# all_value

name: LANL2TZ+
description: TZ triple zeta basis set designed for an ECP + diffuse d function
elt: Zn
data:
ZINC
S   1
  1      0.7997000              1.0000000        
S   1
  1      0.1752000              1.0000000        
S   1
  1      0.0556000              1.0000000        
P   1
  1      0.1202000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   3
  1     68.8500000              0.0258532        
  2     18.3200000              0.1651195        
  3      5.9220000              0.4468212        
D   1
  1      1.9270000              1.0000000        
D   1
  1      0.5528000              1.0000000        
D   1
  1      0.1700000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Sc
data:
SCANDIUM
S   1
  1      3.7170000              1.0000000        
S   1
  1      1.0970000              1.0000000        
S   1
  1      0.4164000              1.0000000        
S   1
  1      0.0761000              1.0000000        
S   1
  1      0.0284000              1.0000000        
P   1
  1     10.4000000              1.0000000        
P   1
  1      1.3110000              1.0000000        
P   1
  1      0.4266000              1.0000000        
P   1
  1      0.0470000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   3
  1     15.1300000              0.0379291        
  2      4.2050000              0.1738360        
  3      1.3030000              0.4268057        
D   1
  1      0.3680000              1.0000000        
D   1
  1      0.0812000              1.0000000        
F   1
  1      1.3350000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Ti
data:
TITANIUM
S   1
  1      4.3720000              1.0000000        
S   1
  1      1.0980000              1.0000000        
S   1
  1      0.4178000              1.0000000        
S   1
  1      0.0872000              1.0000000        
S   1
  1      0.0314000              1.0000000        
P   1
  1     12.5200000              1.0000000        
P   1
  1      1.4910000              1.0000000        
P   1
  1      0.4859000              1.0000000        
P   1
  1      0.0530000              1.0000000        
P   1
  1      0.0160000              1.0000000        
D   3
  1     20.2100000              0.0341682        
  2      5.4950000              0.1710005        
  3      1.6990000              0.4405849        
D   1
  1      0.4840000              1.0000000        
D   1
  1      0.1157000              1.0000000        
F   1
  1      1.5060000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: V
data:
VANADIUM
S   1
  1      4.5900000              1.0000000        
S   1
  1      1.4930000              1.0000000        
S   1
  1      0.5570000              1.0000000        
S   1
  1      0.0975000              1.0000000        
S   1
  1      0.0342000              1.0000000        
P   1
  1     13.7600000              1.0000000        
P   1
  1      1.7120000              1.0000000        
P   1
  1      0.5587000              1.0000000        
P   1
  1      0.0590000              1.0000000        
P   1
  1      0.0180000              1.0000000        
D   3
  1     25.7000000              0.0331033        
  2      6.5300000              0.1795753        
  3      2.0780000              0.4373062        
D   1
  1      0.6243000              1.0000000        
D   1
  1      0.1542000              1.0000000        
F   1
  1      1.7510000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Cr
data:
CHROMIUM
S   1
  1      5.3610000              1.0000000        
S   1
  1      1.4490000              1.0000000        
S   1
  1      0.5496000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0364000              1.0000000        
P   1
  1     16.4200000              1.0000000        
P   1
  1      1.9140000              1.0000000        
P   1
  1      0.6241000              1.0000000        
P   1
  1      0.0630000              1.0000000        
P   1
  1      0.0190000              1.0000000        
D   3
  1     28.9500000              0.0337787        
  2      7.7080000              0.1780345        
  3      2.4950000              0.4370008        
D   1
  1      0.7655000              1.0000000        
D   1
  1      0.1889000              1.0000000        
F   1
  1      1.9410000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Mn
data:
MANGANESE
S   1
  1      5.9140000              1.0000000        
S   1
  1      1.6050000              1.0000000        
S   1
  1      0.6260000              1.0000000        
S   1
  1      0.1115000              1.0000000        
S   1
  1      0.0380000              1.0000000        
P   1
  1     18.2000000              1.0000000        
P   1
  1      2.1410000              1.0000000        
P   1
  1      0.7009000              1.0000000        
P   1
  1      0.0690000              1.0000000        
P   1
  1      0.0210000              1.0000000        
D   3
  1     32.2700000              0.0341580        
  2      8.8750000              0.1761105        
  3      2.8900000              0.4394298        
D   1
  1      0.8761000              1.0000000        
D   1
  1      0.2120000              1.0000000        
F   1
  1      2.1950000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Fe
data:
IRON
S   1
  1      6.4220000              1.0000000        
S   1
  1      1.8260000              1.0000000        
S   1
  1      0.7135000              1.0000000        
S   1
  1      0.1021000              1.0000000        
S   1
  1      0.0363000              1.0000000        
P   1
  1     19.4800000              1.0000000        
P   1
  1      2.3890000              1.0000000        
P   1
  1      0.7795000              1.0000000        
P   1
  1      0.0740000              1.0000000        
P   1
  1      0.0220000              1.0000000        
D   3
  1     37.0800000              0.0329000        
  2     10.1000000              0.1787418        
  3      3.2200000              0.4487657        
D   1
  1      0.9628000              1.0000000        
D   1
  1      0.2262000              1.0000000        
F   1
  1      2.4620000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Co
data:
COBALT
S   1
  1      7.1760000              1.0000000        
S   1
  1      2.0090000              1.0000000        
S   1
  1      0.8055000              1.0000000        
S   1
  1      0.1070000              1.0000000        
S   1
  1      0.0375000              1.0000000        
P   1
  1     21.3900000              1.0000000        
P   1
  1      2.6500000              1.0000000        
P   1
  1      0.8619000              1.0000000        
P   1
  1      0.0800000              1.0000000        
P   1
  1      0.0230000              1.0000000        
D   3
  1     39.2500000              0.0361541        
  2     10.7800000              0.1896744        
  3      3.4960000              0.4524981        
D   1
  1      1.0660000              1.0000000        
D   1
  1      0.2606000              1.0000000        
F   1
  1      2.7800000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Ni
data:
NICKEL
S   1
  1      7.6200000              1.0000000        
S   1
  1      2.2940000              1.0000000        
S   1
  1      0.8760000              1.0000000        
S   1
  1      0.1153000              1.0000000        
S   1
  1      0.0396000              1.0000000        
P   1
  1     23.6600000              1.0000000        
P   1
  1      2.8930000              1.0000000        
P   1
  1      0.9435000              1.0000000        
P   1
  1      0.0840000              1.0000000        
P   1
  1      0.0240000              1.0000000        
D   3
  1     42.7200000              0.0372699        
  2     11.7600000              0.1956103        
  3      3.8170000              0.4561273        
D   1
  1      1.1690000              1.0000000        
D   1
  1      0.2836000              1.0000000        
F   1
  1      3.1300000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Cu
data:
COPPER
S   1
  1      8.1760000              1.0000000        
S   1
  1      2.5680000              1.0000000        
S   1
  1      0.9587000              1.0000000        
S   1
  1      0.1153000              1.0000000        
S   1
  1      0.0396000              1.0000000        
P   1
  1     25.6300000              1.0000000        
P   1
  1      3.1660000              1.0000000        
P   1
  1      1.0230000              1.0000000        
P   1
  1      0.0860000              1.0000000        
P   1
  1      0.0240000              1.0000000        
D   3
  1     41.3400000              0.0465424        
  2     11.4200000              0.2227824        
  3      3.8390000              0.4539059        
D   1
  1      1.2300000              1.0000000        
D   1
  1      0.3102000              1.0000000        
F   1
  1      3.5250000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Y
data:
YTTRIUM
S   1
  1      1.7510000              1.0000000        
S   1
  1      1.1430000              1.0000000        
S   1
  1      0.3581000              1.0000000        
S   1
  1      0.1058000              1.0000000        
S   1
  1      0.0318000              1.0000000        
P   1
  1      3.8840000              1.0000000        
P   1
  1      0.7660000              1.0000000        
P   1
  1      0.2890000              1.0000000        
P   1
  1      0.0629000              1.0000000        
P   1
  1      0.0223000              1.0000000        
D   2
  1      1.5230000              0.1074843        
  2      0.5634000              0.4563954        
D   1
  1      0.1834000              1.0000000        
D   1
  1      0.0569000              1.0000000        
F   1
  1      0.8350000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Zr
data:
ZIRCONIUM
S   1
  1      1.9760000              1.0000000        
S   1
  1      1.1540000              1.0000000        
S   1
  1      0.3910000              1.0000000        
S   1
  1      0.1001000              1.0000000        
S   1
  1      0.0334000              1.0000000        
P   1
  1      4.1920000              1.0000000        
P   1
  1      0.8764000              1.0000000        
P   1
  1      0.2972000              1.0000000        
P   1
  1      0.0724000              1.0000000        
P   1
  1      0.0243000              1.0000000        
D   2
  1      2.2690000              0.0599741        
  2      0.7855000              0.4734158        
D   1
  1      0.2615000              1.0000000        
D   1
  1      0.0802000              1.0000000        
F   1
  1      0.8750000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Nb
data:
NIOBIUM
S   1
  1      2.1820000              1.0000000        
S   1
  1      1.2090000              1.0000000        
S   1
  1      0.4165000              1.0000000        
S   1
  1      0.1454000              1.0000000        
S   1
  1      0.0392000              1.0000000        
P   1
  1      4.5190000              1.0000000        
P   1
  1      0.9406000              1.0000000        
P   1
  1      0.3492000              1.0000000        
P   1
  1      0.0752000              1.0000000        
P   1
  1      0.0247000              1.0000000        
D   2
  1      3.4660000              0.0315983        
  2      0.9938000              0.4834306        
D   1
  1      0.3350000              1.0000000        
D   1
  1      0.1024000              1.0000000        
F   1
  1      0.9520000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Mo
data:
MOLYBDENUM
S   1
  1      2.3610000              1.0000000        
S   1
  1      1.3090000              1.0000000        
S   1
  1      0.4500000              1.0000000        
S   1
  1      0.1681000              1.0000000        
S   1
  1      0.0423000              1.0000000        
P   1
  1      4.8950000              1.0000000        
P   1
  1      1.0440000              1.0000000        
P   1
  1      0.3877000              1.0000000        
P   1
  1      0.0780000              1.0000000        
P   1
  1      0.0247000              1.0000000        
D   2
  1      2.9930000              0.0527063        
  2      1.0630000              0.5003907        
D   1
  1      0.3721000              1.0000000        
D   1
  1      0.1178000              1.0000000        
F   1
  1      1.0430000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Tc
data:
TECHNETIUM
S   1
  1      2.3420000              1.0000000        
S   1
  1      1.6340000              1.0000000        
S   1
  1      0.5094000              1.0000000        
S   1
  1      0.1706000              1.0000000        
S   1
  1      0.0435000              1.0000000        
P   1
  1      5.2780000              1.0000000        
P   1
  1      1.1560000              1.0000000        
P   1
  1      0.4302000              1.0000000        
P   1
  1      0.0895000              1.0000000        
P   1
  1      0.0246000              1.0000000        
D   2
  1      4.6320000              0.0268724        
  2      1.2790000              0.5073089        
D   1
  1      0.4425000              1.0000000        
D   1
  1      0.1364000              1.0000000        
F   1
  1      1.1340000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Ru
data:
RUTHENIUM
S   1
  1      2.5650000              1.0000000        
S   1
  1      1.5080000              1.0000000        
S   1
  1      0.5129000              1.0000000        
S   1
  1      0.1362000              1.0000000        
S   1
  1      0.0417000              1.0000000        
P   1
  1      4.8590000              1.0000000        
P   1
  1      1.2190000              1.0000000        
P   1
  1      0.4413000              1.0000000        
P   1
  1      0.0830000              1.0000000        
P   1
  1      0.0250000              1.0000000        
D   2
  1      4.1950000              0.0485729        
  2      1.3770000              0.5105223        
D   1
  1      0.4828000              1.0000000        
D   1
  1      0.1501000              1.0000000        
F   1
  1      1.2350000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Rh
data:
RHODIUM
S   1
  1      2.6460000              1.0000000        
S   1
  1      1.7510000              1.0000000        
S   1
  1      0.5713000              1.0000000        
S   1
  1      0.1438000              1.0000000        
S   1
  1      0.0428000              1.0000000        
P   1
  1      5.4400000              1.0000000        
P   1
  1      1.3290000              1.0000000        
P   1
  1      0.4845000              1.0000000        
P   1
  1      0.0869000              1.0000000        
P   1
  1      0.0257000              1.0000000        
D   2
  1      3.6690000              0.0760059        
  2      1.4230000              0.5158852        
D   1
  1      0.5091000              1.0000000        
D   1
  1      0.1610000              1.0000000        
F   1
  1      1.3500000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Pd
data:
PALLADIUM
S   1
  1      2.7870000              1.0000000        
S   1
  1      1.9650000              1.0000000        
S   1
  1      0.6243000              1.0000000        
S   1
  1      0.1496000              1.0000000        
S   1
  1      0.0436000              1.0000000        
P   1
  1      5.9990000              1.0000000        
P   1
  1      1.4430000              1.0000000        
P   1
  1      0.5264000              1.0000000        
P   1
  1      0.0899000              1.0000000        
P   1
  1      0.0262000              1.0000000        
D   2
  1      6.0910000              0.0376146        
  2      1.7190000              0.5200479        
D   1
  1      0.6056000              1.0000000        
D   1
  1      0.1883000              1.0000000        
F   1
  1      1.4720000              1.0000000        


name: LANL2TZ(f)
description: TZ triple zeta basis set designed for an ECP + f polarization
elt: Ag
data:
SILVER
S   1
  1      2.9500000              1.0000000        
S   1
  1      2.1490000              1.0000000        
S   1
  1      0.6684000              1.0000000        
S   1
  1      0.0997000              1.0000000        
S   1
  1      0.0347000              1.0000000        
P   1
  1      6.5530000              1.0000000        
P   1
  1      1.5650000              1.0000000        
P   1
  1      0.5748000              1.0000000        
P   1
  1      0.0833000              1.0000000        
P   1
  1      0.0252000              1.0000000        
D   2
  1      3.3910000              0.1396938        
  2      1.5990000              0.4744421        
D   1
  1      0.6282000              1.0000000        
D   1
  1      0.2108000              1.0000000        
F   1
  1      1.6110000              1.0000000        


name: Lanl2-[5s4p4d2f]
description: N/A
elt: Rh
data:
RHODIUM
S   11
  1    327.6800000             -0.0009800        
  2    163.8400000              0.0055500        
  3     81.9200000             -0.0198300        
  4     40.9600000              0.0544400        
  5     20.4800000             -0.1562300        
  6     10.2400000              0.3511800        
  7      5.1200000             -0.6265400        
  8      2.5600000             -0.1291100        
  9      1.2800000              0.8471200        
 10      0.6400000              0.4147500        
 11      0.3200000              0.1326400        
S   12
  1    327.6800000              0.0002400        
  2    163.8400000             -0.0013300        
  3     81.9200000              0.0049000        
  4     40.9600000             -0.0136000        
  5     20.4800000              0.0412300        
  6     10.2400000             -0.0965400        
  7      5.1200000              0.2007300        
  8      2.5600000              0.0036100        
  9      1.2800000             -0.3011100        
 10      0.6400000             -0.2436200        
 11      0.3200000             -0.0908900        
 12      0.1600000              0.2190200        
S   1
  1      0.0793500              1.0000000        
S   1
  1      0.0345000              1.0000000        
S   1
  1      0.0200000              1.0000000        
P   9
  1    163.8400000              0.0004700        
  2     81.9200000             -0.0032400        
  3     40.9600000              0.0101200        
  4     20.4800000             -0.0449000        
  5     10.2400000              0.0931000        
  6      5.1200000             -0.2412500        
  7      2.5600000              0.2057500        
  8      1.2800000              0.5400800        
  9      0.6400000              0.3505500        
P   1
  1      0.2250000              1.0000000        
P   1
  1      0.0750000              1.0000000        
P   1
  1      0.0240000              1.0000000        
D   10
  1     37.4813370             -0.0003900        
  2     20.8229650             -0.0032000        
  3     11.5683140              0.0020200        
  4      6.4268410             -0.0045700        
  5      3.5704672              0.0444700        
  6      1.9835929              0.2169900        
  7      1.1019961              0.2789200        
  8      0.6122200              0.2864500        
  9      0.3401222              0.2112500        
 10      0.1889568              0.1385000        
D   1
  1      0.5400000              1.0000000        
D   1
  1      0.1800000              1.0000000        
D   1
  1      0.0600000              1.0000000        
F   1
  1      0.5000000              1.0000000        
F   1
  1      0.0800000              1.0000000        


name: Lanl2-[6s4p4d2f]
description: N/A
elt: Rh
data:
RHODIUM
S   11
  1    327.6800000             -0.0009800        
  2    163.8400000              0.0055500        
  3     81.9200000             -0.0198300        
  4     40.9600000              0.0544400        
  5     20.4800000             -0.1562300        
  6     10.2400000              0.3511800        
  7      5.1200000             -0.6265400        
  8      2.5600000             -0.1291100        
  9      1.2800000              0.8471200        
 10      0.6400000              0.4147500        
 11      0.3200000              0.1326400        
S   12
  1    327.6800000              0.0002400        
  2    163.8400000             -0.0013300        
  3     81.9200000              0.0049000        
  4     40.9600000             -0.0136000        
  5     20.4800000              0.0412300        
  6     10.2400000             -0.0965400        
  7      5.1200000              0.2007300        
  8      2.5600000              0.0036100        
  9      1.2800000             -0.3011100        
 10      0.6400000             -0.2436200        
 11      0.3200000             -0.0908900        
 12      0.1600000              0.2190200        
S   1
  1      0.0793500              1.0000000        
S   1
  1      0.0345000              1.0000000        
S   1
  1      0.0200000              1.0000000        
S   1
  1      0.0100000              1.0000000        
P   9
  1    163.8400000              0.0004700        
  2     81.9200000             -0.0032400        
  3     40.9600000              0.0101200        
  4     20.4800000             -0.0449000        
  5     10.2400000              0.0931000        
  6      5.1200000             -0.2412500        
  7      2.5600000              0.2057500        
  8      1.2800000              0.5400800        
  9      0.6400000              0.3505500        
P   1
  1      0.2250000              1.0000000        
P   1
  1      0.0750000              1.0000000        
P   1
  1      0.0240000              1.0000000        
D   10
  1     37.4813370             -0.0003900        
  2     20.8229650             -0.0032000        
  3     11.5683140              0.0020200        
  4      6.4268410             -0.0045700        
  5      3.5704672              0.0444700        
  6      1.9835929              0.2169900        
  7      1.1019961              0.2789200        
  8      0.6122200              0.2864500        
  9      0.3401222              0.2112500        
 10      0.1889568              0.1385000        
D   1
  1      0.5400000              1.0000000        
D   1
  1      0.1800000              1.0000000        
D   1
  1      0.0600000              1.0000000        
F   1
  1      0.5000000              1.0000000        
F   1
  1      0.0800000              1.0000000        


