280             -7.19693950D-02   
 15     34.2010640             -1.90631357D-02   
 16     17.0670600              1.62286784D-01   
 17      8.5612492              4.14274441D-01   
 18      4.3086647              2.47340025D-01   
 19      2.1727396             -3.41193394D-01   
 20      1.0968856             -6.08082195D-01   
 21      0.55408178            -3.24895141D-01   
 22      0.27997009            -3.64858866D-02   
 23      0.14148265            -4.22252910D-03   
 24      0.71501358E-01         1.94018980D-03   
 25      0.36135240E-01        -7.50351281D-04   
 26      0.18262014E-01         2.47876689D-04   
S   26
  1 39452193.0000000           -8.70070530D-09   
  2 8183165.5000000            -4.74302898D-08   
  3 1941276.7000000            -2.69708491D-07   
  4 521633.5900000             -1.26635192D-06   
  5 157005.1500000             -5.19822883D-06   
  6  52286.9280000             -1.88295101D-05   
  7  19017.8730000             -6.13386301D-05   
  8   7456.0343000             -1.82642896D-04   
  9   3110.8782000             -5.03250501D-04   
 10   1364.9391000             -1.29155529D-03   
 11    623.0999100             -3.06492490D-03   
 12    293.2272900             -6.56937773D-03   
 13    141.1577000             -1.19889114D-02   
 14     69.0803280             -1.54024239D-02   
 15     34.2010640             -4.08670120D-03   
 16     17.0670600              3.56171819D-02   
 17      8.5612492              9.61811339D-02   
 18      4.3086647              5.91775139D-02   
 19      2.1727396             -9.61209257D-02   
 20      1.0968856             -1.98076623D-01   
 21      0.55408178            -1.91459065D-01   
 22      0.27997009            -6.00856548D-02   
 23      0.14148265             1.97754254D-01   
 24      0.71501358E-01         4.94812241D-01   
 25      0.36135240E-01         4.12081479D-01   
 26      0.18262014E-01         7.45223470D-02   
P   17
  1  19017.8730000              2.08833509D-05   
  2   7456.0343000              6.57786908D-05   
  3   3110.8782000              3.19969450D-04   
  4   1364.9391000              1.22235385D-03   
  5    623.0999100              4.43436276D-03   
  6    293.2272900              1.46694093D-02   
  7    141.1577000              4.35723494D-02   
  8     69.0803280              1.13129888D-01   
  9     34.2010640              2.32543347D-01   
 10     17.0670600              3.49756079D-01   
 11      8.5612492              3.09779897D-01   
 12      4.3086647              1.11734187D-01   
 13      2.1727396              1.19108224D-02   
 14      1.0968856              1.10252568D-03   
 15      0.55408178             2.08732918D-04   
 16      0.27997009             7.49720785D-05   
 17      0.14148265             1.25385523D-05   
P   17
  1  19017.8730000              7.29593135D-06   
  2   7456.0343000              2.30303532D-05   
  3   3110.8782000              1.11896850D-04   
  4   1364.9391000              4.28892174D-04   
  5    623.0999100              1.55957897D-03   
  6    293.2272900              5.20307888D-03   
  7    141.1577000              1.56743156D-02   
  8     69.0803280              4.18782361D-02   
  9     34.2010640              8.92326130D-02   
 10     17.0670600              1.41905509D-01   
 11      8.5612492              1.21913349D-01   
 12      4.3086647             -9.25362624D-02   
 13      2.1727396             -3.57190549D-01   
 14      1.0968856             -4.12799326D-01   
 15      0.55408178            -2.41098370D-01   
 16      0.27997009            -5.44761452D-02   
 17      0.14148265            -6.43136789D-03   
D   13
  1    293.2272900              2.16296412D-04   
  2    141.1577000              5.86866770D-04   
  3     69.0803280              2.92874400D-03   
  4     34.2010640              1.02266139D-02   
  5     17.0670600              3.05665469D-02   
  6      8.5612492              7.72399167D-02   
  7      4.3086647              1.59935066D-01   
  8      2.1727396              2.39809608D-01   
  9      1.0968856              2.74761574D-01   
 10      0.55408178             2.53538709D-01   
 11      0.27997009             1.95834127D-01   
 12      0.14148265             1.06790122D-01   
 13      0.71501358E-01         4.16396689D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Mn
data:
MANGANESE
S   26
  1 47145111.0000000            3.33643235D-07   
  2 10045644.0000000            1.74304604D-06   
  3 2426015.7000000             9.77628323D-06   
  4 658562.0000000              4.54810878D-05   
  5 199043.0100000              1.86512471D-04   
  6  66275.2440000              6.77233532D-04   
  7  24038.5180000              2.21530323D-03   
  8   9388.1747000              6.60287650D-03   
  9   3902.9530000              1.81000330D-02   
 10   1708.4470000              4.55416515D-02   
 11    779.5571600              1.03453318D-01   
 12    367.5065800              2.02452954D-01   
 13    177.6367100              3.10599236D-01   
 14     87.4761380              3.05555725D-01   
 15     43.6625830              1.37367042D-01   
 16     22.0014300              1.60805763D-02   
 17     11.1581900              1.52034708D-03   
 18      5.6828864             -4.24566185D-04   
 19      2.9019530              3.29819388D-04   
 20      1.4841962             -3.11370356D-04   
 21      0.75974773             1.87935947D-04   
 22      0.38908091            -1.34286161D-04   
 23      0.19929586             8.44127900D-05   
 24      0.10209183            -4.72769926D-05   
 25      0.52299121E-01         2.05782791D-05   
 26      0.26791688E-01        -5.05608506D-06   
S   26
  1 47145111.0000000           -1.00627199D-07   
  2 10045644.0000000           -5.25621576D-07   
  3 2426015.7000000            -2.94872547D-06   
  4 658562.0000000             -1.37161007D-05   
  5 199043.0100000             -5.62751405D-05   
  6  66275.2440000             -2.04422289D-04   
  7  24038.5180000             -6.70117072D-04   
  8   9388.1747000             -2.00548213D-03   
  9   3902.9530000             -5.55640318D-03   
 10   1708.4470000             -1.42874053D-02   
 11    779.5571600             -3.40116945D-02   
 12    367.5065800             -7.29496359D-02   
 13    177.6367100             -1.34370251D-01   
 14     87.4761380             -1.81429684D-01   
 15     43.6625830             -9.69967366D-02   
 16     22.0014300              2.23303556D-01   
 17     11.1581900              5.50828961D-01   
 18      5.6828864              3.53618523D-01   
 19      2.9019530              5.02911136D-02   
 20      1.4841962              6.63016327D-03   
 21      0.75974773            -1.49879649D-03   
 22      0.38908091             1.75927679D-03   
 23      0.19929586            -1.06864549D-03   
 24      0.10209183             6.15535184D-04   
 25      0.52299121E-01        -2.70906881D-04   
 26      0.26791688E-01         6.70375688D-05   
S   26
  1 47145111.0000000           -3.69773915D-08   
  2 10045644.0000000           -1.93303486D-07   
  3 2426015.7000000            -1.08337678D-06   
  4 658562.0000000             -5.04469665D-06   
  5 199043.0100000             -2.06740553D-05   
  6  66275.2440000             -7.52054346D-05   
  7  24038.5180000             -2.46202346D-04   
  8   9388.1747000             -7.38535121D-04   
  9   3902.9530000             -2.04422106D-03   