name: Lanl2DZ+1d1f
description: Lanl2DZ+1d1f
elt: Rh
data:
RHODIUM
S   3
  1      2.6460000             -1.3554084        
  2      1.7510000              1.6112233        
  3      0.5713000              0.5893814        
S   4
  1      2.6460000              1.1472137        
  2      1.7510000             -1.4943525        
  3      0.5713000             -0.8589704        
  4      0.1438000              1.0297241        
S   1
  1      0.0428000              1.0000000        
P   3
  1      5.4400000             -0.0987699        
  2      1.3290000              0.7433595        
  3      0.4845000              0.3668462        
P   2
  1      0.6595000             -0.0838056        
  2      0.0869000              1.0244841        
P   1
  1      0.0257000              1.0000000        
D   3
  1      3.6690000              0.0760059        
  2      1.4230000              0.5158852        
  3      0.5091000              0.5436585        
D   1
  1      0.1610000              1.0000000        
D   1
  1      0.0800000              1.0000000        
F   1
  1      0.5000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: H
data:
HYDROGEN
S   4
  1     50.9991780              0.0096605        
  2      7.4832181              0.0737289        
  3      1.7774676              0.2958581        
  4      0.5193295              0.7159053        
S   1
  1      0.1541100              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: He
data:
HELIUM
S   5
  1    221.3880300              0.0027491        
  2     33.2619660              0.0208658        
  3      7.5616549              0.0970588        
  4      2.0855990              0.2807289        
  5      0.6143392              0.4742218        
S   1
  1      0.1829212              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Li
data:
LITHIUM
S   6
  1    605.7053900             -0.0022870        
  2     90.8609070             -0.0174528        
  3     20.6312710             -0.0836970        
  4      5.7384462             -0.2597485        
  5      1.7515261             -0.4794613        
  6      0.5463901             -0.3233006        
S   2
  1      0.8427233              0.0748609        
  2      0.0674483             -0.6546490        
S   1
  1      0.0253733              1.0000000        
P   1
  1      0.0773000              1.0000000        
D   1
  1      0.1220000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Be
data:
BERYLLIUM
S   6
  1   1203.4141000              0.0020504        
  2    180.2457100              0.0157078        
  3     40.8000540              0.0768315        
  4     11.3365380              0.2480252        
  5      3.5034830              0.4798452        
  6      1.1091216              0.3371459        
S   2
  1      1.9593420             -0.0750455        
  2      0.1652013              0.5813557        
S   1
  1      0.0552208              1.0000000        
P   1
  1      0.1665000              1.0000000        
D   1
  1      0.2780000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: B
data:
BORON
S   6
  1   1915.1666000             -0.0020395        
  2    287.1831100             -0.0155966        
  3     65.1571760             -0.0762442        
  4     18.1958270             -0.2479244        
  5      5.7015379             -0.4790823        
  6      1.8438375             -0.3352953        
S   2
  1      3.4914304              0.0774224        
  2      0.3050560             -0.5741239        
S   1
  1      0.0964865              1.0000000        
P   4
  1     11.6874170              0.0150861        
  2      2.6307755              0.0888157        
  3      0.7442269              0.2903682        
  4      0.2304761              0.4994433        
P   1
  1      0.0699380              1.0000000        
D   1
  1      0.4000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: C
data:
CARBON
S   6
  1   2808.0645000              0.0020178        
  2    421.1382800              0.0154332        
  3     95.5866160              0.0755815        
  4     26.7390040              0.2478282        
  5      8.4328268              0.4793725        
  6      2.7605821              0.3338344        
S   2
  1      5.4470045             -0.0778408        
  2      0.4792422              0.5689560        
S   1
  1      0.1461565              1.0000000        
P   4
  1     18.1308520              0.0158547        
  2      4.0998832              0.0956828        
  3      1.1858370              0.3049119        
  4      0.3685974              0.4935016        
P   1
  1      0.1097200              1.0000000        
D   1
  1      0.6000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: N
data:
NITROGEN
S   6
  1   3845.4149000              0.0020186        
  2    577.5332300              0.0154078        
  3    131.3198300              0.0753714        
  4     36.8237810              0.2482122        
  5     11.6701150              0.4798274        
  6      3.8542604              0.3318012        
S   2
  1      7.8295611             -0.0776669        
  2      0.6877351              0.5654598        
S   1
  1      0.2040388              1.0000000        
P   4
  1     26.8098410              0.0154663        
  2      6.0681540              0.0964397        
  3      1.7676256              0.3083610        
  4      0.5466727              0.4911597        
P   1
  1      0.1587289              1.0000000        
D   1
  1      0.7000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: O
data:
OXYGEN
S   6
  1   5222.9022000             -0.0019364        
  2    782.5399400             -0.0148507        
  3    177.2674300             -0.0733187        
  4     49.5166880             -0.2451162        
  5     15.6664400             -0.4802847        
  6      5.1793599             -0.3359427        
S   2
  1     10.6014410              0.0788058        
  2      0.9423170             -0.5676952        
S   1
  1      0.2774746              1.0000000        
P   4
  1     33.4241260              0.0175603        
  2      7.6221714              0.1076300        
  3      2.2382093              0.3235256        
  4      0.6867300              0.4832229        
P   1
  1      0.1938135              1.0000000        
D   1
  1      0.8000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: F
data:
FLUORINE
S   6
  1   6384.7144000             -0.0020302        
  2    958.8865200             -0.0154981        
  3    218.1901000             -0.0757787        
  4     61.3647310             -0.2502723        
  5     19.6028960             -0.4801087        
  6      6.5648834             -0.3271614        
S   2
  1     13.8106940              0.0790707        
  2      1.2298665             -0.5681216        
S   1
  1      0.3584713              1.0000000        
P   4
  1     42.4699110              0.018317041      
  2      9.7138811              0.112451290      
  3      2.8640386              0.329777050      
  4      0.87460544             0.479977190      
P   1
  1      0.24250706             1.0000000        
D   1
  1      1.0000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ne
data:
NEON
S   6
  1   7883.8261000              0.0020375        
  2   1184.4055000              0.0155468        
  3    269.6730900              0.0759638        
  4     75.9416520              0.2511027        
  5     24.3210950              0.4804765        
  6      8.1832559              0.3251142        
S   2
  1     17.4495240             -0.0790100        
  2      1.5516316              0.5676274        
S   1
  1      0.4476985              1.0000000        
P   4
  1     52.9038080              0.0187911        
  2     12.1233610              0.1157605        
  3      3.5859225              0.3342627        
  4      1.0921634              0.4778038        
P   1
  1      0.2994419              1.0000000        
D   1
  1      1.2000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Na
data:
SODIUM
S   6
  1   9911.9960000              0.0019505        
  2   1487.4555000              0.0149171        
  3    337.9538500              0.0734166        
  4     94.9139450              0.2456910        
  5     30.3414990              0.4795611        
  6     10.1908390              0.3337212        
S   3
  1     21.2296480              0.0823029        
  2      1.9804176             -0.5608480        
  3      0.6188824             -0.5224378        
S   2
  1      0.6991738              0.0920975        
  2      0.0618270             -0.6708252        
S   1
  1      0.0237274              1.0000000        
P   4
  1     73.0853150              0.0167176        
  2     16.8645630              0.1065395        
  3      5.0553913              0.3242217        
  4      1.5920207              0.4891363        
P   1
  1      0.4702690              1.0000000        
P   1
  1      0.0647000              1.0000000        
D   1
  1      0.1169000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Mg
data:
MAGNESIUM
S   6
  1  12436.6750000             -0.0018333        
  2   1862.2232000             -0.0140828        
  3    421.3745200             -0.0700956        
  4    117.6930400             -0.2387718        
  5     37.4314530             -0.4787377        
  6     12.5054890             -0.3447773        
S   3
  1     25.4514000              0.0852140        
  2      2.4528765             -0.5646916        
  3      0.8051334             -0.5157275        
S   2
  1      1.0820076             -0.1113334        
  2      0.1083340              0.6481452        
S   1
  1      0.0399074              1.0000000        
P   4
  1     92.4632220              0.0162716        
  2     21.5017690              0.1045630        
  3      6.5374423              0.3224328        
  4      2.1180808              0.4940399        
P   1
  1      0.6583148              1.0000000        
P   1
  1      0.1061000              1.0000000        
D   1
  1      0.1870000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Al
data:
ALUMINUM
S   6
  1  14724.4510000              0.0018182        
  2   2205.4634000              0.0139581        
  3    499.3020700              0.0695009        
  4    139.5901400              0.2371062        
  5     44.4922770              0.4776104        
  6     14.9056910              0.3476339        
S   3
  1     30.0750650             -0.0878851        
  2      2.9838328              0.5677371        
  3      1.0209899              0.5105008        
S   2
  1      1.4927792              0.1341424        
  2      0.1692291             -0.6656758        
S   1
  1      0.0617449              1.0000000        
P   5
  1    127.9161300              0.0133024        
  2     29.7767780              0.0896710        
  3      9.0917384              0.2981308        
  4      3.0009865              0.4962628        
  5      0.9695584              0.3301450        
P   2
  1      0.3756001              0.2050982        
  2      0.1250989              0.5518102        
P   1
  1      0.0417398              1.0000000        
D   1
  1      0.3000000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Si
data:
SILICON
S   6
  1  17268.5770000             -0.0017974        
  2   2586.6509000             -0.0137970        
  3    585.6364100             -0.0687807        
  4    163.7736400             -0.2352508        
  5     52.2670280             -0.4766194        
  6     17.5416810             -0.3507726        
S   3
  1     35.1241390              0.0902137        
  2      3.5654227             -0.5722548        
  3      1.2591474             -0.5045537        
S   2
  1      1.9470144             -0.1508352        
  2      0.2367573              0.6745594        
S   1
  1      0.0858966              1.0000000        
P   5
  1    159.6817400             -0.0123932        
  2     37.2581720             -0.0850800        
  3     11.4382530             -0.2905513        
  4      3.8278336             -0.4985588        
  5      1.2679003             -0.3325624        
P   2
  1      0.5344095             -0.2264369        
  2      0.1829031             -0.5553035        
P   1
  1      0.0617873              1.0000000        
D   1
  1      0.4500000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: P
data:
PHOSPHOROUS
S   6
  1  20024.9360000             -0.0017787        
  2   2999.4410000             -0.0136541        
  3    679.0868000             -0.0681442        
  4    189.9438900             -0.2336137        
  5     60.6834770             -0.4757401        
  6     20.3982250             -0.3535470        
S   3
  1     40.5941630             -0.0922427        
  2      4.1972196              0.5774677        
  3      1.5192955              0.4983773        
S   2
  1      2.4458587              0.1631695        
  2      0.3116158             -0.6787174        
S   1
  1      0.1120101              1.0000000        
P   5
  1    195.3993700             -0.0116298        
  2     45.6667490             -0.0811413        
  3     14.0730670             -0.2837706        
  4      4.7572427             -0.5004074        
  5      1.6035065             -0.3357758        
P   2
  1      0.7039432             -0.2471697        
  2      0.2451145             -0.5552025        
P   1
  1      0.0831324              1.0000000        
D   1
  1      0.5500000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: S
data:
SULFUR
S   6
  1  23050.0670000             -0.0017567        
  2   3451.8663000             -0.0134894        
  3    781.2786700             -0.0674325        
  4    218.4765300             -0.2318604        
  5     69.8326320             -0.4749416        
  6     23.4947980             -0.3564992        
S   3
  1     46.4823770             -0.0940422        
  2      4.8807488              0.5828881        
  3      1.8014758              0.4923262        
S   2
  1      2.9778039              0.1731553        
  2      0.3942510             -0.6854363        
S   1
  1      0.1417028              1.0000000        
P   5
  1    231.3312600              0.0112789        
  2     54.1461640              0.0794257        
  3     16.7576180              0.2808799        
  4      5.7193197              0.5020190        
  5      1.9560351              0.3344146        
P   2
  1      0.8955912              0.2646811        
  2      0.3094227              0.5496127        
P   1
  1      0.1021157              1.0000000        
D   1
  1      0.6500000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Cl
data:
CHLORINE
S   6
  1  26351.4580000              0.0017324        
  2   3945.0567000              0.0133109        
  3    892.4383500              0.0666748        
  4    249.4174300              0.2300506        
  5     79.7215720              0.4742307        
  6     26.8311450              0.3595240        
S   3
  1     52.7853010             -0.0956296        
  2      5.6156429              0.5880840        
  3      2.1059076              0.4866982        
S   2
  1      3.5586149              0.1806891        
  2      0.4847981             -0.6884829        
S   1
  1      0.1733310              1.0000000        
P   5
  1    271.0782100             -0.0109257        
  2     63.5472080             -0.0775909        
  3     19.7371090             -0.2775159        
  4      6.7889937             -0.5031933        
  5      2.3480303             -0.3348426        
P   2
  1      1.1066864             -0.2765381        
  2      0.3829680             -0.5466768        
P   1
  1      0.1251133              1.0000000        
D   1
  1      0.7500000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ar
data:
ARGON
S   6
  1  29505.7740000             -0.0017375        
  2   4419.2162000             -0.0133381        
  3   1000.5770000             -0.0667249        
  4    280.0379800             -0.2298887        
  5     89.7120820             -0.4735744        
  6     30.2798780             -0.3599160        
S   3
  1     59.5144060              0.0970257        
  2      6.3997779             -0.5933987        
  3      2.4314709             -0.4810805        
S   2
  1      4.1875357             -0.1864000        
  2      0.5832562              0.6895689        
S   1
  1      0.2071081              1.0000000        
P   5
  1    313.0217600              0.0106753        
  2     73.4872310              0.0763095        
  3     22.8979880              0.2751270        
  4      7.9322148              0.5040719        
  5      2.7702696              0.3346271        
P   2
  1      1.3318953              0.2877000        
  2      0.4618615              0.5447527        
P   1
  1      0.1502194              1.0000000        
D   1
  1      0.8500000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: K
data:
POTASSIUM
S   6
  1  33078.6480000              0.0017267        
  2   4954.9024000              0.0132514        
  3   1122.1308000              0.0663142        
  4    314.2080700              0.2286724        
  5    100.7762900              0.4726698        
  6     34.0613480              0.3621416        
S   3
  1     66.6029310             -0.0984507        
  2      7.2644563              0.5941619        
  3      2.8036787              0.4799139        
S   3
  1      4.8324390              0.1972709        
  2      0.7058189             -0.6956473        
  3      0.2697520             -0.4228781        
S   2
  1      0.3533535             -0.1246783        
  2      0.0420916              0.7383633        
S   1
  1      0.0174485              1.0000000        
P   5
  1    367.5114600             -0.0100333        
  2     86.2608580             -0.0727348        
  3     26.8979680             -0.2679043        
  4      9.3541248             -0.5038367        
  5      3.2920581             -0.3426224        
P   2
  1      1.6209189             -0.2952722        
  2      0.5872493             -0.5563566        
P   1
  1      0.2046941              1.0000000        
P   1
  1      0.0408000              1.0000000        
D   1
  1      0.0741000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ca
data:
CALCIUM
S   6
  1  36930.0090000              0.0017128        
  2   5531.7097000              0.0131449        
  3   1252.7414000              0.0658359        
  4    350.8148500              0.2273606        
  5    112.5965800              0.4718469        
  6     38.0887930              0.3644995        
S   3
  1     74.1164700             -0.0997436        
  2      8.1843738              0.5952113        
  3      3.2003684              0.4785993        
S   3
  1      5.5283278              0.2071853        
  2      0.8378952             -0.7105804        
  3      0.3330333             -0.4109917        
S   2
  1      0.5088598             -0.1545511        
  2      0.0660244              0.7241643        
S   1
  1      0.0268590              1.0000000        
P   5
  1    421.3459200             -0.0096865        
  2     98.9759890             -0.0707599        
  3     30.9286980             -0.2636593        
  4     10.8116610             -0.5033651        
  5      3.8379800             -0.3466308        
P   2
  1      1.9276019             -0.3026980        
  2      0.7256823             -0.5591628        
P   1
  1      0.2659863              1.0000000        
P   1
  1      0.0581000              1.0000000        
D   4
  1      7.2031146              0.0569478        
  2      1.8988074              0.1912518        
  3      0.5924974              0.2912302        
  4      0.1840388              0.2946869        
D   1
  1      0.0557044              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Sc
data:
SCANDIUM
S   6
  1  40355.9090000              0.0017333        
  2   6050.5154000              0.0132789        
  3   1372.4765000              0.0663041        
  4    385.2470400              0.2281044        
  5    124.0319400              0.4713657        
  6     42.1194230              0.3633764        
S   3
  1     82.1586980             -0.1008175        
  2      9.1349838              0.6005760        
  3      3.6000856              0.4731860        
S   3
  1      6.3109738              0.2096618        
  2      0.9654948             -0.7088848        
  3      0.3789351             -0.4149589        
S   2
  1      0.5339866             -0.1518766        
  2      0.0736986              0.7029741        
S   1
  1      0.0287205              1.0000000        
P   5
  1    483.1196600              0.0092716        
  2    113.2477300              0.0686349        
  3     35.3572540              0.2599716        
  4     12.3792040              0.5043357        
  5      4.4103725              0.3495890        
P   3
  1      2.2242378              0.3102315        
  2      0.8338992              0.5551398        
  3      0.3034508              0.2617353        
P   1
  1      0.0765000              1.0000000        
D   4
  1     10.6629030              0.0644752        
  2      2.7196219              0.2636906        
  3      0.7677085              0.4718955        
  4      0.1886336              0.5452150        
D   1
  1      0.0360000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ti
data:
TITANIUM
S   6
  1  44446.8960000             -0.0017276        
  2   6664.4146000             -0.0132329        
  3   1511.9865000             -0.0660837        
  4    424.5507800             -0.2274691        
  5    136.8002300             -0.4708755        
  6     46.5145350             -0.3644901        
S   3
  1     90.6049420             -0.1018126        
  2     10.1468580              0.6042992        
  3      4.0277164              0.4694450        
S   3
  1      7.1270376             -0.2127146        
  2      1.1031403              0.7104118        
  3      0.4324495              0.4153307        
S   2
  1      0.6155752             -0.1526574        
  2      0.0858581              0.6610350        
S   1
  1      0.0331033              1.0000000        
P   5
  1    537.6690300              0.0092080        
  2    126.3641400              0.0681868        
  3     39.5713790              0.2591324        
  4     13.9217500              0.5046390        
  5      4.9916806              0.3487787        
P   3
  1      2.5478908              0.3152197        
  2      0.9597935              0.5534010        
  3      0.3502063              0.2577543        
P   1
  1      0.0855000              1.0000000        
D   4
  1     13.5200160             -0.0624137        
  2      3.5074523             -0.2648016        
  3      1.0220948             -0.4797700        
  4      0.2627861             -0.5240558        
D   1
  1      0.0510000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: V
data:
VANADIUM
S   6
  1  49145.2580000             -0.0017049        
  2   7366.1009000             -0.0130685        
  3   1669.9598000             -0.0654044        
  4    468.4395900             -0.2259286        
  5    150.8210000             -0.4704403        
  6     51.2527760             -0.3670273        
S   3
  1     99.4801800             -0.1027169        
  2     11.2132640              0.6076980        
  3      4.4778252              0.4660731        
S   3
  1      7.9913350             -0.2147809        
  2      1.2468158              0.7109044        
  3      0.4873934              0.4162709        
S   2
  1      0.6908890             -0.1490260        
  2      0.0969866              0.6330897        
S   1
  1      0.0367640              1.0000000        
P   5
  1    595.1270700             -0.0091589        
  2    140.0039700             -0.0679657        
  3     43.9413770             -0.2588992        
  4     15.5269520             -0.5050116        
  5      5.5992158             -0.3473443        
P   3
  1      2.8892723             -0.3191486        
  2      1.0908884             -0.5518365        
  3      0.3981297             -0.2552426        
P   1
  1      0.0951000              1.0000000        
D   4
  1     16.2204730             -0.0616386        
  2      4.2547424             -0.2668608        
  3      1.2617714             -0.4844443        
  4      0.3315145             -0.5111355        
D   1
  1      0.0640000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Cr
data:
CHROMIUM
S   6
  1  52778.7450000              0.0017354        
  2   7918.3017000              0.0132775        
  3   1798.4871000              0.0661906        
  4    505.9200500              0.2273848        
  5    163.5005800              0.4700728        
  6     55.8176340              0.3647653        
S   3
  1    108.8041200              0.1035171        
  2     12.3273870             -0.6115169        
  3      4.9462295             -0.4623066        
S   3
  1      8.9020446              0.2161901        
  2      1.3966976             -0.7109203        
  3      0.5440141             -0.4173588        
S   2
  1      0.7773661              0.1468721        
  2      0.1070358             -0.6148496        
S   1
  1      0.0399077              1.0000000        
P   5
  1    661.7120400             -0.0089894        
  2    155.3130200             -0.0672768        
  3     48.7430800             -0.2579756        
  4     17.2660830             -0.5055800        
  5      6.2507652             -0.3471414        
P   3
  1      3.2504865             -0.3220208        
  2      1.2284088             -0.5504777        
  3      0.4478437             -0.2539024        
P   1
  1      0.1051000              1.0000000        
D   4
  1     18.8329730             -0.0617040        
  2      4.9791203             -0.2701080        
  3      1.4918696             -0.4880989        
  4      0.3958512             -0.5011105        
D   1
  1      0.0750000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Mn
data:
MANGANESE
S   6
  1  58745.6920000              0.0016835        
  2   8803.0393000              0.0129103        
  3   1994.9330000              0.0647226        
  4    559.3536300              0.2242657        
  5    180.1227000              0.4696949        
  6     61.2621340              0.3698049        
S   3
  1    118.5280300              0.1042770        
  2     13.5049460             -0.6140001        
  3      5.4431834             -0.4598971        
S   3
  1      9.8569553              0.2175547        
  2      1.5552163             -0.7108859        
  3      0.6046178             -0.4183703        
S   2
  1      0.8629655              0.1437611        
  2      0.1167188             -0.6009008        
S   1
  1      0.0428591              1.0000000        
P   5
  1    740.9276800             -0.0086420        
  2    173.9131300             -0.0652249        
  3     54.5184910             -0.2540417        
  4     19.3004140             -0.5061519        
  5      6.9893098             -0.3514232        
P   3
  1      3.6326196             -0.3248359        
  2      1.3738297             -0.5496415        
  3      0.5014289             -0.2517273        
P   1
  1      0.1129000              1.0000000        
D   4
  1     21.2579580              0.0630275        
  2      5.6579946              0.2754061        
  3      1.7029455              0.4916845        
  4      0.4518869              0.4914830        
D   1
  1      0.0820000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Fe
data:
IRON
S   6
  1  61430.2270000              0.0017559        
  2   9222.1760000              0.0134169        
  3   2097.5969000              0.0666954        
  4    591.4904000              0.2282051        
  5    191.8606200              0.4694499        
  6     65.8263280              0.3635569        
S   3
  1    128.7407400             -0.1049168        
  2     14.7181330              0.6179619        
  3      5.9507543              0.4560093        
S   3
  1     10.8598790              0.2184917        
  2      1.7194471             -0.7113310        
  3      0.6664532             -0.4186947        
S   2
  1      0.9754761             -0.1441054        
  2      0.1231143              0.5958134        
S   1
  1      0.0448795              1.0000000        
P   5
  1    780.6203000             -0.0091217        
  2    184.0062200             -0.0680040        
  3     58.0844670             -0.2597681        
  4     20.7597950             -0.5060138        
  5      7.5934515             -0.3419082        
P   3
  1      4.0279173             -0.3272962        
  2      1.5264700             -0.5481500        
  3      0.5573702             -0.2506629        
P   1
  1      0.1210000              1.0000000        
D   4
  1     23.9293160             -0.0634921        
  2      6.3999013             -0.2783913        
  3      1.9317417             -0.4938195        
  4      0.5115279             -0.4862694        
D   1
  1      0.0900000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Co
data:
COBALT
S   6
  1  67981.0420000             -0.0017024        
  2  10193.4280000             -0.0130386        
  3   2313.1814000             -0.0651880        
  4    650.0777900             -0.2250290        
  5    210.0601500             -0.4691457        
  6     71.7744980             -0.3686586        
S   3
  1    139.3222100              0.1055578        
  2     16.0027860             -0.6200954        
  3      6.4919353             -0.4539725        
S   3
  1     11.9103940             -0.2191273        
  2      1.8904105              0.7114201        
  3      0.7302278              0.4192248        
S   2
  1      1.0586020              0.1392893        
  2      0.1300905             -0.5864315        
S   1
  1      0.0468530              1.0000000        
P   5
  1    852.7913900             -0.0090266        
  2    201.0696400             -0.0675098        
  3     63.5213450             -0.2590251        
  4     22.7486490             -0.5063919        
  5      8.3427755             -0.3418521        
P   3
  1      4.4476087             -0.3289535        
  2      1.6858780             -0.5472994        
  3      0.6151209             -0.2500163        
P   1
  1      0.1266000              1.0000000        
D   4
  1     26.5324690             -0.0644759        
  2      7.1258945             -0.2823659        
  3      2.1547673             -0.4956536        
  4      0.5688600             -0.4806519        
D   1
  1      0.0970000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ni
data:
NICKEL
S   6
  1  72509.0420000             -0.0017208        
  2  10879.1760000             -0.0131637        
  3   2471.6460000             -0.0656567        
  4    695.8260600             -0.2259027        
  5    225.3750400             -0.4689157        
  6     77.2401580             -0.3672841        
S   3
  1    150.3641200              0.1061216        
  2     17.3310920             -0.6228997        
  3      7.0488555             -0.4512631        
S   3
  1     13.0063960             -0.2195590        
  2      2.0682821              0.7111742        
  3      0.7963434              0.4199687        
S   2
  1      1.1407612              0.1345042        
  2      0.1364956             -0.5791179        
S   1
  1      0.0486402              1.0000000        
P   5
  1    925.3782300              0.0089808        
  2    218.3791800              0.0672568        
  3     69.0758940              0.2587199        
  4     24.7941860              0.5067080        
  5      9.1177270              0.3412531        
P   3
  1      4.8865556              0.3302654        
  2      1.8520568              0.5465753        
  3      0.6748905              0.2496822        
P   1
  1      0.1351000              1.0000000        
D   4
  1     29.2296590             -0.0653953        
  2      7.8789145             -0.2860130        
  3      2.3861160             -0.4971564        
  4      0.6282437             -0.4756369        
D   1
  1      0.1040000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Cu
data:
COPPER
S   6
  1  80289.6200000             -0.0016562        
  2  12027.3380000             -0.0127093        
  3   2724.2575000             -0.0638518        
  4    763.5617300             -0.2221154        
  5    246.0645900             -0.4686049        
  6     83.8683630             -0.3733793        
S   3
  1    161.7972600              0.1066759        
  2     18.7253750             -0.6245943        
  3      7.6364165             -0.4496724        
S   3
  1     14.1508290             -0.2198077        
  2      2.2528304              0.7108760        
  3      0.8644886              0.4206571        
S   2
  1      1.2230963              0.1303169        
  2      0.1429771             -0.5708601        
S   1
  1      0.0504603              1.0000000        
P   5
  1   1002.9745000              0.0089143        
  2    236.6253000              0.0669704        
  3     74.8923210              0.2584147        
  4     26.9312520              0.5070620        
  5      9.9267759              0.3407511        
P   3
  1      5.3446648              0.3313745        
  2      2.0247480              0.5459871        
  3      0.7366331              0.2494767        
P   1
  1      0.1410000              1.0000000        
D   4
  1     31.8126670             -0.0668891        
  2      8.6058716             -0.2907401        
  3      2.6093411             -0.4984194        
  4      0.6852135             -0.4697251        
D   1
  1      0.1100000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Zn
data:
ZINC
S   6
  1  82904.2200000             -0.0017313        
  2  12444.2320000             -0.0132328        
  3   2829.8529000             -0.0658901        
  4    797.8928800             -0.2261988        
  5    259.0647300             -0.4683911        
  6     89.0795120             -0.3669156        
S   3
  1    173.6817200             -0.1071624        
  2     20.1664970              0.6264982        
  3      8.2470819              0.4478206        
S   3
  1     15.3165840             -0.2212375        
  2      2.4557493              0.7091911        
  3      0.9548777              0.4224147        
S   2
  1      1.4100034             -0.1404652        
  2      0.1693441              0.6012745        
S   1
  1      0.0592210              1.0000000        
P   5
  1   1085.1785000              0.0088260        
  2    256.1809300              0.0664455        
  3     81.1402530              0.2574246        
  4     29.2225200              0.5071455        
  5     10.7936950              0.3414356        
P   3
  1      5.8412904              0.3312125        
  2      2.2263660              0.5463761        
  3      0.8211640              0.2468144        
P   1
  1      0.1690000              1.0000000        
D   4
  1     38.0934670             -0.0606966        
  2     10.4237560             -0.2760500        
  3      3.2532521             -0.4982638        
  4      0.9097529             -0.4689898        
D   1
  1      0.1720000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ga
data:
GALLIUM
S   6
  1  88374.0450000              0.0017358        
  2  13268.9050000              0.0132605        
  3   3018.7941000              0.0659759        
  4    851.7884100              0.2262658        
  5    276.8761900              0.4681011        
  6     95.3453240              0.3668822        
S   3
  1    185.9603000             -0.1076453        
  2     21.6707490              0.6277265        
  3      8.8893894              0.4466379        
S   3
  1     16.5336260              0.2226595        
  2      2.6666023             -0.7081774        
  3      1.0515414             -0.4233846        
S   2
  1      1.5625465             -0.1577253        
  2      0.2076115              0.6391179        
S   1
  1      0.0735439              1.0000000        
P   5
  1   1163.1955000             -0.0088407        
  2    274.8972700             -0.0665062        
  3     87.2559890             -0.2573602        
  4     31.5348640             -0.5065298        
  5     11.7006110             -0.3411450        
P   3
  1      6.3876673             -0.3278164        
  2      2.4667022             -0.5424422        
  3      0.9361940             -0.2505594        
P   2
  1      0.3812727             -0.2124864        
  2      0.1255096             -0.5517548        
P   1
  1      0.0410717              1.0000000        
D   4
  1     38.0582720             -0.0700358        
  2     10.3615220             -0.3052574        
  3      3.1603523             -0.5167260        
  4      0.8477195             -0.4278052        
D   1
  1      0.1620000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ge
data:
GERMANIUM
S   6
  1 100666.2300000             -0.0016006        
  2  15061.9730000             -0.0123094        
  3   3404.1946000             -0.0622062        
  4    951.2169800             -0.2183436        
  5    305.6481000             -0.4675375        
  6    103.8813800             -0.3797132        
S   3
  1    198.5480300             -0.1081669        
  2     23.2648650              0.6266130        
  3      9.5835004              0.4477900        
S   3
  1     17.7891020             -0.2247444        
  2      2.8895735              0.7096098        
  3      1.1609259              0.4219827        
S   2
  1      1.7840838             -0.1776766        
  2      0.2538740              0.6676128        
S   1
  1      0.0921981              1.0000000        
P   5
  1   1316.9306000              0.0080489        
  2    310.7653200              0.0616066        
  3     98.0417160              0.2468894        
  4     35.1499910              0.5066484        
  5     12.9492470              0.3557105        
P   3
  1      6.9476147              0.3277649        
  2      2.7037889              0.5428977        
  3      1.0484809              0.2466886        
P   2
  1      0.4417125              0.2557696        
  2      0.1606094              0.5378329        
P   1
  1      0.0574076              1.0000000        
D   4
  1     43.6637510              0.0664648        
  2     11.9792100              0.2982969        
  3      3.7227864              0.5203260        
  4      1.0423715              0.4202894        
D   1
  1      0.2180000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: As
data:
ARSENIC
S   6
  1 107365.8600000             -0.0015957        
  2  16064.0530000             -0.0122722        
  3   3630.6518000             -0.0620362        
  4   1014.5283000             -0.2178657        
  5    326.0742900             -0.4672108        
  6    110.8651900             -0.3805783        
S   3
  1    211.6292400             -0.1086048        
  2     24.8873120              0.6271180        
  3     10.2861900              0.4473011        
S   3
  1     19.0905140             -0.2270113        
  2      3.1202838              0.7137823        
  3      1.2751351              0.4180248        
S   2
  1      2.0202307             -0.1944864        
  2      0.3032086              0.6871501        
S   1
  1      0.1113256              1.0000000        
P   5
  1   1416.2409000              0.0079561        
  2    334.2792000              0.0610373        
  3    105.5240000              0.2454926        
  4     37.8871400              0.5062554        
  5     13.9876120              0.3573375        
P   3
  1      7.5293458             -0.3275804        
  2      2.9610269             -0.5429651        
  3      1.1706232             -0.2433757        
P   2
  1      0.1962306             -0.5487952        
  2      0.5252210             -0.2795973        
P   1
  1      0.0704748              1.0000000        
D   4
  1     49.4288200              0.0636744        
  2     13.6481140              0.2927250        
  3      4.3052959              0.5233417        
  4      1.2466446              0.4142044        
D   1
  1      0.2730000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Se
data:
SELENIUM
S   6
  1 114288.7600000             -0.0015910        
  2  17099.7400000             -0.0122362        
  3   3864.6762000             -0.0618723        
  4   1079.9532000             -0.2174028        
  5    347.1853000             -0.4668917        
  6    118.0835800             -0.3814202        
S   3
  1    225.1277600             -0.1090202        
  2     26.5650680              0.6275629        
  3     11.0155830              0.4468661        
S   3
  1     20.4370160             -0.2294209        
  2      3.3604973              0.7197040        
  3      1.3940505              0.4125418        
S   2
  1      2.2645278             -0.2083219        
  2      0.3544357              0.7041515        
S   1
  1      0.1319064              1.0000000        
P   5
  1   1519.2830000              0.0078685        
  2    358.7246100              0.0604866        
  3    113.3100800              0.2441071        
  4     40.7375810              0.5058603        
  5     15.0697460              0.3589737        
P   3
  1      8.1294894              0.3282052        
  2      3.2274327              0.5438675        
  3      1.2950982              0.2388012        
P   2
  1      0.6126198              0.3087793        
  2      0.2272267              0.5447087        
P   1
  1      0.0806248              1.0000000        
D   4
  1     55.3721080              0.0614362        
  2     15.3729630              0.2882194        
  3      4.9092288              0.5259797        
  4      1.4602416              0.4090499        
D   1
  1      0.3210000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Br
data:
BROMINE
S   6
  1 115354.1000000              0.0016894        
  2  17308.3900000              0.0129218        
  3   3932.8534000              0.0645566        
  4   1107.7723000              0.2228721        
  5    359.6333600              0.4668336        
  6    123.6998800              0.3726870        
S   3
  1    239.1218000              0.1093640        
  2     28.2681270             -0.6294377        
  3     11.7505660             -0.4449871        
S   3
  1     21.8299640              0.2318734        
  2      3.6088257             -0.7272457        
  3      1.5164865             -0.4055866        
S   2
  1      2.5209367              0.2202626        
  2      0.4093415             -0.7163121        
S   1
  1      0.1530953              1.0000000        
P   5
  1   1580.3739000              0.0081757        
  2    373.0975500              0.0625525        
  3    118.3523300              0.2484745        
  4     42.8589550              0.5054137        
  5     15.9778740              0.3523443        
P   3
  1      8.7533275              0.3283504        
  2      3.5160335              0.5437991        
  3      1.4307378              0.2357859        
P   2
  1      0.7091508             -0.3244162        
  2      0.2656835             -0.5395416        
P   1
  1      0.0943995              1.0000000        
D   4
  1     61.5144140              0.0595777        
  2     17.1619830              0.2843781        
  3      5.5384706              0.5281856        
  4      1.6848166              0.4047724        
D   1
  1      0.3620000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Kr
data:
KRYPTON
S   6
  1 121095.8700000             -0.0017062        
  2  18179.4990000             -0.0130372        
  3   4135.0244000             -0.0649915        
  4   1166.5606000             -0.2236678        
  5    379.5258400             -0.4665839        
  6    130.8760500             -0.3715006        
S   3
  1    253.4819300              0.1097265        
  2     30.0462320             -0.6301801        
  3     12.5257890             -0.4442448        
S   3
  1     23.2690980             -0.2343607        
  2      3.8678875              0.7351894        
  3      1.6436802              0.3983798        
S   2
  1      2.7904565              0.2305767        
  2      0.4676485             -0.7249465        
S   1
  1      0.1750899              1.0000000        
P   5
  1   1659.8844000             -0.0083195        
  2    392.5200600             -0.0633941        
  3    124.8949600             -0.2500195        
  4     45.4285890             -0.5049266        
  5     17.0162090             -0.3497957        
P   3
  1      9.3987393             -0.3290142        
  2      3.8150619             -0.5438178        
  3      1.5717667             -0.2324568        
P   2
  1      0.8101745              0.3373338        
  2      0.3064747              0.5352931        
P   1
  1      0.1093540              1.0000000        
D   4
  1     67.8193990              0.0580719        
  2     19.0035410              0.2812775        
  3      6.1890315              0.5301052        
  4      1.9192995              0.4008533        
D   1
  1      0.4020000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Rb
data:
RUBIDIUM
S   6
  1 131515.0600000             -0.0016499        
  2  19719.2170000             -0.0126372        
  3   4474.3040000             -0.0633842        
  4   1257.7508000             -0.2201085        
  5    139.8153300             -0.3774800        
  6    407.5170000             -0.4659321        
S   3
  1    267.8455800              0.1102285        
  2     32.0025990             -0.6260558        
  3     13.4119460             -0.4484162        
S   3
  1     24.6854610             -0.2378679        
  2      4.1766912              0.7312414        
  3      1.8093356              0.4037899        
S   3
  1      3.0379536              0.2470808        
  2      0.5466666             -0.7279453        
  3      0.2210044             -0.4195015        
S   2
  1      0.3007990             -0.1476392        
  2      0.0377479              0.7643571        
S   1
  1      0.0159840              1.0000000        
P   5
  1   1813.8928000              0.0079110        
  2    428.1581200              0.0609081        
  3    135.8410900              0.2444233        
  4     49.2528820              0.5044221        
  5     18.4087530              0.3577504        
P   3
  1     10.1023830              0.3276215        
  2      4.1521422              0.5418507        
  3      1.7413779              0.2329981        
P   2
  1      0.9412337             -0.3459701        
  2      0.3790904             -0.5408154        
P   1
  1      0.1435002              1.0000000        
P   1
  1      0.0358000              1.0000000        
D   5
  1    130.8551500              0.0202737        
  2     37.9529440              0.1266624        
  3     13.4673380              0.3577686        
  4      4.9424752              0.4920449        
  5      1.7083314              0.2798508        
D   1
  1      0.0600000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Sr
data:
STRONTIUM
S   6
  1 139600.8400000             -0.0016378        
  2  20926.6590000             -0.0125499        
  3   4746.2276000             -0.0630238        
  4   1333.3111000             -0.2192939        
  5    431.6806900             -0.4657914        
  6    148.0023800             -0.3787658        
S   3
  1    283.0651900             -0.1105633        
  2     33.8934450              0.6267330        
  3     14.2498330              0.4476967        
S   3
  1     26.2389790             -0.2401835        
  2      4.4540778              0.7407144        
  3      1.9483734              0.3949994        
S   3
  1      3.3118117             -0.2623786        
  2      0.6212780              0.7529803        
  3      0.2607211              0.4020321        
S   2
  1      0.3926312             -0.1731545        
  2      0.0565242              0.7482808        
S   1
  1      0.0237396              1.0000000        
P   5
  1   1927.6125000              0.0078539        
  2    455.1146600              0.0605619        
  3    144.4781200              0.2434858        
  4     52.4628020              0.5039651        
  5     19.6517850              0.3588853        
P   3
  1     10.7758000             -0.3304770        
  2      4.4620421             -0.5419147        
  3      1.8943082             -0.2277387        
P   2
  1      1.0524225              0.3723870        
  2      0.4402490              0.5348795        
P   1
  1      0.1756503              1.0000000        
P   1
  1      0.0463000              1.0000000        
D   5
  1    143.1270800              0.0196512        
  2     41.6218040              0.1241418        
  3     14.8367350              0.3554270        
  4      5.4956655              0.4938418        
  5      1.9302776              0.2774254        
D   3
  1      0.9140951             -0.2160249        
  2      0.3459379             -0.2705849        
  3      0.1224188             -0.5160614        
D   1
  1      0.0780000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Y
data:
YTTRIUM
S   6
  1 147196.9900000              0.0016364        
  2  22066.5740000              0.0125372        
  3   5005.3894000              0.0629552        
  4   1406.3860000              0.2190656        
  5    455.5366200              0.4655018        
  6    156.2831900              0.3792505        
S   3
  1    298.9511500              0.1108066        
  2     35.7815850             -0.6293800        
  3     15.0710000             -0.4449943        
S   3
  1     27.8417380              0.2423388        
  2      4.7324406             -0.7530983        
  3      2.0840820             -0.3832947        
S   3
  1      3.6285134              0.2725480        
  2      0.6959899             -0.7660265        
  3      0.2918579             -0.3952102        
S   2
  1      0.4247937              0.1847383        
  2      0.0643254             -0.7652465        
S   1
  1      0.0259690              1.0000000        
P   5
  1   2045.5614000             -0.0077963        
  2    483.0653100             -0.0601997        
  3    153.4532500             -0.2424855        
  4     55.7920350             -0.5036148        
  5     20.9348750             -0.3600474        
P   3
  1     11.4475310             -0.3352234        
  2      4.7602696             -0.5433278        
  3      2.0395849             -0.2195077        
P   2
  1      1.1815298             -0.3829897        
  2      0.4985617             -0.5292642        
P   1
  1      0.2005795              1.0000000        
P   1
  1      0.0535000              1.0000000        
D   5
  1    163.4726300              0.0174785        
  2     47.6453440              0.1139084        
  3     17.0656350              0.3404451        
  4      6.3988715              0.4957676        
  5      2.3007206              0.2938499        
D   3
  1      1.5022957              0.1948034        
  2      0.4549400              0.4782609        
  3      0.1265615              0.5710845        
D   1
  1      0.0285000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Zr
data:
ZIRCONIUM
S   6
  1 154759.6100000              0.0016380        
  2  23203.4480000              0.0125462        
  3   5264.8042000              0.0629721        
  4   1479.9713000              0.2189916        
  5    479.7185800              0.4652423        
  6    164.7159700              0.3794577        
S   3
  1    314.9317300              0.1111347        
  2     37.8059870             -0.6292935        
  3     15.9702340             -0.4450823        
S   3
  1     29.4627660              0.2448339        
  2      5.0379026             -0.7607243        
  3      2.2358209             -0.3767339        
S   3
  1      3.9415221             -0.2819639        
  2      0.7773542              0.7737658        
  3      0.3276699              0.3936740        
S   2
  1      0.4766533             -0.1852031        
  2      0.0742047              0.7444872        
S   1
  1      0.0293677              1.0000000        
P   5
  1   2177.7945000             -0.0076791        
  2    514.1909100             -0.0594783        
  3    163.3112100             -0.2407304        
  4     59.3945900             -0.5032079        
  5     22.3076560             -0.3623951        
P   3
  1     12.1746660             -0.3374139        
  2      5.0974209             -0.5433643        
  3      2.2052320             -0.2153307        
P   2
  1      1.3125044             -0.3946016        
  2      0.5590442             -0.5242979        
P   1
  1      0.2270145              1.0000000        
P   1
  1      0.0596000              1.0000000        
D   5
  1    179.9142800              0.0165592        
  2     52.5186870              0.1097042        
  3     18.8702540              0.3346995        
  4      7.1277747              0.4974377        
  5      2.5954845              0.2976056        
D   3
  1      1.7662955             -0.2067470        
  2      0.5527131             -0.4956232        
  3      0.1594001             -0.5352037        
D   1
  1      0.0352000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Nb
data:
NIOBIUM
S   6
  1 161518.4400000              0.0016519        
  2  24228.1250000              0.0126413        
  3   5502.1840000              0.0633313        
  4   1548.8033000              0.2196490        
  5    502.9506100              0.4650191        
  6    173.0690000              0.3784935        
S   3
  1    331.4713300             -0.1114085        
  2     39.8504140              0.6303224        
  3     16.8719470              0.4440367        
S   3
  1     31.1400510              0.2471379        
  2      5.3478117             -0.7699948        
  3      2.3861171             -0.3684821        
S   3
  1      4.2712924             -0.2895512        
  2      0.8601071              0.7809394        
  3      0.3629884              0.3916610        
S   2
  1      0.5337331              0.1868077        
  2      0.0828485             -0.7251456        
S   1
  1      0.0322135              1.0000000        
P   5
  1   2299.5578000             -0.0076498        
  2    543.1280500             -0.0592846        
  3    172.6475200             -0.2401241        
  4     62.8807000             -0.5028628        
  5     23.6629070             -0.3630349        
P   3
  1     12.9174230             -0.3399631        
  2      5.4425230             -0.5434097        
  3      2.3745651             -0.2109462        
P   2
  1      1.4516914             -0.4021629        
  2      0.6228485             -0.5202113        
P   1
  1      0.2542567              1.0000000        
P   1
  1      0.0649000              1.0000000        
D   5
  1    194.6932400              0.0161191        
  2     56.9487500              0.1076899        
  3     20.5409950              0.3317767        
  4      7.8193562              0.4979379        
  5      2.8843399              0.2979210        
D   3
  1      2.0330360             -0.2153858        
  2      0.6520933             -0.5062715        
  3      0.1923867             -0.5108522        
D   1
  1      0.0417000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Mo
data:
MOLYBDENUM
S   6
  1 170343.9400000             -0.0016423        
  2  25548.8590000             -0.0125710        
  3   5800.4887000             -0.0630361        
  4   1632.0785000             -0.2189368        
  5    529.7896400             -0.4647520        
  6    182.2255000             -0.3797261        
S   3
  1    348.3331900              0.1117018        
  2     41.9786030             -0.6304345        
  3     17.8185170             -0.4439243        
S   3
  1     32.8585430             -0.2494502        
  2      5.6718438              0.7781576        
  3      2.5429626              0.3614287        
S   3
  1      4.6121484              0.2959207        
  2      0.9465116             -0.7850306        
  3      0.3994142             -0.3921630        
S   2
  1      0.5873355             -0.1849895        
  2      0.0909384              0.7054266        
S   1
  1      0.0347531              1.0000000        
P   5
  1   2428.0420000              0.0076041        
  2    573.5977900              0.0589976        
  3    182.4291400              0.2393360        
  4     66.5176470              0.5025254        
  5     25.0718740              0.3639697        
P   3
  1     13.6790300             -0.3427110        
  2      5.7958646             -0.5434750        
  3      2.5476963             -0.2065035        
P   2
  1      1.5962689              0.4084906        
  2      0.6878200              0.5168554        
P   1
  1      0.2814702              1.0000000        
P   1
  1      0.0697000              1.0000000        
D   5
  1    211.0407500             -0.0155709        
  2     61.8225910             -0.1051394        
  3     22.3657480             -0.3280576        
  4      8.5687267             -0.4987300        
  5      3.1940065             -0.2998007        
D   3
  1      2.3040401             -0.2224302        
  2      0.7535423             -0.5133561        
  3      0.2259020             -0.4927812        
D   1
  1      0.0482000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Tc
data:
TECHNETIUM
S   6
  1 179686.1900000             -0.0016302        
  2  26943.2630000             -0.0124839        
  3   6114.3029000             -0.0626766        
  4   1719.2835000             -0.2180935        
  5    557.7491400             -0.4644936        
  6    191.7046600             -0.3811596        
S   3
  1    365.6066200              0.1119961        
  2     44.1823210             -0.6301375        
  3     18.8025030             -0.4442314        
S   3
  1     34.6219410             -0.2516721        
  2      6.0080799              0.7853670        
  3      2.7051262              0.3553439        
S   3
  1      4.9630143              0.3012406        
  2      1.0356513             -0.7866986        
  3      0.4371554             -0.3944238        
S   2
  1      0.6430125             -0.1781723        
  2      0.0980066              0.6757694        
S   1
  1      0.0372164              1.0000000        
P   5
  1   2561.0052000              0.0075974        
  2    604.8569800              0.0582190        
  3    192.8161800              0.2401994        
  4     69.5182400              0.5084689        
  5     26.2105750              0.3577400        
P   3
  1    107.0895500             -0.0237932        
  2     12.2376130              0.4952180        
  3      4.4912118              0.5812543        
P   2
  1      1.8484030             -0.3817962        
  2      0.7711282             -0.5436058        
P   1
  1      0.3106871              1.0000000        
P   1
  1      0.0765000              1.0000000        
D   5
  1    228.8373200             -0.0149657        
  2     67.1657660             -0.1020690        
  3     24.3762200             -0.3231163        
  4      9.3936148             -0.4993646        
  5      3.5347228             -0.3038108        
D   3
  1      2.6524986             -0.2211562        
  2      0.8949099             -0.5106990        
  3      0.2768870             -0.4875796        
D   1
  1      0.0646000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ru
data:
RUTHENIUM
S   6
  1 188363.7000000             -0.0016283        
  2  28246.1540000             -0.0124680        
  3   6410.4558000             -0.0625988        
  4   1802.7696000             -0.2178482        
  5    584.9981000             -0.4642662        
  6    201.1428000             -0.3816352        
S   3
  1    383.3629200             -0.1122513        
  2     46.4090990              0.6306301        
  3     19.7924360              0.4437351        
S   3
  1     36.4371760             -0.2538161        
  2      6.3516227              0.7935927        
  3      2.8675119              0.3482381        
S   3
  1      5.3311415              0.3056042        
  2      1.1272716             -0.7880834        
  3      0.4757767             -0.3962728        
S   2
  1      0.7097161              0.1743661        
  2      0.1018585             -0.6666011        
S   1
  1      0.0383627              1.0000000        
P   5
  1   2680.7499000             -0.0076319        
  2    633.2076000             -0.0584876        
  3    201.9999500             -0.2409453        
  4     72.9651370             -0.5083816        
  5     27.5911420             -0.3564023        
P   3
  1    112.3755400              0.0239538        
  2     12.9704940             -0.4959182        
  3      4.8000426             -0.5795846        
P   2
  1      2.0022824              0.3909479        
  2      0.8344804              0.5399433        
P   1
  1      0.3368239              1.0000000        
P   1
  1      0.0820000              1.0000000        
D   5
  1    244.4694300             -0.0147564        
  2     71.8275810             -0.1012469        
  3     26.1354550             -0.3221165        
  4     10.1320530             -0.4992598        
  5      3.8536072             -0.3026771        
D   3
  1      2.9850999              0.2221427        
  2      1.0287513              0.5099612        
  3      0.3246385              0.4817461        
D   1
  1      0.0787000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Rh
data:
RHODIUM
S   6
  1 194399.5400000             -0.0016557        
  2  29173.2020000             -0.0126592        
  3   6630.9115000             -0.0633416        
  4   1869.1158000             -0.2193329        
  5    608.3512800             -0.4641347        
  6    209.9202100             -0.3793139        
S   3
  1    401.6496000             -0.1124641        
  2     48.6571160              0.6320222        
  3     20.7838600              0.4423307        
S   3
  1     38.3018720             -0.2558484        
  2      6.7034662              0.8020183        
  3      3.0313647              0.3409033        
S   3
  1      5.7142594              0.3090720        
  2      1.2196848             -0.7913780        
  3      0.5131545             -0.3956822        
S   2
  1      0.7792284              0.1731067        
  2      0.1052762             -0.6552429        
S   1
  1      0.0394174              1.0000000        
P   5
  1   2807.5195000             -0.0076445        
  2    663.5760100             -0.0585284        
  3    211.9429200             -0.2409256        
  4     76.6776170             -0.5081233        
  5     29.0602980             -0.3562086        
P   3
  1    117.8643700              0.0241241        
  2     13.7192250             -0.4969291        
  3      5.1161393             -0.5776992        
P   2
  1      2.1636268              0.3979395        
  2      0.9017759              0.5361914        
P   1
  1      0.3647145              1.0000000        
P   1
  1      0.0882000              1.0000000        
D   5
  1    263.3566400             -0.0142686        
  2     77.3886400             -0.0990218        
  3     28.1976500             -0.3190027        
  4     10.9766870             -0.4999267        
  5      4.2068087             -0.3046989        
D   3
  1      3.3322714              0.2221471        
  2      1.1672176              0.5096083        
  3      0.3733267              0.4779062        
D   1
  1      0.0924000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Pd
data:
PALLADIUM
S   6
  1 207193.1000000              0.0016166        
  2  31063.7720000              0.0123822        
  3   7047.7495000              0.0622323        
  4   1981.2001000              0.2169219        
  5    642.7533800              0.4638187        
  6    220.9533400              0.3832771        
S   3
  1    420.0886000              0.1127446        
  2     51.0438390             -0.6311858        
  3     21.8601170             -0.4431819        
S   3
  1     40.2013360              0.2579690        
  2      7.0760011             -0.8079526        
  3      3.2086931             -0.3361730        
S   3
  1      6.1041967             -0.3123386        
  2      1.3179249              0.7911463        
  3      0.5534537              0.3986219        
S   2
  1      0.8233603             -0.1623037        
  2      0.1088226              0.6448050        
S   1
  1      0.0401268              1.0000000        
P   5
  1   2972.4214000             -0.0075091        
  2    702.1149000             -0.0577011        
  3    224.0646400             -0.2390153        
  4     81.0236780             -0.5076466        
  5     30.7253050             -0.3589804        
P   3
  1    123.2597100              0.0242358        
  2     14.5119280             -0.4968331        
  3      5.4488286             -0.5770064        
P   2
  1      2.3322949              0.4036794        
  2      0.9711259              0.5333648        
P   1
  1      0.3928289              1.0000000        
P   1
  1      0.0904000              1.0000000        
D   5
  1    282.6718700              0.0138309        
  2     83.1650980              0.0968327        
  3     30.3585380              0.3155661        
  4     11.8627480              0.5007092        
  5      4.5710013              0.3072451        
D   3
  1      3.5936515              0.2314603        
  2      1.2599726              0.5150304        
  3      0.4004196              0.4655096        
D   1
  1      0.0952000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Ag
data:
SILVER
S   6
  1 215086.0600000             -0.0016282        
  2  32258.5880000             -0.0124621        
  3   7324.3644000             -0.0625339        
  4   2061.3101000             -0.2174846        
  5    669.7475600             -0.4636648        
  6    230.6433200             -0.3824312        
S   3
  1    439.1541500              0.1129571        
  2     53.4219390             -0.6320098        
  3     22.9168510             -0.4423542        
S   3
  1     42.1564060             -0.2599067        
  2      7.4525892              0.8150261        
  3      3.3834738              0.3302085        
S   3
  1      6.5120304              0.3148473        
  2      1.4164639             -0.7927725        
  3      0.5931207             -0.3990682        
S   2
  1      0.8927631             -0.1610001        
  2      0.1107510              0.6415571        
S   1
  1      0.0406475              1.0000000        
P   5
  1   3110.4582000              0.0075054        
  2    735.0493700              0.0576511        
  3    234.7802900              0.2388160        
  4     85.0022250              0.5073984        
  5     32.2947870              0.3590847        
P   3
  1    128.9915700             -0.0243955        
  2     15.3032130              0.4978927        
  3      5.7835900              0.5752185        
P   2
  1      2.5052560             -0.4091123        
  2      1.0423256             -0.5303257        
P   1
  1      0.4217877              1.0000000        
P   1
  1      0.0986000              1.0000000        
D   5
  1    310.2735600             -0.0128080        
  2     91.1443380             -0.0917817        
  3     33.2196170             -0.3079296        
  4     12.9831480             -0.5026952        
  5      5.0137566             -0.3158562        
D   3
  1      3.9789803              0.2289409        
  2      1.4220407              0.5106596        
  3      0.4626039              0.4660627        
D   1
  1      0.1162000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Cd
data:
CADMIUM
S   6
  1 225379.4600000              0.0016194        
  2  33798.1580000              0.0123976        
  3   7671.6419000              0.0622656        
  4   2158.1271000              0.2168328        
  5    700.9315700              0.4634149        
  6    241.2650200              0.3835714        
S   3
  1    458.5346300              0.1131940        
  2     55.8940770             -0.6318382        
  3     24.0314420             -0.4425207        
S   3
  1     44.1498140              0.2619017        
  2      7.8498518             -0.8197565        
  3      3.5739404             -0.3266451        
S   3
  1      6.9148481             -0.3193036        
  2      1.5269953              0.7908449        
  3      0.6491530              0.4036859        
S   2
  1      0.9796369             -0.1689889        
  2      0.1350007              0.6392561        
S   1
  1      0.0492193              1.0000000        
P   5
  1   3286.5491000             -0.0073707        
  2    776.7265400             -0.0567258        
  3    248.0698800             -0.2363825        
  4     89.7721430             -0.5066776        
  5     34.1129020             -0.3626949        
P   3
  1    134.6657100              0.0245168        
  2     16.1428550             -0.4976483        
  3      6.1401879             -0.5747280        
P   2
  1      2.6903112              0.4131505        
  2      1.1263601              0.5299429        
P   1
  1      0.4618970              1.0000000        
P   1
  1      0.1124000              1.0000000        
D   5
  1    323.8785000              0.0130333        
  2     95.5148200              0.0926147        
  3     35.0133540              0.3085042        
  4     13.7870570              0.5011372        
  5      5.3857296              0.3132880        
D   3
  1      4.4592175              0.2229832        
  2      1.6378356              0.5118175        
  3      0.5551158              0.4588206        
D   1
  1      0.1478000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: In
data:
INDIUM
S   6
  1 235861.1200000             -0.0016114        
  2  35365.2830000             -0.0123399        
  3   8025.2589000             -0.0620238        
  4   2256.7679000             -0.2162407        
  5    732.7353800             -0.4631674        
  6    252.1151800             -0.3846192        
S   3
  1    478.3767800             -0.1134149        
  2     58.4086520              0.6319863        
  3     25.1660720              0.4423582        
S   3
  1     46.2062970             -0.2637462        
  2      8.2521932              0.8257003        
  3      3.7616341              0.3217874        
S   3
  1      7.3377253              0.3232703        
  2      1.6380034             -0.7913041        
  3      0.7077128             -0.4052935        
S   2
  1      1.0796188              0.1916757        
  2      0.1634650             -0.6769690        
S   1
  1      0.0608676              1.0000000        
P   5
  1   3433.6412000             -0.0073653        
  2    811.3151900             -0.0567456        
  3    259.1487900             -0.2365663        
  4     93.8918430             -0.5064242        
  5     35.7711070             -0.3623434        
P   3
  1    140.4103100              0.0246722        
  2     17.0227790             -0.4965323        
  3      6.5292809             -0.5748598        
P   3
  1      2.8859793              0.4151222        
  2      1.2195438              0.5279892        
  3      0.5152136              0.1471352        
P   2
  1      0.2732522             -0.2392050        
  2      0.0989724             -0.5637124        
P   1
  1      0.0351330              1.0000000        
D   5
  1    337.4852800              0.0132701        
  2     99.5706610              0.0942483        
  3     36.5966250              0.3109702        
  4     14.4992050              0.5004293        
  5      5.6939458              0.3084718        
D   3
  1      4.3763223              0.2713087        
  2      1.5233570              0.5554482        
  3      0.4783456              0.3858803        
D   1
  1      0.1270000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Sn
data:
TIN
S   6
  1 245047.3600000             -0.0016162        
  2  36750.0260000             -0.0123711        
  3   8342.7735000             -0.0621339        
  4   2347.4723000             -0.2163977        
  5    762.8362000             -0.4629749        
  6    262.7379300             -0.3844478        
S   3
  1    498.7328300             -0.1136052        
  2     60.9504580              0.6327182        
  3     26.3056100              0.4416086        
S   3
  1     48.3039130             -0.2655359        
  2      8.6671437              0.8308897        
  3      3.9564692              0.3176724        
S   3
  1      7.7681446             -0.3275765        
  2      1.7526836              0.7939468        
  3      0.7702961              0.4049341        
S   2
  1      1.2005155             -0.2148420        
  2      0.1947026              0.7026114        
S   1
  1      0.0742741              1.0000000        
P   5
  1   3581.6969000             -0.0073659        
  2    846.7443400             -0.0567097        
  3    270.7320800             -0.2363375        
  4     98.2183720             -0.5060284        
  5     37.4960670             -0.3626046        
P   3
  1    146.3433800              0.0248184        
  2     17.9099630             -0.4961926        
  3      6.9164132             -0.5744256        
P   3
  1      3.0806013              0.4193038        
  2      1.3119684              0.5289039        
  3      0.5586859              0.1391701        
P   2
  1      0.3009037             -0.2999250        
  2      0.1154273             -0.5615155        
P   1
  1      0.0434033              1.0000000        
D   5
  1    354.2403300             -0.0132982        
  2    104.7107500             -0.0943270        
  3     38.6067210             -0.3110782        
  4     15.3717900             -0.4995839        
  5      6.0921833             -0.3069138        
D   3
  1      4.8471988             -0.2664558        
  2      1.7287563             -0.5581614        
  3      0.5654283             -0.3761591        
D   1
  1      0.1540000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Sb
data:
ANTIMONY
S   6
  1 256073.3300000              0.0016078        
  2  38397.8170000              0.0123108        
  3   8714.3415000              0.0618822        
  4   2451.0514000              0.2157809        
  5    796.1924700              0.4627403        
  6    274.0907700              0.3855250        
S   3
  1    519.3217400             -0.1138273        
  2     63.6010650              0.6323345        
  3     27.5109650              0.4419875        
S   3
  1     50.4449740             -0.2673314        
  2      9.0971555              0.8351708        
  3      4.1604915              0.3144869        
S   3
  1      8.2092774              0.3319585        
  2      1.8705087             -0.7985220        
  3      0.8347907             -0.4027937        
S   2
  1      1.3261741             -0.2342429        
  2      0.2273737              0.7214225        
S   1
  1      0.0877769              1.0000000        
P   5
  1   3762.0537000              0.0072735        
  2    889.0880800              0.0561261        
  3    284.1540300              0.2349295        
  4    103.0729400              0.5055388        
  5     39.3842220              0.3646855        
P   3
  1    152.3159800              0.0249555        
  2     18.8305710             -0.4954616        
  3      7.3182696             -0.5744357        
P   3
  1      3.2844080             -0.4228412        
  2      1.4113934             -0.5285978        
  3      0.6081456             -0.1331447        
P   2
  1      0.3496818             -0.3212522        
  2      0.1392780             -0.5534051        
P   1
  1      0.0540262              1.0000000        
D   5
  1    381.5766100              0.0126401        
  2    112.7069400              0.0910125        
  3     41.5310270              0.3060604        
  4     16.5461090              0.5007823        
  5      6.5775021              0.3123228        
D   3
  1      5.3229522              0.2628088        
  2      1.9379668              0.5602120        
  3      0.6551829              0.3682020        
D   1
  1      0.1820000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Te
data:
TELLURIUM
S   6
  1 265467.0400000             -0.0016137        
  2  39815.8570000             -0.0123502        
  3   9040.2222000             -0.0620254        
  4   2544.4469000             -0.2160078        
  5    827.3164400             -0.4625615        
  6    285.1167500             -0.3852361        
S   3
  1    540.4512500              0.1140164        
  2     66.2705480             -0.6327132        
  3     28.7163780             -0.4415960        
S   3
  1     52.6375880              0.2690376        
  2      9.5365952             -0.8396225        
  3      4.3672865             -0.3110886        
S   3
  1      8.6619854             -0.3363394        
  2      1.9915548              0.8048105        
  3      0.9007850              0.3990575        
S   2
  1      1.4550912              0.2495512        
  2      0.2602148             -0.7386960        
S   1
  1      0.1019078              1.0000000        
P   5
  1   3950.2179000             -0.0071737        
  2    933.9326600             -0.0554098        
  3    298.4950000             -0.2330318        
  4    108.2418000             -0.5049013        
  5     41.3777630             -0.3675117        
P   3
  1    158.4659600             -0.0250989        
  2     19.7717450              0.4949100        
  3      7.7301177              0.5743177        
P   3
  1      3.4938156              0.4266005        
  2      1.5152995              0.5276961        
  3      0.6596170              0.1277185        
P   2
  1      0.4064418              0.3387827        
  2      0.1625345              0.5418624        
P   1
  1      0.0622456              1.0000000        
D   5
  1    405.1688200             -0.0123197        
  2    119.7824400             -0.0892847        
  3     44.1813310             -0.3034428        
  4     17.6360980             -0.5012430        
  5      7.0441616             -0.3144661        
D   3
  1      5.8214668             -0.2586291        
  2      2.1579560             -0.5622119        
  3      0.7487736             -0.3625221        
D   1
  1      0.2120000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: I
data:
IODINE
S   6
  1 274845.4600000             -0.0016207        
  2  41233.1880000             -0.0123976        
  3   9366.7333000             -0.0622007        
  4   2638.4081000             -0.2162938        
  5    858.7744000             -0.4623949        
  6    296.3025200             -0.3848417        
S   3
  1    561.8372200              0.1142284        
  2     69.0401460             -0.6322909        
  3     29.9806350             -0.4420179        
S   3
  1     54.8696840             -0.2707986        
  2      9.9954585              0.8426472        
  3      4.5888678              0.3091657        
S   3
  1      9.1208256             -0.3410224        
  2      2.1196787              0.8100650        
  3      0.9708925              0.3967537        
S   2
  1      1.5879965              0.2629711        
  2      0.2953356             -0.7510412        
S   1
  1      0.1164016              1.0000000        
P   5
  1   4089.4554000             -0.0072366        
  2    967.0335900             -0.0558390        
  3    309.4421300             -0.2340242        
  4    112.4588600             -0.5047018        
  5     43.1185900             -0.3659633        
P   3
  1    164.6462000             -0.0252330        
  2     20.7365830              0.4944191        
  3      8.1558304              0.5741462        
P   3
  1      3.7104872              0.4299955        
  2      1.6249990              0.5262371        
  3      0.7146216              0.1234063        
P   2
  1      0.4628193              0.3537251        
  2      0.1864312              0.5355830        
P   1
  1      0.0714835              1.0000000        
D   5
  1    417.5032400             -0.0127252        
  2    123.6148300             -0.0915212        
  3     45.7790390             -0.3070989        
  4     18.3916630             -0.4996397        
  5      7.4217932             -0.3083066        
D   3
  1      6.2738586             -0.2593005        
  2      2.3594146             -0.5650765        
  3      0.8377966             -0.3523694        
D   1
  1      0.2440000              1.0000000        


name: DZVP (DFT Orbital)
description: VDZP Valence Double Zeta + Polarization designed for DFT
elt: Xe
data:
XENON
S   6
  1 287346.8700000              0.0016071        
  2  43095.3010000              0.0123001        
  3   9784.1285000              0.0618025        
  4   2753.6384000              0.2153881        
  5    895.4391800              0.4621485        
  6    308.6236800              0.3863971        
S   3
  1    583.9560900             -0.1143846        
  2     71.7851100              0.6332253        
  3     31.2157040              0.4410587        
S   3
  1     57.1718900             -0.2722831        
  2     10.4504210              0.8478492        
  3      4.7963432              0.3049036        
S   3
  1      9.6014044             -0.3450486        
  2      2.2451447              0.8196190        
  3      1.0382427              0.3896311        
S   2
  1      1.7261286              0.2745400        
  2      0.3319892             -0.7609475        
S   1
  1      0.1311516              1.0000000        
P   5
  1   4259.5720000              0.0072162        
  2   1007.4760000              0.0556817        
  3    322.5573100              0.2335722        
  4    117.3065700              0.5044039        
  5     45.0438490              0.3665276        
P   3
  1    171.1608300             -0.0253923        
  2     21.7103630              0.4944531        
  3      8.5862720              0.5735099        
P   3
  1      3.9278209             -0.4347689        
  2      1.7347255             -0.5241963        
  3      0.7693813             -0.1184808        
P   2
  1      0.5217671              0.3639488        
  2      0.2123886              0.5302511        
P   1
  1      0.0817809              1.0000000        
D   5
  1    443.5452000             -0.0123278        
  2    131.5612000             -0.0891627        
  3     19.6601230             -0.4998401        
  4     48.8163950             -0.3025428        
  5      7.9564419             -0.3134045        
D   3
  1      6.8245385             -0.2537549        
  2      2.6049770             -0.5660708        
  3      0.9422192             -0.3511078        
D   1
  1      0.2750000              1.0000000        