 10   1708.4470000             -5.28329133D-03   
 11    779.5571600             -1.26071149D-02   
 12    367.5065800             -2.74372801D-02   
 13    177.6367100             -5.14353145D-02   
 14     87.4761380             -7.29670016D-02   
 15     43.6625830             -4.05953062D-02   
 16     22.0014300              1.06461938D-01   
 17     11.1581900              3.71126740D-01   
 18      5.6828864              3.51540916D-01   
 19      2.9019530             -1.82854309D-01   
 20      1.4841962             -5.97280744D-01   
 21      0.75974773            -4.39291605D-01   
 22      0.38908091            -7.96422717D-02   
 23      0.19929586            -4.74298882D-03   
 24      0.10209183             1.45273535D-03   
 25      0.52299121E-01        -7.52041593D-04   
 26      0.26791688E-01         1.97876232D-04   
S   26
  1 47145111.0000000           -8.01611586D-09   
  2 10045644.0000000           -4.19053956D-08   
  3 2426015.7000000            -2.34858801D-07   
  4 658562.0000000             -1.09361932D-06   
  5 199043.0100000             -4.48182206D-06   
  6  66275.2440000             -1.63037216D-05   
  7  24038.5180000             -5.33748069D-05   
  8   9388.1747000             -1.60121332D-04   
  9   3902.9530000             -4.43265419D-04   
 10   1708.4470000             -1.14601426D-03   
 11    779.5571600             -2.73644838D-03   
 12    367.5065800             -5.96383949D-03   
 13    177.6367100             -1.12113740D-02   
 14     87.4761380             -1.59908084D-02   
 15     43.6625830             -8.97197981D-03   
 16     22.0014300              2.38870682D-02   
 17     11.1581900              8.72425312D-02   
 18      5.6828864              8.63683479D-02   
 19      2.9019530             -5.42420926D-02   
 20      1.4841962             -1.81366155D-01   
 21      0.75974773            -2.23220661D-01   
 22      0.38908091            -1.14034314D-01   
 23      0.19929586             1.34189800D-01   
 24      0.10209183             4.32507513D-01   
 25      0.52299121E-01         4.56646920D-01   
 26      0.26791688E-01         1.74937528D-01   
P   17
  1  24038.5180000              1.62070219D-05   
  2   9388.1747000              5.17027837D-05   
  3   3902.9530000              2.52684947D-04   
  4   1708.4470000              9.70342291D-04   
  5    779.5571600              3.53792452D-03   
  6    367.5065800              1.17665784D-02   
  7    177.6367100              3.52843612D-02   
  8     87.4761380              9.35730151D-02   
  9     43.6625830              2.01424229D-01   
 10     22.0014300              3.26063984D-01   
 11     11.1581900              3.35742677D-01   
 12      5.6828864              1.58353749D-01   
 13      2.9019530              2.40317659D-02   
 14      1.4841962              2.15300221D-03   
 15      0.75974773             9.97877345D-05   
 16      0.38908091             2.07016032D-04   
 17      0.19929586            -3.32914953D-05   
P   17
  1  24038.5180000              5.80366061D-06   
  2   9388.1747000              1.84446294D-05   
  3   3902.9530000              9.06137121D-05   
  4   1708.4470000              3.47289140D-04   
  5    779.5571600              1.27405237D-03   
  6    367.5065800              4.25552640D-03   
  7    177.6367100              1.29561963D-02   
  8     87.4761380              3.51823461D-02   
  9     43.6625830              7.86247324D-02   
 10     22.0014300              1.33410643D-01   
 11     11.1581900              1.42392732D-01   
 12      5.6828864             -2.40846663D-02   
 13      2.9019530             -3.01789573D-01   
 14      1.4841962             -4.23994774D-01   
 15      0.75974773            -2.98985888D-01   
 16      0.38908091            -8.32633353D-02   
 17      0.19929586            -1.11781428D-02   
D   13
  1    367.5065800              1.86245659D-04   
  2    177.6367100              4.99413918D-04   
  3     87.4761380              2.51219941D-03   
  4     43.6625830              8.92347370D-03   
  5     22.0014300              2.75103486D-02   
  6     11.1581900              7.07926536D-02   
  7      5.6828864              1.52882914D-01   
  8      2.9019530              2.42600564D-01   
  9      1.4841962              2.88776524D-01   
 10      0.75974773             2.67285696D-01   
 11      0.38908091             1.85185293D-01   
 12      0.19929586             8.20067663D-02   
 13      0.10209183             2.16462685D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Fe
data:
IRON
S   26
  1 53946029.0000000            3.12878672D-07   
  2 11304393.0000000            1.67901529D-06   
  3 2697672.1000000             9.51333435D-06   
  4 726658.1100000              4.46032753D-05   
  5 218683.9300000              1.83463570D-04   
  6  72696.5290000              6.66277412D-04   
  7  26373.5620000              2.17578736D-03   
  8  10313.7220000              6.46989598D-03   
  9   4295.2047000              1.77005018D-02   
 10   1883.2040000              4.45108464D-02   
 11    860.2593800              1.01300570D-01   
 12    405.7032100              1.99305796D-01   
 13    196.0049500              3.08864770D-01   
 14     96.3921860              3.08852831D-01   
 15     48.0104290              1.41799966D-01   
 16     24.1243100              1.68419431D-02   
 17     12.1936970              1.53765650D-03   
 18      6.1867732             -4.64044631D-04   
 19      3.1463420              3.55893319D-04   
 20      1.6022734             -3.28791647D-04   
 21      0.81655825             2.01890499D-04   
 22      0.41629091            -1.42949093D-04   
 23      0.21226448             9.00175763D-05   
 24      0.10823916            -5.04726233D-05   
 25      0.55194964E-01         2.20311957D-05   
 26      0.28145964E-01        -5.43617170D-06   
S   26
  1 53946029.0000000           -9.48947967D-08   
  2 11304393.0000000           -5.09144387D-07   
  3 2697672.1000000            -2.88555156D-06   
  4 726658.1100000             -1.35265279D-05   
  5 218683.9300000             -5.56666490D-05   
  6  72696.5290000             -2.02235672D-04   
  7  26373.5620000             -6.61857311D-04   
  8  10313.7220000             -1.97587663D-03   
  9   4295.2047000             -5.46326461D-03   
 10   1883.2040000             -1.40337489D-02   
 11    860.2593800             -3.34506782D-02   
 12    405.7032100             -7.20250664D-02   
 13    196.0049500             -1.33693078D-01   
 14     96.3921860             -1.82955557D-01   
 15     48.0104290             -1.01793607D-01   
 16     24.1243100              2.22716134D-01   
 17     12.1936970              5.56408456D-01   
 18      6.1867732              3.52461937D-01   
 19      3.1463420              4.82718494D-02   
 20      1.6022734              6.61176762D-03   
 21      0.81655825            -1.58986670D-03   
 22      0.41629091             1.78338319D-03   
 23      0.21226448            -1.08528704D-03   
 24      0.10823916             6.24971989D-04   
 25      0.55194964E-01        -2.75547040D-04   
 26      0.28145964E-01         6.84381775D-05   
S   26
  1 53946029.0000000           -3.51371587D-08   
  2 11304393.0000000           -1.88676442D-07   
  3 2697672.1000000            -1.06825870D-06   
  4 726658.1100000             -5.01307169D-06   