name: Lanl2DZ+2s2p2d2f
description: N/A
elt: Rh
data:
RHODIUM
S   3
  1      2.6460000             -1.3554084        
  2      1.7510000              1.6112233        
  3      0.5713000              0.5893814        
S   4
  1      2.6460000              1.1472137        
  2      1.7510000             -1.4943525        
  3      0.5713000             -0.8589704        
  4      0.1438000              1.0297241        
S   1
  1      0.0428000              1.0000000        
S   1
  1      0.0850000              1.0000000        
S   1
  1      0.0150000              1.0000000        
P   3
  1      5.4400000             -0.0987699        
  2      1.3290000              0.7433595        
  3      0.4845000              0.3668462        
P   2
  1      0.6595000             -0.0838056        
  2      0.0869000              1.0244841        
P   1
  1      0.0257000              1.0000000        
P   1
  1      1.0000000              1.0000000        
P   1
  1      0.1200000              1.0000000        
D   3
  1      3.6690000              0.0760059        
  2      1.4230000              0.5158852        
  3      0.5091000              0.5436585        
D   1
  1      1.0000000              1.0000000        
D   1
  1      0.1610000              1.0000000        
D   1
  1      0.0800000              1.0000000        
F   1
  1      0.5000000              1.0000000        
F   1
  1      0.0800000              1.0000000        


name: MG3S
elt: H
description:
MG3S is a triple-zeta polarized basis set with diffuse functions on all heavy atoms.  It is a modification of Pople's 6-311++G** basis set.

data:
HYDROGEN
S   3
  1      3.386500000000E+01            2.549380000000E-02      
  2      5.094790000000E+00            1.903730000000E-01      
  3      1.158790000000E+00            8.521610000000E-01      
S   1
  1      3.258400000000E-01            1.0000000        
S   1
  1      1.027410000000E-01            1.0000000        
P   1
  1      1.500000000000E+00            1.0000000        
P   1
  1      3.750000000000E-01            1.0000000        


name: MG3S
elt: He
description:
MG3S is a triple-zeta polarized basis set with diffuse functions on all heavy atoms.  It is a modification of Pople's 6-311++G** basis set.

data:
HELIUM
S   3
  1      9.812430000000E+01            2.874520000000E-02      
  2      1.476890000000E+01            2.080610000000E-01      
  3      3.318830000000E+00            8.376350000000E-01      
S   1
  1      8.740470000000E-01            1.0000000        
S   1
  1      2.445640000000E-01            1.0000000        
S   1
  1      8.600000000000E-02            1.0000000        
P   1
  1      1.500000000000E+00            1.0000000        
P   1
  1      3.750000000000E-01            1.0000000        


name: MG3S
elt: Li
description:
MG3S is a triple-zeta polarized basis set with diffuse functions on all heavy atoms.  It is a modification of Pople's 6-311++G** basis set.

data:
LITHIUM
S   6
  1      9.004600000000E+02            2.287040000000E-03      
  2      1.344330000000E+02            1.763500000000E-02      
  3      3.043650000000E+01            8.734340000000E-02      
  4      8.626390000000E+00            2.809770000000E-01      
  5      2.483320000000E+00            6.587410000000E-01      
  6      3.031790000000E-01            1.187120000000E-01      
S   3
  1      4.868900000000E+00            9.332930000000E-02      
  2      8.569240000000E-01            9.430450000000E-01      
  3      2.432270000000E-01           -2.798270000000E-01      
S   1
  1      6.350700000000E-02            1.0000000        
S   1
  1      2.436830000000E-02            1.0000000        
S   1
  1      7.400000000000E-03            1.0000000        
P   3
  1      4.868900000000E+00            3.276610000000E-02      
  2      8.569240000000E-01            1.597920000000E-01      
  3      2.432270000000E-01            8.856670000000E-01      
P   1
  1      6.350700000000E-02            1.0000000        
P   1
  1      2.436830000000E-02            1.0000000        
P   1
  1      7.400000000000E-03            1.0000000        
D   1
  1      4.000000000000E-01            1.0000000        
D   1
  1      1.000000000000E-01            1.0000000        
F   1
  1      1.500000000000E-01            1.0000000        


name: MG3S
elt: Be
data:
BERYLLIUM
S   6
  1      1.682800000000E+03            2.285740000000E-03      
  2      2.517150000000E+02            1.759380000000E-02      
  3      5.741160000000E+01            8.633150000000E-02      
  4      1.651710000000E+01            2.818350000000E-01      
  5      4.853640000000E+00            6.405940000000E-01      
  6      6.268630000000E-01            1.444670000000E-01      
S   3
  1      8.093800000000E+00            1.086210000000E-01      
  2      1.740750000000E+00            9.273010000000E-01      
  3      4.858160000000E-01           -2.971690000000E-01      
S   1
  1      1.636130000000E-01            1.0000000        
S   1
  1      5.672850000000E-02            1.0000000        
S   1
  1      2.070000000000E-02            1.0000000        
P   3
  1      8.093800000000E+00            3.613440000000E-02      
  2      1.740750000000E+00            2.169580000000E-01      
  3      4.858160000000E-01            8.418390000000E-01      
P   1
  1      1.636130000000E-01            1.0000000        
P   1
  1      5.672850000000E-02            1.0000000        
P   1
  1      2.070000000000E-02            1.0000000        
D   1
  1      5.100000000000E-01            1.0000000        
D   1
  1      1.275000000000E-01            1.0000000        
F   1
  1      2.600000000000E-01            1.0000000        


name: MG3S
elt: B
data:
BORON
S   6
  1      2.858890000000E+03            2.153750000000E-03      
  2      4.281400000000E+02            1.658230000000E-02      
  3      9.752820000000E+01            8.218700000000E-02      
  4      2.796930000000E+01            2.766180000000E-01      
  5      8.215770000000E+00            6.293160000000E-01      
  6      1.112780000000E+00            1.737700000000E-01      
S   3
  1      1.324150000000E+01            1.174430000000E-01      
  2      3.001660000000E+00            9.180020000000E-01      
  3      9.128560000000E-01           -2.651050000000E-03      
S   1
  1      3.154540000000E-01            1.0000000        
S   1
  1      9.885630000000E-02            1.0000000        
S   1
  1      3.150000000000E-02            1.0000000        
P   3
  1      1.324150000000E+01            4.181000000000E-02      
  2      3.001660000000E+00            2.365750000000E-01      
  3      9.128560000000E-01            8.162140000000E-01      
P   1
  1      3.154540000000E-01            1.0000000        
P   1
  1      9.885630000000E-02            1.0000000        
P   1
  1      3.150000000000E-02            1.0000000        
D   1
  1      8.020000000000E-01            1.0000000        
D   1
  1      2.005000000000E-01            1.0000000        
F   1
  1      5.000000000000E-01            1.0000000        