  5 218683.9300000             -2.06064232D-05   
  6  72696.5290000             -7.49717735D-05   
  7  26373.5620000             -2.45017773D-04   
  8  10313.7220000             -7.33230143D-04   
  9   4295.2047000             -2.02520703D-03   
 10   1883.2040000             -5.22947551D-03   
 11    860.2593800             -1.24929254D-02   
 12    405.7032100             -2.72974211D-02   
 13    196.0049500             -5.15611384D-02   
 14     96.3921860             -7.41487825D-02   
 15     48.0104290             -4.30261744D-02   
 16     24.1243100              1.07544219D-01   
 17     12.1936970              3.80233667D-01   
 18      6.1867732              3.50745095D-01   
 19      3.1463420             -2.01819999D-01   
 20      1.6022734             -6.06139716D-01   
 21      0.81655825            -4.24971820D-01   
 22      0.41629091            -7.16311926D-02   
 23      0.21226448            -4.66166452D-03   
 24      0.10823916             1.57644477D-03   
 25      0.55194964E-01        -8.07406953D-04   
 26      0.28145964E-01         2.11869714D-04   
S   26
  1 53946029.0000000           -7.51581026D-09   
  2 11304393.0000000           -4.03590572D-08   
  3 2697672.1000000            -2.28498127D-07   
  4 726658.1100000             -1.07233211D-06   
  5 218683.9300000             -4.40766510D-06   
  6  72696.5290000             -1.60373328D-05   
  7  26373.5620000             -5.24101623D-05   
  8  10313.7220000             -1.56862654D-04   
  9   4295.2047000             -4.33285766D-04   
 10   1883.2040000             -1.11931106D-03   
 11    860.2593800             -2.67545803D-03   
 12    405.7032100             -5.85494886D-03   
 13    196.0049500             -1.10884226D-02   
 14     96.3921860             -1.60366686D-02   
 15     48.0104290             -9.37966987D-03   
 16     24.1243100              2.38160469D-02   
 17     12.1936970              8.82915492D-02   
 18      6.1867732              8.49577460D-02   
 19      3.1463420             -5.85243507D-02   
 20      1.6022734             -1.83835461D-01   
 21      0.81655825            -2.18397837D-01   
 22      0.41629091            -1.03255057D-01   
 23      0.21226448             1.42628644D-01   
 24      0.10823916             4.31480242D-01   
 25      0.55194964E-01         4.50341525D-01   
 26      0.28145964E-01         1.70469787D-01   
P   17
  1  26373.5620000              1.59904665D-05   
  2  10313.7220000              5.07836713D-05   
  3   4295.2047000              2.47568057D-04   
  4   1883.2040000              9.48861541D-04   
  5    860.2593800              3.45824209D-03   
  6    405.7032100              1.15359935D-02   
  7    196.0049500              3.47655822D-02   
  8     96.3921860              9.29124117D-02   
  9     48.0104290              2.01795504D-01   
 10     24.1243100              3.28931641D-01   
 11     12.1936970              3.37202304D-01   
 12      6.1867732              1.55692527D-01   
 13      3.1463420              2.26866650D-02   
 14      1.6022734              2.12093483D-03   
 15      0.81655825             1.10766526D-04   
 16      0.41629091             2.15096683D-04   
 17      0.21226448            -2.95564928D-05   
P   17
  1  26373.5620000              5.79286896D-06   
  2  10313.7220000              1.83293807D-05   
  3   4295.2047000              8.98147087D-05   
  4   1883.2040000              3.43585958D-04   
  5    860.2593800              1.25992423D-03   
  6    405.7032100              4.22133461D-03   
  7    196.0049500              1.29162464D-02   
  8     96.3921860              3.53578771D-02   
  9     48.0104290              7.97819366D-02   
 10     24.1243100              1.36530185D-01   
 11     12.1936970              1.44094278D-01   
 12      6.1867732             -3.19364054D-02   
 13      3.1463420             -3.14283788D-01   
 14      1.6022734             -4.26451604D-01   
 15      0.81655825            -2.87991350D-01   
 16      0.41629091            -7.57544532D-02   
 17      0.21226448            -9.79808020D-03   
D   13
  1    405.7032100              1.88773765D-04   
  2    196.0049500              5.10885676D-04   
  3     96.3921860              2.57715780D-03   
  4     48.0104290              9.25938696D-03   
  5     24.1243100              2.88415136D-02   
  6     12.1936970              7.48647511D-02   
  7      6.1867732              1.60115540D-01   
  8      3.1463420              2.48314114D-01   
  9      1.6022734              2.87915977D-01   
 10      0.81655825             2.61006283D-01   
 11      0.41629091             1.80528176D-01   
 12      0.21226448             8.14357013D-02   
 13      0.10823916             2.25938480D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Co
data:
COBALT
S   26
  1 60672000.0000000            2.97902029D-07   
  2 12604766.0000000            1.62075529D-06   
  3 2989439.3000000             9.23298653D-06   
  4 801967.0000000              4.34700489D-05   
  5 240777.7700000              1.79127422D-04   
  6  79956.4820000              6.50833823D-04   
  7  29002.4180000              2.12456838D-03   
  8  11345.4050000              6.31423538D-03   
  9   4727.0836000              1.72725163D-02   
 10   2073.2941000              4.34771070D-02   
 11    947.1420300              9.92263107D-02   
 12    446.5159500              1.96315304D-01   
 13    215.5464200              3.07131651D-01   
 14    105.8685900              3.11884025D-01   
 15     52.6426200              1.46226674D-01   
 16     26.3988830              1.77166078D-02   
 17     13.3130280              1.55147700D-03   
 18      6.7379461             -4.92608902D-04   
 19      3.4176523              3.77317108D-04   
 20      1.7357011             -3.43110273D-04   
 21      0.88209546             2.13433086D-04   
 22      0.44843609            -1.50287712D-04   
 23      0.22800723             9.47521287D-05   
 24      0.11593649            -5.31674842D-05   
 25      0.58951991E-01         2.32485941D-05   
 26      0.29976310E-01        -5.75187035D-06   
S   26
  1 60672000.0000000           -9.08149731D-08   
  2 12604766.0000000           -4.93983412D-07   
  3 2989439.3000000            -2.81486431D-06   
  4 801967.0000000             -1.32500152D-05   
  5 240777.7700000             -5.46293585D-05   
  6  79956.4820000             -1.98550505D-04   
  7  29002.4180000             -6.49567492D-04   
  8  11345.4050000             -1.93791985D-03   
  9   4727.0836000             -5.35712069D-03   
 10   2073.2941000             -1.37686759D-02   
 11    947.1420300             -3.28910997D-02   
 12    446.5159500             -7.11166738D-02   
 13    215.5464200             -1.32959319D-01   
 14    105.8685900             -1.84249543D-01   
 15     52.6426200             -1.06527698D-01   
 16     26.3988830              2.20588056D-01   
 17     13.3130280              5.60264958D-01   
 18      6.7379461              3.53097703D-01   
 19      3.4176523              4.74751754D-02   
 20      1.7357011              6.63128832D-03   
 21      0.88209546            -1.64276086D-03   
 22      0.44843609             1.80185026D-03   
 23      0.22800723            -1.09688768D-03   
 24      0.11593649             6.31757492D-04   
 25      0.58951991E-01        -2.78864998D-04   
 26      0.29976310E-01         6.94242031D-05   
S   26
  1 60672000.0000000           -3.38309270D-08   
  2 12604766.0000000           -1.84172833D-07   
  3 2989439.3000000            -1.04842325D-06   
  4 801967.0000000             -4.94051198D-06   
  5 240777.7700000             -2.03452514D-05   
  6  79956.4820000             -7.40545523D-05   
  7  29002.4180000             -2.41926186D-04   
  8  11345.4050000             -7.23535619D-04   
  9   4727.0836000             -1.99786869D-03   
 10   2073.2941000             -5.16197229D-03   
 11    947.1420300             -1.23578266D-02   
 12    446.5159500             -2.71157723D-02   
 13    215.5464200             -5.15831931D-02   
 14    105.8685900             -7.51183943D-02   
 15     52.6426200             -4.53907759D-02   
 16     26.3988830              1.07614590D-01   
 17     13.3130280              3.86625058D-01   
 18      6.7379461              3.50811474D-01   
 19      3.4176523             -2.13492304D-01   
 20      1.7357011             -6.10054051D-01   
 21      0.88209546            -4.16438331D-01   
 22      0.44843609            -6.79434529D-02   
 23      0.22800723            -4.60938293D-03   
 24      0.11593649             1.60132966D-03   
 25      0.58951991E-01        -8.18944752D-04   
 26      0.29976310E-01         2.14907482D-04   
S   26
  1 60672000.0000000           -7.12087268D-09   
  2 12604766.0000000           -3.87666898D-08   
  3 2989439.3000000            -2.20674982D-07   
  4 801967.0000000             -1.03993733D-06   
  5 240777.7700000             -4.28232157D-06   
  6  79956.4820000             -1.55881980D-05   
  7  29002.4180000             -5.09226482D-05   
  8  11345.4050000             -1.52317133D-04   
  9   4727.0836000             -4.20612074D-04   
 10   2073.2941000             -1.08721821D-03   
 11    947.1420300             -2.60425930D-03   
 12    446.5159500             -5.72305399D-03   
 13    215.5464200             -1.09158828D-02   
 14    105.8685900             -1.59866192D-02   
 15     52.6426200             -9.73887977D-03   
 16     26.3988830              2.34642913D-02   
 17     13.3130280              8.83586700D-02   
 18      6.7379461              8.35746398D-02   
 19      3.4176523             -6.06659203D-02   
 20      1.7357011             -1.83166417D-01   
 21      0.88209546            -2.12855356D-01   
 22      0.44843609            -9.67224501D-02   
 23      0.22800723             1.41350810D-01   
 24      0.11593649             4.25394790D-01   
 25      0.58951991E-01         4.46519428D-01   
 26      0.29976310E-01         1.77644733D-01   
P   17
  1  29002.4180000              1.56171931D-05   
  2  11345.4050000              4.95604541D-05   
  3   4727.0836000              2.41382567D-04   
  4   2073.2941000              9.25564021D-04   
  5    947.1420300              3.37716065D-03   
  6    446.5159500              1.13059917D-02   
  7    215.5464200              3.42398829D-02   
  8    105.8685900              9.21362125D-02   
  9     52.6426200              2.01710341D-01   
 10     26.3988830              3.30889058D-01   
 11     13.3130280              3.38472611D-01   
 12      6.7379461              1.54179931D-01   
 13      3.4176523              2.19366570D-02   
 14      1.7357011              2.13029292D-03   
 15      0.88209546             1.28704246D-04   
 16      0.44843609             2.21940643D-04   
 17      0.22800723            -2.64971467D-05   
P   17
  1  29002.4180000              5.71120900D-06   
  2  11345.4050000              1.80604403D-05   
  3   4727.0836000              8.83986163D-05   
  4   2073.2941000              3.38371452D-04   
  5    947.1420300              1.24205697D-03   
  6    446.5159500              4.17701287D-03   
  7    215.5464200              1.28425915D-02   
  8    105.8685900              3.54085481D-02   
  9     52.6426200              8.05823857D-02   
 10     26.3988830              1.38961410D-01   
 11     13.3130280              1.45484372D-01   
 12      6.7379461             -3.75328538D-02   
 13      3.4176523             -3.22617762D-01   
 14      1.7357011             -4.27043560D-01   
 15      0.88209546            -2.80625903D-01   
 16      0.44843609            -7.15255665D-02   
 17      0.22800723            -9.04621869D-03   
D   13
  1    446.5159500              1.90524206D-04   
  2    215.5464200              5.20558323D-04   
  3    105.8685900              2.63190186D-03   
  4     52.6426200              9.54659716D-03   
  5     26.3988830              2.99963627D-02   
  6     13.3130280              7.83519914D-02   
  7      6.7379461              1.66127680D-01   
  8      3.4176523              2.53051609D-01   
  9      1.7357011              2.87527572D-01   
 10      0.88209546             2.56189970D-01   
 11      0.44843609             1.75929236D-01   
 12      0.22800723             7.95998462D-02   
 13      0.11593649             2.24873972D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ni
data:
NICKEL
S   26
  1 67393769.0000000            2.86751356D-07   
  2 13930933.0000000            1.57253215D-06   
  3 3292307.1000000             8.98546984D-06   
  4 881220.2300000              4.24003922D-05   
  5 264240.9800000              1.74878764D-04   
  6  87702.1200000              6.35530191D-04   
  7  31809.6690000              2.07431567D-03   
  8  12445.1010000              6.16468900D-03   
  9   5185.8136000              1.68712380D-02   
 10   2274.3173000              4.25299452D-02   
 11   1038.5971000              9.73616440D-02   
 12    489.2860000              1.93668687D-01   
 13    235.9433900              3.05626483D-01   
 14    115.7262400              3.14597785D-01   
 15     57.4478970              1.50177383D-01   
 16     28.7534680              1.84948784D-02   
 17     14.4699950              1.56033867D-03   
 18      7.3071106             -5.17657113D-04   
 19      3.6976900              3.96262640D-04   
 20      1.8734163             -3.55399319D-04   
 21      0.94976189             2.23425124D-04   
 22      0.48164829            -1.56582173D-04   
 23      0.24428887             9.87776166D-05   
 24      0.12390783            -5.54402507D-05   
 25      0.62849239E-01         2.42698204D-05   
 26      0.31878838E-01        -6.01639810D-06   
S   26
  1 67393769.0000000           -8.78258555D-08   
  2 13930933.0000000           -4.81522991D-07   
  3 3292307.1000000            -2.75226959D-06   
  4 881220.2300000             -1.29842454D-05   
  5 264240.9800000             -5.35840826D-05   
  6  87702.1200000             -1.94782055D-04   
  7  31809.6690000             -6.37162066D-04   
  8  12445.1010000             -1.90060706D-03   
  9   5185.8136000             -5.25595021D-03   
 10   2274.3173000             -1.35231233D-02   
 11   1038.5971000             -3.23859735D-02   
 12    489.2860000             -7.03158813D-02   
 13    235.9433900             -1.32346622D-01   
 14    115.7262400             -1.85448589D-01   
 15     57.4478970             -1.10705473D-01   
 16     28.7534680              2.19078406D-01   
 17     14.4699950              5.63861714D-01   
 18      7.3071106              3.53227018D-01   
 19      3.6976900              4.66537325D-02   
 20      1.8734163              6.63531676D-03   
 21      0.94976189            -1.68310406D-03   