name: MG3S
elt: C
data:
CARBON
S   6
  1      4.563240000000E+03            1.966650000000E-03      
  2      6.820240000000E+02            1.523060000000E-02      
  3      1.549730000000E+02            7.612690000000E-02      
  4      4.445530000000E+01            2.608010000000E-01      
  5      1.302900000000E+01            6.164620000000E-01      
  6      1.827730000000E+00            2.210060000000E-01      
S   3
  1      2.096420000000E+01            1.146600000000E-01      
  2      4.803310000000E+00            9.199990000000E-01      
  3      1.459330000000E+00           -3.030680000000E-03      
S   1
  1      4.834560000000E-01            1.0000000        
S   1
  1      1.455850000000E-01            1.0000000        
S   1
  1      4.380000000000E-02            1.0000000        
P   3
  1      2.096420000000E+01            4.024870000000E-02      
  2      4.803310000000E+00            2.375940000000E-01      
  3      1.459330000000E+00            8.158540000000E-01      
P   1
  1      4.834560000000E-01            1.0000000        
P   1
  1      1.455850000000E-01            1.0000000        
P   1
  1      4.380000000000E-02            1.0000000        
D   1
  1      1.252000000000E+00            1.0000000        
D   1
  1      3.130000000000E-01            1.0000000        
F   1
  1      8.000000000000E-01            1.0000000        


name: MG3S
elt: N
data:
NITROGEN
S   6
  1      6.293480000000E+03            1.969790000000E-03      
  2      9.490440000000E+02            1.496130000000E-02      
  3      2.187760000000E+02            7.350060000000E-02      
  4      6.369160000000E+01            2.489370000000E-01      
  5      1.882820000000E+01            6.024600000000E-01      
  6      2.720230000000E+00            2.562020000000E-01      
S   3
  1      3.063310000000E+01            1.119060000000E-01      
  2      7.026140000000E+00            9.216660000000E-01      
  3      2.112050000000E+00           -2.569190000000E-03      
S   1
  1      6.840090000000E-01            1.0000000        
S   1
  1      2.008780000000E-01            1.0000000        
S   1
  1      6.390000000000E-02            1.0000000        
P   3
  1      3.063310000000E+01            3.831190000000E-02      
  2      7.026140000000E+00            2.374030000000E-01      
  3      2.112050000000E+00            8.175920000000E-01      
P   1
  1      6.840090000000E-01            1.0000000        
P   1
  1      2.008780000000E-01            1.0000000        
P   1
  1      6.390000000000E-02            1.0000000        
D   1
  1      1.826000000000E+00            1.0000000        
D   1
  1      4.565000000000E-01            1.0000000        
F   1
  1      1.000000000000E+00            1.0000000        


name: MG3S
elt: O
data:
OXYGEN
S   6
  1      8.588500000000E+03            1.895150000000E-03      
  2      1.297230000000E+03            1.438590000000E-02      
  3      2.992960000000E+02            7.073200000000E-02      
  4      8.737710000000E+01            2.400010000000E-01      
  5      2.567890000000E+01            5.947970000000E-01      
  6      3.740040000000E+00            2.808020000000E-01      
S   3
  1      4.211750000000E+01            1.138890000000E-01      
  2      9.628370000000E+00            9.208110000000E-01      
  3      2.853320000000E+00           -3.274470000000E-03      
S   1
  1      9.056610000000E-01            1.0000000        
S   1
  1      2.556110000000E-01            1.0000000        
S   1
  1      8.450000000000E-02            1.0000000        
P   3
  1      4.211750000000E+01            3.651140000000E-02      
  2      9.628370000000E+00            2.371530000000E-01      
  3      2.853320000000E+00            8.197020000000E-01      
P   1
  1      9.056610000000E-01            1.0000000        
P   1
  1      2.556110000000E-01            1.0000000        
P   1
  1      8.450000000000E-02            1.0000000        
D   1
  1      2.584000000000E+00            1.0000000        
D   1
  1      6.460000000000E-01            1.0000000        
F   1
  1      1.400000000000E+00            1.0000000        


name: MG3S
elt: F
data:
FLUORINE
S   6
  1      1.142710000000E+04            1.800930000000E-03      
  2      1.722350000000E+03            1.374190000000E-02      
  3      3.957460000000E+02            6.813340000000E-02      
  4      1.151390000000E+02            2.333250000000E-01      
  5      3.360260000000E+01            5.890860000000E-01      
  6      4.919010000000E+00            2.995050000000E-01      
S   3
  1      5.544410000000E+01            1.145360000000E-01      
  2      1.263230000000E+01            9.205120000000E-01      
  3      3.717560000000E+00           -3.378040000000E-03      
S   1
  1      1.165450000000E+00            1.0000000        
S   1
  1      3.218920000000E-01            1.0000000        
S   1
  1      1.076000000000E-01            1.0000000        
P   3
  1      5.544410000000E+01            3.546090000000E-02      
  2      1.263230000000E+01            2.374510000000E-01      
  3      3.717560000000E+00            8.204580000000E-01      
P   1
  1      1.165450000000E+00            1.0000000        
P   1
  1      3.218920000000E-01            1.0000000        
P   1
  1      1.076000000000E-01            1.0000000        
D   1
  1      3.500000000000E+00            1.0000000        
D   1
  1      8.750000000000E-01            1.0000000        
F   1
  1      1.850000000000E+00            1.0000000        


name: MG3S
elt: Ne
data:
NEON
S   6
  1      1.399570000000E+04            1.832760000000E-03      
  2      2.117100000000E+03            1.388270000000E-02      
  3      4.904250000000E+02            6.806870000000E-02      
  4      1.438330000000E+02            2.313280000000E-01      
  5      4.192650000000E+01            5.858900000000E-01      
  6      6.156840000000E+00            3.058830000000E-01      
S   3
  1      6.912110000000E+01            1.191490000000E-01      
  2      1.583500000000E+01            9.173750000000E-01      
  3      4.673260000000E+00           -4.058390000000E-03      
S   1
  1      1.457560000000E+00            1.0000000        
S   1
  1      3.970570000000E-01            1.0000000        
S   1
  1      1.300000000000E-01            1.0000000        
P   3
  1      6.912110000000E+01            3.565740000000E-02      
  2      1.583500000000E+01            2.394770000000E-01      
  3      4.673260000000E+00            8.184610000000E-01      
P   1
  1      1.457560000000E+00            1.0000000        
P   1
  1      3.970570000000E-01            1.0000000        
P   1
  1      1.300000000000E-01            1.0000000        
D   1
  1      4.608000000000E+00            1.0000000        
D   1
  1      1.152000000000E+00            1.0000000        
F   1
  1      2.500000000000E+00            1.0000000        


name: MG3S
elt: Na
data:
SODIUM
S   6
  1      3.616640000000E+04            1.032000000000E-03      
  2      5.372580000000E+03            8.071000000000E-03      
  3      1.213210000000E+03            4.212900000000E-02      
  4      3.396230000000E+02            1.697890000000E-01      
  5      1.095530000000E+02            5.146210000000E-01      
  6      3.877730000000E+01            3.798170000000E-01      
S   3
  1      3.877730000000E+01            3.747620000000E-01      
  2      1.457590000000E+01            5.757690000000E-01      
  3      5.269930000000E+00            1.129330000000E-01      
S   1
  1      1.827770000000E+00            1.0000000        
S   1
  1      6.199480000000E-01            1.0000000        
S   1
  1      5.724000000000E-02            1.0000000        
S   1
  1      2.404800000000E-02            1.0000000        
S   1
  1      7.600000000000E-03            1.0000000        
P   4
  1      1.446450000000E+02            1.148500000000E-02      
  2      3.390740000000E+01            8.238300000000E-02      
  3      1.062850000000E+01            3.196580000000E-01      
  4      3.823890000000E+00            7.012950000000E-01      
P   2
  1      1.444290000000E+00            6.385060000000E-01      
  2      5.526210000000E-01            4.253650000000E-01      
P   1
  1      1.887200000000E-01            1.0000000        
P   1
  1      4.650100000000E-02            1.0000000        
P   1
  1      1.628500000000E-02            1.0000000        
P   1
  1      7.600000000000E-03            1.0000000        
D   1
  1      7.000000000000E-01            1.0000000        
D   1
  1      1.750000000000E-01            1.0000000        
D   1
  1      4.375000000000E-02            1.0000000        
F   1
  1      3.000000000000E-01            1.0000000        
F   1
  1      7.500000000000E-02            1.0000000        


name: MG3S
elt: Mg
data:
MAGNESIUM
S   6
  1      4.386650000000E+04            9.180000000000E-04      
  2      6.605370000000E+03            7.047000000000E-03      
  3      1.513260000000E+03            3.594100000000E-02      
  4      4.323170000000E+02            1.414610000000E-01      
  5      1.421490000000E+02            4.267640000000E-01      
  6      5.139830000000E+01            4.979750000000E-01      
S   3
  1      5.139830000000E+01            2.513550000000E-01      
  2      1.991960000000E+01            6.186710000000E-01      
  3      8.024740000000E+00            1.884170000000E-01      
S   1
  1      2.508170000000E+00            1.0000000        
S   1
  1      8.715310000000E-01            1.0000000        
S   1
  1      1.081880000000E-01            1.0000000        
S   1
  1      4.013000000000E-02            1.0000000        
S   1
  1      1.460000000000E-02            1.0000000        
P   4
  1      1.938540000000E+02            1.018800000000E-02      
  2      4.544200000000E+01            7.536000000000E-02      
  3      1.418640000000E+01            3.074190000000E-01      
  4      5.057510000000E+00            7.175750000000E-01      
P   2
  1      1.888610000000E+00            6.673390000000E-01      
  2      7.226520000000E-01            3.946490000000E-01      
P   1
  1      2.364170000000E-01            1.0000000        
P   1
  1      9.335800000000E-02            1.0000000        
P   1
  1      3.480900000000E-02            1.0000000        
P   1
  1      1.460000000000E-02            1.0000000        
D   1
  1      7.000000000000E-01            1.0000000        
D   1
  1      1.750000000000E-01            1.0000000        
D   1
  1      4.375000000000E-02            1.0000000        
F   1
  1      4.000000000000E-01            1.0000000        
F   1
  1      1.000000000000E-01            1.0000000        


name: MG3S
elt: Al
data:
ALUMINUM
S   6
  1      5.486648900000E+04            8.390000000000E-04      
  2      8.211766500000E+03            6.527000000000E-03      
  3      1.866176100000E+03            3.366600000000E-02      
  4      5.311293400000E+02            1.329020000000E-01      
  5      1.751179700000E+02            4.012660000000E-01      
  6      6.400550000000E+01            5.313380000000E-01      
S   3
  1      6.400550000000E+01            2.023050000000E-01      
  2      2.529250700000E+01            6.247900000000E-01      
  3      1.053491000000E+01            2.274390000000E-01      
S   1
  1      3.206711000000E+00            1.0000000        
S   1
  1      1.152555000000E+00            1.0000000        
S   1
  1      1.766780000000E-01            1.0000000        
S   1
  1      6.523700000000E-02            1.0000000        
S   1
  1      3.180000000000E-02            1.0000000        
P   4
  1      2.592836200000E+02            9.448000000000E-03      
  2      6.107687000000E+01            7.097400000000E-02      
  3      1.930323700000E+01            2.956360000000E-01      
  4      7.010882000000E+00            7.282190000000E-01      
P   2
  1      2.673865000000E+00            6.444670000000E-01      
  2      1.036596000000E+00            4.174130000000E-01      
P   1
  1      3.168190000000E-01            1.0000000        
P   1
  1      1.142570000000E-01            1.0000000        
P   1
  1      4.139700000000E-02            1.0000000        
P   1
  1      3.180000000000E-02            1.0000000        
D   1
  1      1.300000000000E+00            1.0000000        
D   1
  1      3.250000000000E-01            1.0000000        
D   1
  1      8.125000000000E-02            1.0000000        
F   1
  1      5.000000000000E-01            1.0000000        
F   1
  1      1.250000000000E-01            1.0000000        


name: MG3S
elt: Si
data:
SILICON
S   6
  1      6.937923000000E+04            7.570000000000E-04      
  2      1.035494000000E+04            5.932000000000E-03      
  3      2.333879600000E+03            3.108800000000E-02      
  4      6.571429500000E+02            1.249670000000E-01      
  5      2.143011300000E+02            3.868970000000E-01      
  6      7.762916800000E+01            5.548880000000E-01      
S   3
  1      7.762916800000E+01            1.778810000000E-01      
  2      3.063080700000E+01            6.277650000000E-01      
  3      1.280129500000E+01            2.476230000000E-01      
S   1
  1      3.926866000000E+00            1.0000000        
S   1
  1      1.452343000000E+00            1.0000000        
S   1
  1      2.562340000000E-01            1.0000000        
S   1
  1      9.427900000000E-02            1.0000000        
S   1
  1      3.310000000000E-02            1.0000000        
P   4
  1      3.354831900000E+02            8.866000000000E-03      
  2      7.890036600000E+01            6.829900000000E-02      
  3      2.498815000000E+01            2.909580000000E-01      
  4      9.219711000000E+00            7.321170000000E-01      
P   2
  1      3.621140000000E+00            6.198790000000E-01      
  2      1.451310000000E+00            4.391480000000E-01      
P   1
  1      5.049770000000E-01            1.0000000        
P   1
  1      1.863170000000E-01            1.0000000        
P   1
  1      6.543200000000E-02            1.0000000        
P   1
  1      3.310000000000E-02            1.0000000        
D   1
  1      1.800000000000E+00            1.0000000        
D   1
  1      4.500000000000E-01            1.0000000        
D   1
  1      1.125000000000E-01            1.0000000        
F   1
  1      6.400000000000E-01            1.0000000        
F   1
  1      1.600000000000E-01            1.0000000        


name: MG3S
elt: P
data:
PHOSPHOROUS
S   6
  1      7.749240000000E+04            7.869212000000E-04      
  2      1.160580000000E+04            6.108245000000E-03      
  3      2.645960000000E+03            3.139689000000E-02      
  4      7.549700000000E+02            1.242379000000E-01      
  5      2.487500000000E+02            3.811538000000E-01      
  6      9.115000000000E+01            5.595372000000E-01      
S   3
  1      9.115000000000E+01            1.641617000000E-01      
  2      3.622000000000E+01            6.259097000000E-01      
  3      1.521000000000E+01            2.620744000000E-01      
S   1
  1      4.710000000000E+00            1.0000000        
S   1
  1      1.780000000000E+00            1.0000000        
S   1
  1      3.400000000000E-01            1.0000000        
S   1
  1      1.200000000000E-01            1.0000000        
S   1
  1      3.480000000000E-02            1.0000000        
P   4
  1      3.848400000000E+02            8.967875000000E-03      
  2      9.055000000000E+01            6.904902000000E-02      
  3      2.880000000000E+01            2.928770000000E-01      
  4      1.068000000000E+01            7.292494000000E-01      
P   2
  1      4.250000000000E+00            6.325822000000E-01      
  2      1.740000000000E+00            4.232996000000E-01      
P   1
  1      5.900000000000E-01            1.0000000        
P   1
  1      2.200000000000E-01            1.0000000        
P   1
  1      8.000000000000E-02            1.0000000        
P   1
  1      3.480000000000E-02            1.0000000        
D   1
  1      2.200000000000E+00            1.0000000        
D   1
  1      5.500000000000E-01            1.0000000        
D   1
  1      1.375000000000E-01            1.0000000        
F   1
  1      9.000000000000E-01            1.0000000        
F   1
  1      2.250000000000E-01            1.0000000        


name: MG3S
elt: S
data:
SULFUR
S   6
  1      9.341340000000E+04            7.420791000000E-04      
  2      1.396170000000E+04            5.787658000000E-03      
  3      3.169910000000E+03            2.994067000000E-02      
  4      9.024500000000E+02            1.189282000000E-01      
  5      2.971500000000E+02            3.681822000000E-01      
  6      1.087000000000E+02            5.776336000000E-01      
S   3
  1      1.087000000000E+02            1.427905000000E-01      
  2      4.315000000000E+01            6.246934000000E-01      
  3      1.810000000000E+01            2.834835000000E-01      
S   1
  1      5.570000000000E+00            1.0000000        
S   1
  1      2.140000000000E+00            1.0000000        
S   1
  1      4.300000000000E-01            1.0000000        
S   1
  1      1.500000000000E-01            1.0000000        
S   1
  1      4.050000000000E-02            1.0000000        
P   4
  1      4.950400000000E+02            8.196253000000E-03      
  2      1.172200000000E+02            6.364204000000E-02      
  3      3.750000000000E+01            2.788060000000E-01      
  4      1.391000000000E+01            7.447404000000E-01      
P   2
  1      5.500000000000E+00            6.168248000000E-01      
  2      2.240000000000E+00            4.402946000000E-01      
P   1
  1      7.700000000000E-01            1.0000000        
P   1
  1      2.900000000000E-01            1.0000000        
P   1
  1      1.000000000000E-01            1.0000000        
P   1
  1      4.050000000000E-02            1.0000000        
D   1
  1      2.600000000000E+00            1.0000000        
D   1
  1      6.500000000000E-01            1.0000000        
D   1
  1      1.625000000000E-01            1.0000000        
F   1
  1      1.100000000000E+00            1.0000000        
F   1
  1      2.750000000000E-01            1.0000000        


name: MG3S
elt: Cl
data:
CHLORINE
S   6
  1      1.058190000000E+05            7.423627000000E-04      
  2      1.587200000000E+04            5.747318000000E-03      
  3      3.619650000000E+03            2.964876000000E-02      
  4      1.030800000000E+03            1.178998000000E-01      
  5      3.399000000000E+02            3.648532000000E-01      
  6      1.245300000000E+02            5.816968000000E-01      
S   3
  1      1.245300000000E+02            1.370443000000E-01      
  2      4.951000000000E+01            6.231380000000E-01      
  3      2.080000000000E+01            2.903279000000E-01      
S   1
  1      6.460000000000E+00            1.0000000        
S   1
  1      2.520000000000E+00            1.0000000        
S   1
  1      5.300000000000E-01            1.0000000        
S   1
  1      1.900000000000E-01            1.0000000        
S   1
  1      4.830000000000E-02            1.0000000        
P   4
  1      5.897800000000E+02            7.873332000000E-03      
  2      1.398500000000E+02            6.155460000000E-02      
  3      4.479000000000E+01            2.742514000000E-01      
  4      1.661000000000E+01            7.498994000000E-01      
P   2
  1      6.590000000000E+00            6.147640000000E-01      
  2      2.710000000000E+00            4.413416000000E-01      
P   1
  1      9.500000000000E-01            1.0000000        
P   1
  1      3.500000000000E-01            1.0000000        
P   1
  1      1.200000000000E-01            1.0000000        
P   1
  1      4.830000000000E-02            1.0000000        
D   1
  1      3.000000000000E+00            1.0000000        
D   1
  1      7.500000000000E-01            1.0000000        
D   1
  1      1.875000000000E-01            1.0000000        
F   1
  1      1.400000000000E+00            1.0000000        
F   1
  1      3.500000000000E-01            1.0000000        