 22      0.48164829             1.81289347D-03   
 23      0.24428887            -1.10354224D-03   
 24      0.12390783             6.35639557D-04   
 25      0.62849239E-01        -2.80852122D-04   
 26      0.31878838E-01         7.00588070D-05   
S   26
  1 67393769.0000000           -3.28864815D-08   
  2 13930933.0000000           -1.80456580D-07   
  3 3292307.1000000            -1.03040514D-06   
  4 881220.2300000             -4.86649040D-06   
  5 264240.9800000             -2.00589894D-05   
  6  87702.1200000             -7.30255835D-05   
  7  31809.6690000             -2.38529333D-04   
  8  12445.1010000             -7.13284242D-04   
  9   5185.8136000             -1.97021749D-03   
 10   2274.3173000             -5.09611872D-03   
 11   1038.5971000             -1.22302664D-02   
 12    489.2860000             -2.69474250D-02   
 13    235.9433900             -5.16058048D-02   
 14    115.7262400             -7.59898122D-02   
 15     57.4478970             -4.74997193D-02   
 16     28.7534680              1.07889258D-01   
 17     14.4699950              3.92523880D-01   
 18      7.3071106              3.50182591D-01   
 19      3.6976900             -2.24291117D-01   
 20      1.8734163             -6.12866249D-01   
 21      0.94976189            -4.08735240D-01   
 22      0.48164829            -6.48886227D-02   
 23      0.24428887            -4.56250128D-03   
 24      0.12390783             1.61673419D-03   
 25      0.62849239E-01        -8.25818188D-04   
 26      0.31878838E-01         2.16772421D-04   
S   26
  1 67393769.0000000           -6.81099201D-09   
  2 13930933.0000000           -3.73746165D-08   
  3 3292307.1000000            -2.13402109D-07   
  4 881220.2300000             -1.00790984D-06   
  5 264240.9800000             -4.15431958D-06   
  6  87702.1200000             -1.51247842D-05   
  7  31809.6690000             -4.94020753D-05   
  8  12445.1010000             -1.47747529D-04   
  9   5185.8136000             -4.08135914D-04   
 10   2274.3173000             -1.05610377D-03   
 11   1038.5971000             -2.53602307D-03   
 12    489.2860000             -5.59606486D-03   
 13    235.9433900             -1.07453763D-02   
 14    115.7262400             -1.59115418D-02   
 15     57.4478970             -1.00302751D-02   
 16     28.7534680              2.31611689D-02   
 17     14.4699950              8.82715597D-02   
 18      7.3071106              8.20482226D-02   
 19      3.6976900             -6.25057701D-02   
 20      1.8734163             -1.81933309D-01   
 21      0.94976189            -2.07448332D-01   
 22      0.48164829            -9.10993877D-02   
 23      0.24428887             1.38883756D-01   
 24      0.12390783             4.19216464D-01   
 25      0.62849239E-01         4.42823798D-01   
 26      0.31878838E-01         1.86153424D-01   
P   17
  1  31809.6690000              1.52359098D-05   
  2  12445.1010000              4.83565931D-05   
  3   5185.8136000              2.35432238D-04   
  4   2274.3173000              9.03915041D-04   
  5   1038.5971000              3.30378343D-03   
  6    489.2860000              1.11030094D-02   
  7    235.9433900              3.37891278D-02   
  8    115.7262400              9.15086598D-02   
  9     57.4478970              2.01783882D-01   
 10     28.7534680              3.32807883D-01   
 11     14.4699950              3.39477341D-01   
 12      7.3071106              1.52584363D-01   
 13      3.6976900              2.12402479D-02   
 14      1.8734163              2.13726097D-03   
 15      0.94976189             1.46571637D-04   
 16      0.48164829             2.26397036D-04   
 17      0.24428887            -2.36322765D-05   
P   17
  1  31809.6690000              5.61723122D-06   
  2  12445.1010000              1.77700342D-05   
  3   5185.8136000              8.69207239D-05   
  4   2274.3173000              3.33220064D-04   
  5   1038.5971000              1.22500437D-03   
  6    489.2860000              4.13632433D-03   
  7    235.9433900              1.27782459D-02   
  8    115.7262400              3.54693070D-02   
  9     57.4478970              8.13460120D-02   
 10     28.7534680              1.41215210D-01   
 11     14.4699950              1.46558702D-01   
 12      7.3071106             -4.29851626D-02   
 13      3.6976900             -3.30043604D-01   
 14      1.8734163             -4.27062313D-01   
 15      0.94976189            -2.73972876D-01   
 16      0.48164829            -6.79585401D-02   
 17      0.24428887            -8.43660168D-03   
D   13
  1    489.2860000              1.91883405D-04   
  2    235.9433900              5.29549541D-04   
  3    115.7262400              2.68299326D-03   
  4     57.4478970              9.81812052D-03   
  5     28.7534680              3.10930849D-02   
  6     14.4699950              8.16292892D-02   
  7      7.3071106              1.71614417D-01   
  8      3.6976900              2.57217135D-01   
  9      1.8734163              2.87117271D-01   
 10      0.94976189             2.51913794D-01   
 11      0.48164829             1.71643350D-01   
 12      0.24428887             7.76690701D-02   
 13      0.12390783             2.21980798D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Cu
data:
COPPER
S   26
  1 32285234.0000000            7.89339724D-07   
  2 6610569.9000000             4.37572565D-06   
  3 1564955.3000000             2.47405184D-05   
  4 423553.2000000              1.14308393D-04   
  5 129366.3600000              4.57362661D-04   
  6  43958.9520000              1.60245142D-03   
  7  16371.7030000              5.01700641D-03   
  8   6583.7187000              1.42351361D-02   
  9   2818.2848000              3.68357981D-02   
 10   1267.5889000              8.61587347D-02   
 11    592.2432600              1.75876053D-01   
 12    284.6969400              2.89623318D-01   
 13    139.7161600              3.24911386D-01   
 14     69.5735620              1.82381097D-01   
 15     34.9921060              3.06600788D-02   
 16     17.7155420              1.78877751D-03   
 17      9.0065037             -3.10408592D-04   
 18      4.5905463              3.34622394D-04   
 19      2.3432167             -3.27672107D-04   
 20      1.1970399              2.06776872D-04   
 21      0.61175889            -1.54325811D-04   
 22      0.31270310             1.03462910D-04   
 23      0.15985137            -6.55799378D-05   
 24      0.81716807E-01         3.67443872D-05   
 25      0.41774304E-01        -1.59719244D-05   
 26      0.21355392E-01         3.94238604D-06   
S   26
  1 32285234.0000000           -2.42783312D-07   
  2 6610569.9000000            -1.34583049D-06   
  3 1564955.3000000            -7.61014681D-06   
  4 423553.2000000             -3.51646041D-05   
  5 129366.3600000             -1.40779072D-04   
  6  43958.9520000             -4.93898193D-04   
  7  16371.7030000             -1.55203440D-03   
  8   6583.7187000             -4.44069115D-03   
  9   2818.2848000             -1.17111662D-02   
 10   1267.5889000             -2.84949523D-02   
 11    592.2432600             -6.30178162D-02   
 12    284.6969400             -1.21434861D-01   
 13    139.7161600             -1.81531822D-01   
 14     69.5735620             -1.38789510D-01   
 15     34.9921060              1.43535872D-01   
 16     17.7155420              5.30175815D-01   
 17      9.0065037              4.24576289D-01   
 18      4.5905463              7.95999969D-02   
 19      2.3432167              8.52752468D-03   
 20      1.1970399             -1.51674456D-03   
 21      0.61175889             2.17926531D-03   
 22      0.31270310            -1.37647664D-03   
 23      0.15985137             9.14625566D-04   
 24      0.81716807E-01        -5.19324106D-04   
 25      0.41774304E-01         2.26856179D-04   
 26      0.21355392E-01        -5.66049001D-05   
S   26
  1 32285234.0000000            9.08354157D-08   
  2 6610569.9000000             5.03212796D-07   
  3 1564955.3000000             2.84771939D-06   
  4 423553.2000000              1.31473809D-05   
  5 129366.3600000              5.26909501D-05   
  6  43958.9520000              1.84667315D-04   
  7  16371.7030000              5.81392113D-04   
  8   6583.7187000              1.66226159D-03   
  9   2818.2848000              4.40318708D-03   
 10   1267.5889000              1.07374427D-02   
 11    592.2432600              2.40575737D-02   
 12    284.6969400              4.71010970D-02   
 13    139.7161600              7.36431738D-02   
 14     69.5735620              5.90805923D-02   
 15     34.9921060             -6.82334265D-02   
 16     17.7155420             -3.43689175D-01   
 17      9.0065037             -4.03114100D-01   
 18      4.5905463              1.01534477D-01   
 19      2.3432167              5.62124739D-01   
 20      1.1970399              4.81272473D-01   
 21      0.61175889             1.29856397D-01   
 22      0.31270310             8.23783180D-03   
 23      0.15985137             1.24885703D-04   
 24      0.81716807E-01         4.06573113D-04   
 25      0.41774304E-01        -6.17635376D-05   
 26      0.21355392E-01         5.94815776D-05   
S   26
  1 32285234.0000000           -1.57497747D-08   
  2 6610569.9000000            -8.72411388D-08   
  3 1564955.3000000            -4.93774123D-07   
  4 423553.2000000             -2.27930922D-06   
  5 129366.3600000             -9.13654361D-06   
  6  43958.9520000             -3.20148504D-05   
  7  16371.7030000             -1.00824449D-04   
  8   6583.7187000             -2.88212088D-04   
  9   2818.2848000             -7.63951258D-04   
 10   1267.5889000             -1.86315219D-03   
 11    592.2432600             -4.18177659D-03   
 12    284.6969400             -8.20097201D-03   
 13    139.7161600             -1.28963968D-02   
 14     69.5735620             -1.04001312D-02   
 15     34.9921060              1.21468093D-02   
 16     17.7155420              6.39352580D-02   
 17      9.0065037              7.81936964D-02   
 18      4.5905463             -2.48900308D-02   
 19      2.3432167             -1.33082357D-01   
 20      1.1970399             -1.57342029D-01   
 21      0.61175889            -1.09185164D-01   
 22      0.31270310             2.01240354D-03   
 23      0.15985137             2.04844531D-01   
 24      0.81716807E-01         4.48363676D-01   
 25      0.41774304E-01         3.90620031D-01   
 26      0.21355392E-01         8.85684977D-02   
P   17
  1  43958.9520000              9.96981905D-06   
  2  16371.7030000              3.67150606D-05   
  3   6583.7187000              1.82283690D-04   
  4   2818.2848000              7.29384732D-04   
  5   1267.5889000              2.72250622D-03   
  6    592.2432600              9.27932730D-03   
  7    284.6969400              2.86267102D-02   
  8    139.7161600              7.87885237D-02   
  9     69.5735620              1.79725666D-01   
 10     34.9921060              3.11995711D-01   
 11     17.7155420              3.52077963D-01   
 12      9.0065037              1.88907271D-01   
 13      4.5905463              3.38693557D-02   
 14      2.3432167              3.23904716D-03   
 15      1.1970399              2.78642133D-04   
 16      0.61175889             3.38007045D-04   
 17      0.31270310             1.46080162D-05   
P   17
  1  43958.9520000              3.67782641D-06   
  2  16371.7030000              1.34744569D-05   
  3   6583.7187000              6.73267508D-05   
  4   2818.2848000              2.68544201D-04   
  5   1267.5889000              1.00920750D-03   
  6    592.2432600              3.45016372D-03   
  7    284.6969400              1.08017762D-02   
  8    139.7161600              3.03803285D-02   
  9     69.5735620              7.20490590D-02   
 10     34.9921060              1.31101665D-01   
 11     17.7155420              1.54602208D-01   
 12      9.0065037              5.91124638D-03   
 13      4.5905463             -2.79486721D-01   
 14      2.3432167             -4.17344694D-01   
 15      1.1970399             -3.17101150D-01   
 16      0.61175889            -1.09282839D-01   
 17      0.31270310            -1.85993584D-02   
D   14
  1    592.2432600              1.47400259D-04   
  2    284.6969400              4.14463089D-04   
  3    139.7161600              2.10301515D-03   
  4     69.5735620              7.81434122D-03   
  5     34.9921060              2.53729960D-02   
  6     17.7155420              6.79294479D-02   
  7      9.0065037              1.47905604D-01   
  8      4.5905463              2.32766729D-01   
  9      2.3432167              2.69988021D-01   
 10      1.1970399              2.51786447D-01   
 11      0.61175889             1.96394960D-01   
 12      0.31270310             1.26607924D-01   
 13      0.15985137             5.68967346D-02   
 14      0.81716807E-01         1.56562081D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Zn
data:
ZINC
S   26
  1 68088788.0000000            3.38211660D-07   
  2 13880630.0000000            1.89779619D-06   
  3 3241320.5000000             1.09819101D-05   
  4 859030.6100000              5.24338084D-05   
  5 255624.8800000              2.18006702D-04   
  6  84392.1380000              7.95969133D-04   
  7  30517.3160000              2.60050792D-03   
  8  11930.1220000              7.70372384D-03   
  9   4977.4883000              2.09099926D-02   
 10   2189.6622000              5.18961541D-02   
 11   1004.5591000              1.15672705D-01   
 12    476.0398200              2.19927808D-01   
 13    231.1404400              3.21010214D-01   
 14    114.2406700              2.88251125D-01   
 15     57.1781220              1.10144784D-01   
 16     28.8661110              9.35875045D-03   
 17     14.6564610              1.14322723D-03   
 18      7.4687591             -4.32743336D-04   
 19      3.8143902              2.65826169D-04   
 20      1.9505199             -2.40875755D-04   
 21      0.99808774             1.47011761D-04   
 22      0.51089338            -1.02181453D-04   
 23      0.26154957             6.41914479D-05   
 24      0.13390619            -3.58623893D-05   
 25      0.68557335E-01         1.56003909D-05   
 26      0.35100111E-01        -3.83365022D-06   
S   26
  1 68088788.0000000           -1.04454381D-07   
  2 13880630.0000000           -5.85867223D-07   
  3 3241320.5000000            -3.39210992D-06   
  4 859030.6100000             -1.61878164D-05   
  5 255624.8800000             -6.73676613D-05   
  6  84392.1380000             -2.45978236D-04   
  7  30517.3160000             -8.06048042D-04   
  8  11930.1220000             -2.39755893D-03   
  9   4977.4883000             -6.59279878D-03   
 10   2189.6622000             -1.67571070D-02   