name: MG3S
elt: Ar
data:
ARGON
S   6
  1      1.180220000000E+05            7.461902000000E-04      
  2      1.768350000000E+04            5.786362000000E-03      
  3      4.027770000000E+03            2.990098000000E-02      
  4      1.145400000000E+03            1.191287000000E-01      
  5      3.771600000000E+02            3.687839000000E-01      
  6      1.381600000000E+02            5.767726000000E-01      
S   3
  1      1.381600000000E+02            1.435931000000E-01      
  2      5.498000000000E+01            6.231142000000E-01      
  3      2.317000000000E+01            2.840810000000E-01      
S   1
  1      7.370000000000E+00            1.0000000        
S   1
  1      2.920000000000E+00            1.0000000        
S   1
  1      6.500000000000E-01            1.0000000        
S   1
  1      2.300000000000E-01            1.0000000        
S   1
  1      6.000000000000E-02            1.0000000        
P   4
  1      6.630600000000E+02            7.820021000000E-03      
  2      1.570900000000E+02            6.148333000000E-02      
  3      5.023000000000E+01            2.754731000000E-01      
  4      1.863000000000E+01            7.488402000000E-01      
P   2
  1      7.440000000000E+00           -6.282210000000E-01      
  2      3.090000000000E+00           -4.260202000000E-01      
P   1
  1      1.100000000000E+00            1.0000000        
P   1
  1      4.100000000000E-01            1.0000000        
P   1
  1      1.400000000000E-01            1.0000000        
P   1
  1      6.000000000000E-02            1.0000000        
D   1
  1      3.400000000000E+00            1.0000000        
D   1
  1      8.500000000000E-01            1.0000000        
D   1
  1      2.125000000000E-01            1.0000000        
F   1
  1      1.700000000000E+00            1.0000000        
F   1
  1      4.250000000000E-01            1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: H
data:
HYDROGEN
S   2
  1      4.5018000              0.0704520        
  2      0.6814440              0.4078260        
S   1
  1      0.1513980              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: C
data:
CARBON
S   3
  1    153.1722600              0.0707400        
  2     23.0730300              0.3953800        
  3      4.9232900              0.6633110        
S   2
  1      5.7255700             -0.0813800        
  2      0.4550400              0.5748530        
S   1
  1      0.1470700              1.0000000        
P   2
  1      4.2513100              0.1099310        
  2      0.8632700              0.4627130        
P   1
  1      0.2013500              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: N
data:
NITROGEN
S   3
  1    218.3644900              0.0678700        
  2     32.5988900              0.3902020        
  3      6.9173900              0.6700830        
S   2
  1      8.3263800             -0.0808900        
  2      0.6591900              0.5672020        
S   1
  1      0.2100900              1.0000000        
P   2
  1      6.1203500              0.1159190        
  2      1.2593800              0.4699580        
P   1
  1      0.2914500              1.0000000        
D   1
  1      0.8500000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: O
data:
OXYGEN
S   3
  1    281.8665800              0.0690600        
  2     42.4160000              0.3931590        
  3      9.0956200              0.6656690        
S   2
  1     11.4660300             -0.0808200        
  2      0.8878600              0.5820900        
S   1
  1      0.2788000              1.0000000        
P   2
  1      8.0472400              0.1242710        
  2      1.6684200              0.4765940        
P   1
  1      0.3725100              1.0000000        
D   1
  1      0.8000000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: F
data:
FLUORINE
S   3
  1    368.3711200              0.0670400        
  2     55.0610600              0.3892490        
  3     11.7476700              0.6707880        
S   2
  1     15.1518400             -0.0805500        
  2      1.1513700              0.5877290        
S   1
  1      0.3581100              1.0000000        
P   2
  1     10.5770700              0.1262700        
  2      2.1949800              0.4779480        
P   1
  1      0.4793700              1.0000000        
D   1
  1      1.0000000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: Si
data:
SILICON
S   3
  1    910.6550000              0.0660820        
  2    137.3360000              0.3862290        
  3     29.7601000              0.6723800        
S   3
  1     36.6716000             -0.1045110        
  2      8.3172900              0.1074100        
  3      2.2164500              0.9514460        
S   2
  1      1.0791300             -0.3761080        
  2      0.3024220              1.2516500        
S   1
  1      0.0933390              1.0000000        
P   3
  1     36.6716000              0.1133550        
  2      8.3172900              0.4575780        
  3      2.2164500              0.6074270        
P   2
  1      1.0791300              0.0671030        
  2      0.3024220              0.9568830        
P   1
  1      0.0933390              1.0000000        
D   1
  1      0.4000000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: P
data:
PHOSPHOROUS
S   3
  1   1053.2658000              0.0658650        
  2    158.7904400              0.3845780        
  3     34.4244070              0.6739630        
S   3
  1     45.4503800             -0.0926550        
  2      3.8999260              0.6265130        
  3      1.4885070              0.4410390        
S   2
  1      2.3008410             -0.1805490        
  2      0.2989590              0.6809520        
S   1
  1      0.1088540              1.0000000        
P   3
  1     46.1000190              0.1053880        
  2     10.1650570              0.4597120        
  3      2.6447940              0.6137140        
P   2
  1      0.6326860              0.2358850        
  2      0.2402190              0.5541600        
P   1
  1      0.0864470              1.0000000        
D   1
  1      0.2500000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: S
data:
SULFUR
S   3
  1   1201.4584000              0.0657650        
  2    181.3921200              0.3839480        
  3     39.4047950              0.6743720        
S   3
  1     52.1390300             -0.0942320        
  2      4.5287990              0.6354680        
  3      1.7549380              0.4315060        
S   2
  1      2.8404370              0.1900420        
  2      0.3814330             -0.6855270        
S   1
  1      0.1387860              1.0000000        
P   3
  1     54.6440710              0.1036730        
  2     12.1229020              0.4581900        
  3      3.2065040              0.6134000        
P   2
  1      0.8632740              0.2294360        
  2      0.1086790              0.3537000        
P   1
  1      0.3181300              1.0000000        
D   1
  1      0.4000000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: Cl
data:
CHLORINE
S   3
  1   1362.0220000              0.0655440        
  2    205.8111000              0.3829870        
  3     44.7721670              0.6752100        
S   3
  1     59.2257320             -0.0956200        
  2      5.2139020              0.6414260        
  3      2.0473460              0.4251530        
S   2
  1      3.4197120              0.1964010        
  2      0.4700170             -0.6923600        
S   1
  1      0.1699580              1.0000000        
P   3
  1     64.0999580              0.1017890        
  2     14.2871390              0.4561070        
  3      3.8281350              0.6142820        
P   2
  1      1.0951260              0.2359030        
  2      0.1321760              0.3466000        
P   1
  1      0.3960040              1.0000000        
D   1
  1      0.6500000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: Br
data:
BROMINE
S   3
  1   6103.2899000              0.06241800       
  2    923.6974300              0.37204100       
  3    202.5203100              0.68587300       
S   3
  1    270.6015000             -0.11214900       
  2     58.2535700              0.09314500       
  3     18.4693300              0.96167900       
S   3
  1     19.7614200             -0.29387000       
  2      6.8217520              0.28026600       
  3      2.2916290              0.90203600       
S   2
  1      2.1312060             -0.65180300       
  2      0.4993540              1.33601200       
S   1
  1      0.1647640              1.0000000        
P   3
  1    270.6015000              0.14775100       
  2     58.2535700              0.60105600       
  3     18.4693300              0.41287000       
P   3
  1     19.7614200              0.02500700       
  2      6.8217520              0.48661000       
  3      2.2916290              0.58242300       
P   2
  1      2.1312060              0.02870800       
  2      0.4993540              0.98407000       
P   1
  1      0.1647640              1.0000000        
D   3
  1     33.9650970              0.14966700       
  2      8.9008310              0.51174800       
  3      2.4284360              0.57591500       
D   1
  1      0.4000000              1.0000000        


name: MIDI!
description: VDZP Valence Double Zeta + Polarization on some atoms
elt: I
data:
IODINE
S   3
  1  14351.1860000              0.0610030        
  2   2173.0741000              0.3666400        
  3    477.8720500              0.6911310        
S   3
  1    648.1887000             -0.1128510        
  2    140.3064000              0.0832280        
  3     45.6988000              0.9697520        
S   3
  1     56.6946900             -0.2736970        
  2     27.4887500              0.0465000        
  3      8.2090960              1.0915760        
S   3
  1      8.1916790             -0.4508280        
  2      3.2445960              0.4632090        
  3      1.3004890              0.8386360        
S   2
  1      1.4513800             -0.6658520        
  2      0.3281030              1.3285840        
S   1
  1      0.1150760              1.0000000        
P   3
  1    648.1887000              0.1541140        
  2    140.3064000              0.6194620        
  3     45.6988000              0.3837580        
P   3
  1     56.6946900             -0.1523220        
  2     27.4887500              0.5437690        
  3      8.2090960              0.6561680        
P   3
  1      8.1916790              0.0118700        
  2      3.2445960              0.5265250        
  3      1.3004890              0.5266080        
P   2
  1      1.4513800              0.0275410        
  2      0.3281030              0.9851370        
P   1
  1      0.1150760              1.0000000        
D   3
  1    128.0902600              0.1158640        
  2     35.9823780              0.4820490        
  3     11.5511160              0.5894450        
D   3
  1      6.1461520              0.2681820        
  2      2.2209370              0.5800610        
  3      0.8099120              0.3262260        
D   1
  1      0.4000000              1.0000000        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: H
data:
HYDROGEN
S   3
  1      4.5018000              0.0704520        
  2      0.6814440              0.4078260        
  3      0.1513980              0.6477520        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: He
data:
HELIUM
S   3
  1     13.6267360              0.0802410        
  2      1.9993490              0.4091430        
  3      0.3829930              0.6572780        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   3
  1     35.0461500              0.0737600        
  2      5.2016900              0.3974710        
  3      1.0562400              0.6650920        
S   3
  1      0.7151700             -0.0939700        
  2      0.0705300              0.5701000        
  3      0.0273500              0.4997500        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   3
  1     66.9535400              0.0702000        
  2      9.9392900              0.3919100        
  3      2.0571300              0.6699700        
S   3
  1      1.9122100             -0.0828200        
  2      0.1613200              0.5575530        
  3      0.0552400              0.5160430        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   3
  1    108.4370400              0.0686510        
  2     16.1205600              0.3899330        
  3      3.3734300              0.6713950        
S   3
  1      3.5665000             -0.0824190        
  2      0.2954700              0.5590640        
  3      0.0980500              0.5167950        
P   3
  1      2.5720720              0.1059000        
  2      0.5169400              0.4571800        
  3      0.1231400              0.6318610        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   3
  1    153.1722600              0.0707400        
  2     23.0730300              0.3953800        
  3      4.9232900              0.6633110        
S   3
  1      5.7255700             -0.0813800        
  2      0.4550400              0.5748530        
  3      0.1470700              0.5024130        
P   3
  1      4.2513100              0.1099310        
  2      0.8632700              0.4627130        
  3      0.2013500              0.6275140        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   3
  1    218.3644900              0.0678700        
  2     32.5988900              0.3902020        
  3      6.9173900              0.6700830        
S   3
  1      8.3263800             -0.0808900        
  2      0.6591900              0.5672020        
  3      0.2100900              0.5110920        
P   3
  1      6.1203500              0.1159190        
  2      1.2593800              0.4699580        
  3      0.2914500              0.6184480        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   3
  1    281.8665800              0.0690600        
  2     42.4160000              0.3931590        
  3      9.0956200              0.6656690        
S   3
  1     11.4660300             -0.0808200        
  2      0.8878600              0.5820900        
  3      0.2788000              0.4971600        
P   3
  1      8.0472400              0.1242710        
  2      1.6684200              0.4765940        
  3      0.3725100              0.6130440        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   3
  1    368.3711200              0.0670400        
  2     55.0610600              0.3892490        
  3     11.7476700              0.6707880        
S   3
  1     15.1518400             -0.0805500        
  2      1.1513700              0.5877290        
  3      0.3581100              0.4919790        
P   3
  1     10.5770700              0.1262700        
  2      2.1949800              0.4779480        
  3      0.4793700              0.6140080        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Ne
data:
NEON
S   3
  1    456.9528500              0.0669100        
  2     68.3654300              0.3893490        
  3     14.6197600              0.6705180        
S   3
  1     19.3271900             -0.0802500        
  2      1.4418200              0.5952980        
  3      0.4440800              0.4848680        
P   3
  1     13.3525200              0.1288400        
  2      2.7794700              0.4804410        
  3      0.6009700              0.6116720        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   3
  1    542.7605300              0.0684100        
  2     81.9594700              0.3920920        
  3     17.7237700              0.6660840        
S   3
  1     23.2804200             -0.0838010        
  2      1.8683400              0.5827940        
  3      0.6232500              0.4924740        
S   3
  1      0.5067300             -0.1157620        
  2      0.0535100              0.6958630        
  3      0.0208000              0.3810470        
P   3
  1     17.8363600              0.1257100        
  2      3.7956900              0.4804610        
  3      0.8775100              0.6022810        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   3
  1    650.6433670              0.0680300        
  2     98.3707800              0.3907380        
  3     21.3224900              0.6672670        
S   3
  1     27.9773800             -0.0867200        
  2      2.3265200              0.5856970        
  3      0.8180800              0.4864970        
S   3
  1      0.9113400             -0.1276510        
  2      0.0994000              0.6507730        
  3      0.0362300              0.4362720        
P   3
  1     23.2166200              0.1214600        
  2      5.0022200              0.4792910        
  3      1.2046500              0.5989420        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   3
  1    777.4433400              0.0668870        
  2    117.2315300              0.3877680        
  3     25.3762970              0.6707030        
S   3
  1     33.3562530             -0.0889560        
  2      2.8013150              0.6010610        
  3      1.0227330              0.4687860        
S   3
  1      1.3291880             -0.1513890        
  2      0.1616630              0.6593860        
  3      0.0589890              0.4386930        
P   3
  1     30.5695800              0.1123530        
  2      6.6447010              0.4674670        
  3      1.6543950              0.6097820        
P   3
  1      0.0446520              0.3964700        
  2      0.2996510              0.2264330        
  3      0.1158480              0.5005860        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   3
  1    909.2348700              0.0664050        
  2    137.1245600              0.3862220        
  3     29.7148100              0.6722400        
S   3
  1     39.1294230             -0.0909990        
  2      3.3359810              0.6116150        
  3      1.2512590              0.4568600        
S   3
  1      1.8031010             -0.1687330        
  2      0.2263890              0.6754530        
  3      0.0823950              0.4294190        
P   3
  1     37.8817610              0.1087530        
  2      8.3045980              0.4635150        
  3      2.1207920              0.6113340        
P   3
  1      0.4478020              0.2389130        
  2      0.0623620              0.3454530        
  3      0.1708380              0.5422950        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHOROUS
S   3
  1   1053.2658000              0.0658650        
  2    158.7904400              0.3845780        
  3     34.4244070              0.6739630        
S   3
  1     45.4503770             -0.0926550        
  2      3.8999260              0.6265130        
  3      1.4885070              0.4410390        
S   3
  1      2.3008410             -0.1805490        
  2      0.2989590              0.6809520        
  3      0.1088540              0.4291420        
P   3
  1     46.1000190              0.1053880        
  2     10.1650570              0.4597120        
  3      2.6447940              0.6137140        
P   3
  1      0.6326860              0.2358850        
  2      0.2402190              0.5541600        
  3      0.0864470              0.3365300        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   3
  1   1201.4584000              0.0657650        
  2    181.3921200              0.3839480        
  3     39.4047950              0.6743720        
S   3
  1     52.1390300             -0.0942320        
  2      4.5287990              0.6354680        
  3      1.7549380              0.4315060        
S   3
  1      2.8404370              0.1900420        
  2      0.3814330             -0.6855270        
  3      0.1387860             -0.4292720        
P   3
  1     54.6440710              0.1036730        
  2     12.1229020              0.4581900        
  3      3.2065040              0.6134000        
P   3
  1      0.8632740              0.2294360        
  2      0.1086790              0.3537000        
  3      0.3181300              0.5529600        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   3
  1   1362.0220000              0.0655440        
  2    205.8111000              0.3829187        
  3     44.7721670              0.6752100        
S   3
  1     59.2257320             -0.0956200        
  2      5.2139020              0.6414260        
  3      2.0473460              0.4251530        
S   3
  1      3.4197120              0.1964010        
  2      0.4700170             -0.6923600        
  3      0.1699580             -0.4261930        
P   3
  1     64.0999580              0.1017890        
  2     14.2871390              0.4561070        
  3      3.8281350              0.6142820        
P   3
  1      1.0951260              0.2359030        
  2      0.1321760              0.3466000        
  3      0.3960040              0.5580660        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Ar
data:
ARGON
S   3
  1   1536.9325000              0.0651590        
  2    232.1776500              0.3818070        
  3     50.5216850              0.6764460        
S   3
  1     66.9339490             -0.0967400        
  2      5.9185520              0.6527490        
  3      2.3393420              0.4135730        
S   3
  1      4.0453070              0.2007360        
  2      0.5657010             -0.6962680        
  3      0.2040650             -0.4248430        
P   3
  1     74.3529150              0.1000790        
  2     16.6313460              0.4542260        
  3      4.5039270              0.6152590        
P   3
  1      1.3570910              0.2372760        
  2      0.4881130              0.5583600        
  3      0.1621260              0.3461650        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   3
  1   1721.1755000              0.0648750        
  2    260.0163300              0.3808590        
  3     56.6245540              0.6773680        
S   3
  1     75.0556000             -0.0978730        
  2      6.6911630              0.6595600        
  3      2.6671660              0.4065290        
S   3
  1      4.6689370             -0.2129300        
  2      0.7000130              0.6892490        
  3      0.2753340              0.4339250        
S   3
  1      0.2523120             -0.1529800        
  2      0.0376310              0.6817280        
  3      0.0162180              0.4144830        
P   3
  1     85.7898460              0.0980350        
  2     19.2547940              0.4510410        
  3      5.2686240              0.6177080        
P   3
  1      1.6831450              0.2386360        
  2      0.6258090              0.5710570        
  3      0.2238980              0.3165360        