 11   1004.5591000             -3.94299238D-02   
 12    476.0398200             -8.30195495D-02   
 13    231.1404400             -1.48793587D-01   
 14    114.2406700             -1.86050260D-01   
 15     57.1781220             -6.31002808D-02   
 16     28.8661110              3.14151147D-01   
 17     14.6564610              5.66662261D-01   
 18      7.4687591              2.67768351D-01   
 19      3.8143902              2.78227096D-02   
 20      1.9505199              3.95693106D-03   
 21      0.99808774            -3.81595211D-04   
 22      0.51089338             6.86124192D-04   
 23      0.26154957            -3.71704047D-04   
 24      0.13390619             2.11370549D-04   
 25      0.68557335E-01        -9.15832960D-05   
 26      0.35100111E-01         2.25061590D-05   
S   26
  1 68088788.0000000           -3.94382252D-08   
  2 13880630.0000000           -2.21275470D-07   
  3 3241320.5000000            -1.28065280D-06   
  4 859030.6100000             -6.11425514D-06   
  5 255624.8800000             -2.54336249D-05   
  6  84392.1380000             -9.29269682D-05   
  7  30517.3160000             -3.04387750D-04   
  8  11930.1220000             -9.06678989D-04   
  9   4977.4883000             -2.49436828D-03   
 10   2189.6622000             -6.36695615D-03   
 11   1004.5591000             -1.50581820D-02   
 12    476.0398200             -3.21751844D-02   
 13    231.1404400             -5.90891990D-02   
 14    114.2406700             -7.78029712D-02   
 15     57.1781220             -2.80286857D-02   
 16     28.8661110              1.67648778D-01   
 17     14.6564610              4.35201524D-01   
 18      7.4687591              2.55434394D-01   
 19      3.8143902             -3.36265162D-01   
 20      1.9505199             -6.06249834D-01   
 21      0.99808774            -3.34464848D-01   
 22      0.51089338            -4.22626545D-02   
 23      0.26154957            -3.88985363D-03   
 24      0.13390619             1.55530904D-03   
 25      0.68557335E-01        -7.58397709D-04   
 26      0.35100111E-01         1.94301416D-04   
S   26
  1 68088788.0000000           -7.89943965D-09   
  2 13880630.0000000           -4.43189557D-08   
  3 3241320.5000000            -2.56516565D-07   
  4 859030.6100000             -1.22461081D-06   
  5 255624.8800000             -5.09446384D-06   
  6  84392.1380000             -1.86122218D-05   
  7  30517.3160000             -6.09738655D-05   
  8  11930.1220000             -1.81613917D-04   
  9   4977.4883000             -4.99804656D-04   
 10   2189.6622000             -1.27603259D-03   
 11   1004.5591000             -3.02099756D-03   
 12    476.0398200             -6.46391727D-03   
 13    231.1404400             -1.19150238D-02   
 14    114.2406700             -1.57749264D-02   
 15     57.1781220             -5.76710810D-03   
 16     28.8661110              3.51669425D-02   
 17     14.6564610              9.56215040D-02   
 18      7.4687591              5.74820186D-02   
 19      3.8143902             -8.93219136D-02   
 20      1.9505199             -1.82886888D-01   
 21      0.99808774            -1.87219382D-01   
 22      0.51089338            -6.01700638D-02   
 23      0.26154957             1.51254694D-01   
 24      0.13390619             4.13341005D-01   
 25      0.68557335E-01         4.19680427D-01   
 26      0.35100111E-01         1.92640246D-01   
P   17
  1  30517.3160000              2.12495701D-05   
  2  11930.1220000              6.72713110D-05   
  3   4977.4883000              3.26637054D-04   
  4   2189.6622000              1.23772821D-03   
  5   1004.5591000              4.46054887D-03   
  6    476.0398200              1.46376451D-02   
  7    231.1404400              4.33069420D-02   
  8    114.2406700              1.12217041D-01   
  9     57.1781220              2.32283129D-01   
 10     28.8661110              3.50305572D-01   
 11     14.6564610              3.06238564D-01   
 12      7.4687591              1.10443779D-01   
 13      3.8143902              1.28446305D-02   
 14      1.9505199              1.34032381D-03   
 15      0.99808774             3.71438801D-04   
 16      0.51089338             7.48861282D-05   
 17      0.26154957             1.73673937D-05   
P   17
  1  30517.3160000              7.91694820D-06   
  2  11930.1220000              2.51741348D-05   
  3   4977.4883000              1.21802493D-04   
  4   2189.6622000              4.64090983D-04   
  5   1004.5591000              1.67432271D-03   
  6    476.0398200              5.55255903D-03   
  7    231.1404400              1.66618995D-02   
  8    114.2406700              4.45619402D-02   
  9     57.1781220              9.59583543D-02   
 10     28.8661110              1.53689723D-01   
 11     14.6564610              1.23405985D-01   
 12      7.4687591             -1.09194891D-01   
 13      3.8143902             -3.68937673D-01   
 14      1.9505199             -4.06394518D-01   
 15      0.99808774            -2.27359584D-01   
 16      0.51089338            -4.86016736D-02   
 17      0.26154957            -6.05179097D-03   
D   14
  1   1004.5591000              5.88227095D-05   
  2    476.0398200              1.79256314D-04   
  3    231.1404400              9.43519393D-04   
  4    114.2406700              3.76762591D-03   
  5     57.1781220              1.38090017D-02   
  6     28.8661110              4.10450700D-02   
  7     14.6564610              1.02717821D-01   
  8      7.4687591              1.96233195D-01   
  9      3.8143902              2.67706448D-01   
 10      1.9505199              2.78265146D-01   
 11      0.99808774             2.31018664D-01   
 12      0.51089338             1.50369830D-01   
 13      0.26154957             6.54579042D-02   
 14      0.13390619             1.79813615D-02


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ga
data:
GALLIUM
S   26
  1 73580197.0000000            3.36002775D-07   
  2 14657018.0000000            1.95440944D-06   
  3 3366679.4000000             1.14779151D-05   
  4 882769.1200000              5.53890930D-05   
  5 261136.4100000              2.31278813D-04   
  6  86013.2530000              8.44646387D-04   
  7  31108.4660000              2.75324791D-03   
  8  12179.8660000              8.12758795D-03   
  9   5091.6945000              2.19781221D-02   
 10   2243.6525000              5.43339541D-02   
 11   1030.2315000              1.20535422D-01   
 12    488.1073400              2.27280676D-01   
 13    236.6734800              3.25822425D-01   
 14    116.6812100              2.80881998D-01   
 15     58.1936730              9.86703773D-02   
 16     29.2504670              7.03539281D-03   
 17     14.7769390              9.99782224D-04   
 18      7.4886157             -3.94297376D-04   
 19      3.8021330              2.13864321D-04   
 20      1.9324333             -1.95522208D-04   
 21      0.98268876             1.17530382D-04   
 22      0.49984826            -8.05042506D-05   
 23      0.25427675             5.05653346D-05   
 24      0.12935744            -2.81617616D-05   
 25      0.65808289E-01         1.23134316D-05   
 26      0.33478856E-01        -3.03476560D-06   
S   26
  1 73580197.0000000           -1.04154558D-07   
  2 14657018.0000000           -6.05532002D-07   
  3 3366679.4000000            -3.55842521D-06   
  4 882769.1200000             -1.71621055D-05   
  5 261136.4100000             -7.17356242D-05   
  6  86013.2530000             -2.61974854D-04   
  7  31108.4660000             -8.56726800D-04   
  8  12179.8660000             -2.53952428D-03   
  9   5091.6945000             -6.96235410D-03   
 10   2243.6525000             -1.76419860D-02   
 11   1030.2315000             -4.14215328D-02   
 12    488.1073400             -8.68568318D-02   
 13    236.6734800             -1.54287041D-01   
 14    116.6812100             -1.86481530D-01   
 15     58.1936730             -4.39555043D-02   
 16     29.2504670              3.56036177D-01   
 17     14.7769390              5.64366967D-01   
 18      7.4886157              2.29251847D-01   
 19      3.8021330              2.05534032D-02   
 20      1.9324333              2.66275297D-03   
 21      0.98268876             1.49758685D-04   
 22      0.49984826             1.48673896D-04   
 23      0.25427675            -4.94261039D-05   
 24      0.12935744             2.01114213D-05   
 25      0.65808289E-01        -8.95034938D-06   
 26      0.33478856E-01         1.72479233D-06   
S   26
  1 73580197.0000000            3.97222080D-08   
  2 14657018.0000000            2.30958736D-07   
  3 3366679.4000000             1.35708064D-06   
  4 882769.1200000              6.54604303D-06   
  5 261136.4100000              2.73587070D-05   
  6  86013.2530000              9.99398357D-05   
  7  31108.4660000              3.26852833D-04   
  8  12179.8660000              9.69737337D-04   
  9   5091.6945000              2.66187895D-03   
 10   2243.6525000              6.76935473D-03   
 11   1030.2315000              1.59957895D-02   
 12    488.1073400              3.40233837D-02   
 13    236.6734800              6.21187716D-02   
 14    116.6812100              7.90388811D-02   
 15     58.1936730              2.01016402D-02   
 16     29.2504670             -1.98272640D-01   
 17     14.7769390             -4.55949320D-01   
 18      7.4886157             -2.02060441D-01   
 19      3.8021330              4.08015407D-01   
 20      1.9324333              6.13894525D-01   
 21      0.98268876             2.72585580D-01   
 22      0.49984826             1.95662320D-02   
 23      0.25427675             3.54312320D-03   
 24      0.12935744            -1.68971799D-03   
 25      0.65808289E-01         8.23451059D-04   
 26      0.33478856E-01        -1.94908427D-04   
S   26
  1 73580197.0000000           -9.24067465D-09   
  2 14657018.0000000           -5.37334586D-08   
  3 3366679.4000000            -3.15694950D-07   
  4 882769.1200000             -1.52298181D-06   
  5 261136.4100000             -6.36433569D-06   
  6  86013.2530000             -2.32526427D-05   
  7  31108.4660000             -7.60357768D-05   
  8  12179.8660000             -2.25661721D-04   
  9   5091.6945000             -6.19381289D-04   
 10   2243.6525000             -1.57633031D-03   
 11   1030.2315000             -3.72670126D-03   
 12    488.1073400             -7.94494352D-03   
 13    236.6734800             -1.45507615D-02   
 14    116.6812100             -1.86562408D-02   
 15     58.1936730             -4.78717127D-03   
 16     29.2504670              4.85186365D-02   
 17     14.7769390              1.17727491D-01   
 18      7.4886157              5.18950373D-02   
 19      3.8021330             -1.25717900D-01   
 20      1.9324333             -2.36779935D-01   
 21      0.98268876            -2.21787124D-01   
 22      0.49984826             6.12613216D-03   
 23      0.25427675             3.35190666D-01   
 24      0.12935744             5.00378279D-01   
 25      0.65808289E-01         2.97510811D-01   
 26      0.33478856E-01         4.45760604D-02   
P   20
  1  31108.4660000              2.32319216D-05   
  2  12179.8660000              7.30284131D-05   
  3   5091.6945000              3.54121012D-04   
  4   2243.6525000              1.33601956D-03   
  5   1030.2315000              4.81056946D-03   
  6    488.1073400              1.57660509D-02   
  7    236.6734800              4.66414882D-02   
  8    116.6812100              1.20235535D-01   
  9     58.1936730              2.45732851D-01   
 10     29.2504670              3.59183512D-01   
 11     14.7769390              2.91799081D-01   
 12      7.4886157              9.26796034D-02   
 13      3.8021330              9.61488794D-03   
 14      1.9324333              9.08433049D-04   
 15      0.98268876             4.47175265D-04   
 16      0.49984826            -8.81193310D-05   
 17      0.25427675             9.61846922D-05   
 18      0.12935744            -5.70769438D-05   
 19      0.65808289E-01         2.59549134D-05   
 20      0.33478856E-01        -7.54807254D-06   
P   20
  1  31108.4660000             -8.77468606D-06   
  2  12179.8660000             -2.77788519D-05   
  3   5091.6945000             -1.33840990D-04   
  4   2243.6525000             -5.08984900D-04   
  5   1030.2315000             -1.83157686D-03   
  6    488.1073400             -6.07862014D-03   
  7    236.6734800             -1.82338469D-02   
  8    116.6812100             -4.86419274D-02   
  9     58.1936730             -1.03496898D-01   
 10     29.2504670             -1.61193932D-01   
 11     14.7769390             -1.10793672D-01   
 12      7.4886157              1.48215729D-01   
 13      3.8021330              3.98472036D-01   
 14      1.9324333              4.00456651D-01   
 15      0.98268876             1.87128592D-01   
 16      0.49984826             2.91247947D-02   
 17      0.25427675             2.78558439D-03   
 18      0.12935744             5.31767361D-06   
 19      0.65808289E-01         2.81314324D-04   
 20      0.33478856E-01        -3.52399001D-05   
P   20
  1  31108.4660000              1.43104391D-06   
  2  12179.8660000              4.56210184D-06   
  3   5091.6945000              2.18147244D-05   
  4   2243.6525000              8.34873586D-05   
  5   1030.2315000              2.99040328D-04   
  6    488.1073400              9.97394080D-04   
  7    236.6734800              2.98685313D-03   
  8    116.6812100              8.01724752D-03   
  9     58.1936730              1.70843137D-02   
 10     29.2504670              2.69064649D-02   
 11     14.7769390              1.77892216D-02   
 12      7.4886157             -2.96766064D-02   
 13      3.8021330             -7.86412137D-02   
 14      1.9324333             -8.44387041D-02   
 15      0.98268876            -4.80008706D-02   
 16      0.49984826             6.38388956D-02   
 17      0.25427675             2.02101575D-01   
 18      0.12935744             3.67522110D-01   
 19      0.65808289E-01         3.26100309D-01   
 20      0.33478856E-01         2.03676261D-01   
D   14
  1   1030.2315000              6.92911374D-05   
  2    488.1073400              2.11435722D-04   
  3    236.6734800              1.11540181D-03   
  4    116.6812100              4.46890083D-03   
  5     58.1936730              1.63290046D-02   
  6     29.2504670              4.83621690D-02   
  7     14.7769390              1.19513063D-01   
  8      7.4886157              2.19773272D-01   
  9      3.8021330              2.87036792D-01   
 10      1.9324333              2.84417435D-01   
 11      0.98268876             2.14872958D-01   
 12      0.49984826             1.11880147D-01   
 13      0.25427675             3.27704000D-02   
 14      0.12935744             4.56892322D-03