name: MINI (Huzinaga)
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   3
  1   1915.4348000              0.0646240        
  2    289.5332400              0.3798380        
  3     63.1063520              0.6783290        
S   3
  1     83.6332800             -0.0988820        
  2      7.5118400              0.6660270        
  3      3.0145850              0.3999120        
S   3
  1      5.3707540             -0.2235310        
  2      0.8383800              0.7028860        
  3      0.3462260              0.4235520        
S   3
  1      0.4297410             -0.1793100        
  2      0.0621730              0.6728790        
  3      0.0249480              0.4356660        
P   3
  1     97.9745920              0.0963160        
  2     22.0673840              0.4481080        
  3      6.0938760              0.6199210        
P   3
  1      2.0178860              0.2450290        
  2      0.7666510              0.5843850        
  3      0.2843190              0.2876660        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: He
data:
HELIUM
S   2
  1     13.6267360              0.0802410        
  2      1.9993490              0.4091430        
S   1
  1      0.3829930              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Li
data:
LITHIUM
S   3
  1     35.0461500              0.0737600        
  2      5.2016900              0.3974710        
  3      1.0562400              0.6650920        
S   2
  1      0.7151700             -0.0939700        
  2      0.0705300              0.5701000        
S   1
  1      0.0273500              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Be
data:
BERYLLIUM
S   3
  1     66.9535400              0.0702000        
  2      9.9392900              0.3919100        
  3      2.0571300              0.6699700        
S   2
  1      1.9122100             -0.0828200        
  2      0.1613200              0.5575530        
S   1
  1      0.0552400              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: B
data:
BORON
S   3
  1    108.4370400              0.0686510        
  2     16.1205600              0.3899330        
  3      3.3734300              0.6713950        
S   2
  1      3.5665000             -0.0824190        
  2      0.2954700              0.5590640        
S   1
  1      0.0980500              1.0000000        
P   2
  1      2.5720720              0.1059000        
  2      0.5169400              0.4571800        
P   1
  1      0.1231400              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: N
data:
NITROGEN
S   3
  1    218.3644900              0.0678700        
  2     32.5988900              0.3902020        
  3      6.9173900              0.6700830        
S   2
  1      8.3263800             -0.0808900        
  2      0.6591900              0.5672020        
S   1
  1      0.2100900              1.0000000        
P   2
  1      6.1203500              0.1159190        
  2      1.2593800              0.4699580        
P   1
  1      0.2914500              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: O
data:
OXYGEN
S   3
  1    281.8665800              0.0690600        
  2     42.4160000              0.3931590        
  3      9.0956200              0.6656690        
S   2
  1     11.4660300             -0.0808200        
  2      0.8878600              0.5820900        
S   1
  1      0.2788000              1.0000000        
P   2
  1      8.0472400              0.1242710        
  2      1.6684200              0.4765940        
P   1
  1      0.3725100              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   3
  1    368.3711200              0.0670400        
  2     55.0610600              0.3892490        
  3     11.7476700              0.6707880        
S   2
  1     15.1518400             -0.0805500        
  2      1.1513700              0.5877290        
S   1
  1      0.3581100              1.0000000        
P   2
  1     10.5770700              0.1262700        
  2      2.1949800              0.4779480        
P   1
  1      0.4793700              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   3
  1    456.9528500              0.0669100        
  2     68.3654300              0.3893490        
  3     14.6197600              0.6705180        
S   2
  1     19.3271900             -0.0802500        
  2      1.4418200              0.5952980        
S   1
  1      0.4440800              1.0000000        
P   2
  1     13.3525200              0.1288400        
  2      2.7794700              0.4804410        
P   1
  1      0.6009700              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Na
data:
SODIUM
S   3
  1    542.7605300              0.0684100        
  2     81.9594700              0.3920920        
  3     17.7237700              0.6660840        
S   3
  1     23.2804200             -0.0838010        
  2      1.8683400              0.5827940        
  3      0.6232500              0.4924740        
S   2
  1      0.5067300             -0.1157620        
  2      0.0535100              0.6958630        
S   1
  1      0.0208000              1.0000000        
P   3
  1     17.8363600              0.1257100        
  2      3.7956900              0.4804610        
  3      0.8775100              0.6022810        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Al
data:
ALUMINUM
S   3
  1    777.4433400              0.0668870        
  2    117.2315300              0.3877680        
  3     25.3762970              0.6707030        
S   3
  1     33.3562530             -0.0889560        
  2      2.8013150              0.6010610        
  3      1.0227330              0.4687860        
S   2
  1      1.3291880             -0.1513890        
  2      0.1616630              0.6593860        
S   1
  1      0.0589890              1.0000000        
P   3
  1     30.5695800              0.1123530        
  2      6.6447010              0.4674670        
  3      1.6543950              0.6097820        
P   2
  1      0.0446520              0.3964700        
  2      0.2996510              0.2264330        
P   1
  1      0.1158480              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Si
data:
SILICON
S   3
  1    909.2348700              0.0664050        
  2    137.1245600              0.3862220        
  3     29.7148100              0.6722400        
S   3
  1     39.1294230             -0.0909990        
  2      3.3359810              0.6116150        
  3      1.2512590              0.4568600        
S   2
  1      1.8031010             -0.1687330        
  2      0.2263890              0.6754530        
S   1
  1      0.0823960              1.0000000        
P   3
  1     37.8817610              0.1087530        
  2      8.3045980              0.4635150        
  3      2.1207920              0.6113340        
P   2
  1      0.4478020              0.2389130        
  2      0.0623620              0.3454530        
P   1
  1      0.1708380              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: P
data:
PHOSPHOROUS
S   3
  1   1053.2658000              0.0658650        
  2    158.7904400              0.3845780        
  3     34.4244070              0.6739630        
S   3
  1     45.4503800             -0.0926550        
  2      3.8999260              0.6265130        
  3      1.4885070              0.4410390        
S   2
  1      2.3008410             -0.1805490        
  2      0.2989590              0.6809520        
S   1
  1      0.1088540              1.0000000        
P   3
  1     46.1000190              0.1053880        
  2     10.1650570              0.4597120        
  3      2.6447940              0.6137140        
P   2
  1      0.6326860              0.2358850        
  2      0.2402190              0.5541600        
P   1
  1      0.0864470              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: S
data:
SULFUR
S   3
  1   1201.4584000              0.0657650        
  2    181.3921200              0.3839480        
  3     39.4047950              0.6743720        
S   3
  1     52.1390300             -0.0942320        
  2      4.5287990              0.6354680        
  3      1.7549380              0.4315060        
S   2
  1      2.8404370              0.1900420        
  2      0.3814330             -0.6855270        
S   1
  1      0.1387860              1.0000000        
P   3
  1     54.6440710              0.1036730        
  2     12.1229020              0.4581900        
  3      3.2065040              0.6134000        
P   2
  1      0.8632740              0.2294360        
  2      0.1086790              0.3537000        
P   1
  1      0.3181300              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cl
data:
CHLORINE
S   3
  1   1362.0220000              0.0655440        
  2    205.8111000              0.3829870        
  3     44.7721670              0.6752100        
S   3
  1     59.2257320             -0.0956200        
  2      5.2139020              0.6414260        
  3      2.0473460              0.4251530        
S   2
  1      3.4197120              0.1964010        
  2      0.4700170             -0.6923600        
S   1
  1      0.1699580              1.0000000        
P   3
  1     64.0999580              0.1017890        
  2     14.2871390              0.4561070        
  3      3.8281350              0.6142820        
P   2
  1      1.0951260              0.2359030        
  2      0.1321760              0.3466000        
P   1
  1      0.3960040              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ar
data:
ARGON
S   3
  1   1536.9325000              0.0651590        
  2    232.1776500              0.3818070        
  3     50.5216850              0.6764460        
S   3
  1     66.9339490             -0.0967400        
  2      5.9185520              0.6527490        
  3      2.3393420              0.4135730        
S   2
  1      4.0453070              0.2007360        
  2      0.5657010             -0.6962680        
S   1
  1      0.2040650              1.0000000        
P   3
  1     74.3529150              0.1000790        
  2     16.6313460              0.4542260        
  3      4.5039270              0.6152500        
P   2
  1      1.3570910              0.2372760        
  2      0.4881130              0.5583600        
P   1
  1      0.1621260              1.0000000        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: K
data:
POTASSIUM
S   3
  1   1721.1755000              0.0648750        
  2    260.0163300              0.3808590        
  3     56.6245540              0.6773680        
S   3
  1     75.0556000             -0.0978730        
  2      6.6911630              0.6595600        
  3      2.6671660              0.4065290        
S   3
  1      4.6689370             -0.2129300        
  2      0.7000130              0.6892490        
  3      0.2753340              0.4339250        
S   2
  1      0.2523120             -0.1529800        
  2      0.0376310              0.6817280        
S   1
  1      0.0162180              1.0000000        
P   3
  1     85.7898460              0.0980350        
  2     19.2547940              0.4510410        
  3      5.2686240              0.6177080        
P   3
  1      1.6831450              0.2386360        
  2      0.6258090              0.5710570        
  3      0.2238980              0.3165360        


name: MIDI (Huzinaga)
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cs
data:
CESIUM
S   3
  1  15525.8660000              0.0607240        
  2   2349.0055000              0.3658420        
  3    516.2355500              0.6920470        
S   3
  1    687.5050500             -0.1102130        
  2     67.1911570              0.7272030        
  3     27.9920030              0.3401430        
S   3
  1     60.1681880             -0.2753150        
  2     10.8686940              0.8901280        
  3      4.7407050              0.2648630        
S   3
  1      9.8871630             -0.3688270        
  2      2.3693430              0.8325820        
  3      1.1416760              0.3887890        
S   3
  1      1.7690780             -0.3409420        
  2      0.3836200              0.7000970        
  3      0.1713060              0.4934520        
S   2
  1      0.2118490             -0.2750220        
  2      0.0403240              0.1936040        
S   1
  1      0.0170580              1.0000000        
P   3
  1   1024.2833000              0.0791850        
  2    239.6488900              0.4199330        
  3     71.2555480              0.6432510        
P   3
  1    139.4586400             -0.0331230        
  2     25.8108100              0.3891080        
  3     10.1394520              0.6790330        
P   3
  1      4.3242440              0.3816690        
  2      1.9364150              0.5769760        
  3      0.8145050              0.1154050        
P   3
  1      0.5945840              0.3199070        
  2      0.2749920              0.5531870        
  3      0.1115530              0.2160880        
D   3
  1    144.0513900              0.1118300        
  2     40.5051460              0.4768350        
  3     13.0862440              0.5954170        
D   3
  1      7.3715780              0.2537250        
  2      2.7248240              0.5788860        
  3      1.0266780              0.3325980        


name: McLean/Chandler VTZ
description: VTZ Valence Triple Zeta: 3 Functions/Valence AO
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000        


name: McLean/Chandler VTZ
description: VTZ Valence Triple Zeta: 3 Functions/Valence AO
elt: P
data:
PHOSPHOROUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9800000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000        


name: McLean/Chandler VTZ
description: VTZ Valence Triple Zeta: 3 Functions/Valence AO
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: H
data:
HYDROGEN
S   3
  1      7.0340630              0.0704520        
  2      1.0647560              0.4078260        
  3      0.2365590              0.6477520        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Li
data:
LITHIUM
S   3
  1     35.0461500              0.0737600        
  2      5.2016900              0.3974710        
  3      1.0562400              0.6650920        
S   3
  1      0.8512530             -0.0939700        
  2      0.0839510              0.5701000        
  3      0.0325540              0.4997500        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Be
data:
BERYLLIUM
S   3
  1     66.9535400              0.0702000        
  2      9.9392900              0.3919100        
  3      2.0571300              0.6699700        
S   3
  1      2.3348560             -0.0828200        
  2      0.1969760              0.5575530        
  3      0.0674490              0.5160430        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: B
data:
BORON
S   3
  1    108.4370400              0.0686510        
  2     16.1205600              0.3899330        
  3      3.3734300              0.6713950        
S   3
  1      4.4578540             -0.0824190        
  2      0.3693150              0.5590640        
  3      0.1225550              0.5167950        
P   3
  1      3.2148920              0.1059000        
  2      0.6461360              0.4571800        
  3      0.1539160              0.6318610        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: C
data:
CARBON
S   3
  1    153.1722600              0.0707400        
  2     23.0730300              0.3953800        
  3      4.9232900              0.6633110        
S   3
  1      6.6166120             -0.0813800        
  2      0.5258560              0.5748530        
  3      0.1699580              0.5024130        
P   3
  1      4.9129200              0.1099310        
  2      0.9976160              0.4627130        
  3      0.2326850              0.6275140        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: N
data:
NITROGEN
S   3
  1    218.3644900              0.0678700        
  2     32.5988900              0.3902020        
  3      6.9173900              0.6700830        
S   3
  1      8.9194260             -0.0808900        
  2      0.7061410              0.5672020        
  3      0.2250540              0.5110920        
P   3
  1      6.5562720              0.1159190        
  2      1.3490790              0.4699580        
  3      0.3122090              0.6184480        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: O
data:
OXYGEN
S   3
  1    281.8665800              0.0690600        
  2     42.4160000              0.3931590        
  3      9.0956200              0.6656690        
S   3
  1     11.7893260             -0.0808200        
  2      0.9128940              0.5820900        
  3      0.2866610              0.4971600        
P   3
  1      8.2741400              0.1242710        
  2      1.7154630              0.4765940        
  3      0.3830130              0.6130440        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: F
data:
FLUORINE
S   3
  1    368.3711200              0.0670400        
  2     55.0610600              0.3892490        
  3     11.7476700              0.6707880        
S   3
  1     15.3647080             -0.0805500        
  2      1.1675460              0.5877290        
  3      0.3631410              0.4919790        
P   3
  1     10.7256670              0.1262700        
  2      2.2258170              0.4779480        
  3      0.4861050              0.6140080        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Na
data:
SODIUM
S   3
  1    542.7605300              0.0684100        
  2     81.9594700              0.3920920        
  3     17.7237700              0.6660840        
S   3
  1     23.2804200             -0.0838010        
  2      1.8683400              0.5827940        
  3      0.6232500              0.4924740        
S   3
  1      0.6176110             -0.1157620        
  2      0.0652190              0.6958630        
  3      0.0253510              0.3810470        
P   3
  1     17.8363600              0.1257100        
  2      3.7956900              0.4804610        
  3      0.8775100              0.6022810        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Mg
data:
MAGNESIUM
S   3
  1    650.6433670              0.0680300        
  2     98.3707800              0.3907380        
  3     21.3224900              0.6672670        
S   3
  1     27.9773800             -0.0867200        
  2      2.3265200              0.5856970        
  3      0.8180800              0.4864970        
S   3
  1      1.0847510             -0.1276510        
  2      0.1183140              0.6507730        
  3      0.0431240              0.4362720        
P   3
  1     23.2166200              0.1214600        
  2      5.0022200              0.4792910        
  3      1.2046500              0.5989420        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Al
data:
ALUMINUM
S   3
  1    777.4433400              0.0668870        
  2    117.2315300              0.3877680        
  3     25.3762970              0.6707030        
S   3
  1     33.3562530             -0.0889560        
  2      2.8013150              0.6010610        
  3      1.0227330              0.4687860        
S   3
  1      1.6852460             -0.1513890        
  2      0.2049690              0.6593860        
  3      0.0747900              0.4386930        
P   3
  1     30.5695800              0.1123530        
  2      6.6447010              0.4674670        
  3      1.6543950              0.6097820        
P   3
  1      0.0566130              0.3964700        
  2      0.3799200              0.2264330        
  3      0.1468810              0.5005860        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Si
data:
SILICON
S   3
  1    909.2348700              0.0664050        
  2    137.1245600              0.3862220        
  3     29.7148100              0.6722400        
S   3
  1     39.1294230             -0.0909990        
  2      3.3359810              0.6116150        
  3      1.2512590              0.4568600        
S   3
  1      2.1976490             -0.1687330        
  2      0.2759270              0.6754530        
  3      0.1004250              0.4294190        
P   3
  1     37.8817610              0.1087530        
  2      8.3045980              0.4635150        
  3      2.1207920              0.6113340        
P   3
  1      0.5457890              0.2389130        
  2      0.0760070              0.3454530        
  3      0.2082200              0.5422950        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: P
data:
PHOSPHOROUS
S   3
  1   1053.2658000              0.0658650        
  2    158.7904400              0.3845780        
  3     34.4244070              0.6739630        
S   3
  1     45.4503770             -0.0926550        
  2      3.8999260              0.6265130        
  3      1.4885070              0.4410390        
S   3
  1      2.4694830             -0.1805490        
  2      0.3208720              0.6809520        
  3      0.1168320              0.4291420        
P   3
  1     46.1000190              0.1053880        
  2     10.1650570              0.4597120        
  3      2.6447940              0.6137140        
P   3
  1      0.6790590              0.2358850        
  2      0.2578260              0.5541600        
  3      0.0927830              0.3365300        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: S
data:
SULFUR
S   3
  1   1201.4584000              0.0657650        
  2    181.3921200              0.3839480        
  3     39.4047950              0.6743720        
S   3
  1     52.1390300             -0.0942320        
  2      4.5287990              0.6354680        
  3      1.7549380              0.4315060        
S   3
  1      2.9205260              0.1900420        
  2      0.3921870             -0.6855270        
  3      0.1426990             -0.4292720        
P   3
  1     54.6440710              0.1036730        
  2     12.1229020              0.4581900        
  3      3.2065040              0.6134000        
P   3
  1      0.8876150              0.2294360        
  2      0.1117430              0.3537000        
  3      0.3271000              0.5529600        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Cl
data:
CHLORINE
S   3
  1   1362.0220000              0.0655440        
  2    205.8111000              0.3829870        
  3     44.7721670              0.6752100        
S   3
  1     59.2257320             -0.0956200        
  2      5.2139020              0.6414260        
  3      2.0473460              0.4251530        
S   3
  1      3.4471240              0.1964010        
  2      0.4737850             -0.6923600        
  3      0.1713210             -0.4261930        
P   3
  1     64.0999580              0.1017890        
  2     14.2871390              0.4561070        
  3      3.8281350              0.6142820        
P   3
  1      1.1039040              0.2359030        
  2      0.1332360              0.3466000        
  3      0.3991780              0.5580660        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: K
data:
POTASSIUM
S   3
  1   1721.1755000              0.0648750        
  2    260.0163300              0.3808590        
  3     56.6245540              0.6773680        
S   3
  1     75.0556000             -0.0978730        
  2      6.6911630              0.6595600        
  3      2.6671660              0.4065290        
S   3
  1      4.6689370             -0.2129300        
  2      0.7000130              0.6892490        
  3      0.2753340              0.4339250        
S   3
  1      0.3227470             -0.1529800        
  2      0.0481360              0.6817280        
  3      0.0207460              0.4144830        
P   3
  1     85.7898460              0.0980350        
  2     19.2547940              0.4510410        
  3      5.2686240              0.6177080        
P   3
  1      1.6831450              0.2386360        
  2      0.6258090              0.5710570        
  3      0.2238980              0.3165360        


name: MINI (Scaled)
description: MB Minimal Basis: 1 Function/AO
elt: Ca
data:
CALCIUM
S   3
  1   1915.4348000              0.0646240        
  2    289.5332400              0.3798380        
  3     63.1063520              0.6783290        
S   3
  1     83.6332800             -0.0988820        
  2      7.5118400              0.6660270        
  3      3.0145850              0.3999120        
S   3
  1      5.3707540             -0.2235310        
  2      0.8383800              0.7028860        
  3      0.3462260              0.4235520        
S   3
  1      0.5068340             -0.1793100        
  2      0.0733270              0.6728790        
  3      0.0294240              0.4356660        
P   3
  1     97.9745920              0.0963160        
  2     22.0673840              0.4481080        
  3      6.0938760              0.6199210        
P   3
  1      2.0178860              0.2450290        
  2      0.7666510              0.5843850        
  3      0.2843190              0.2876660        


name: NASA Ames cc-pCV5Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      5.5110200              1.0000000        
F   1
  1      2.4192360              1.0000000        
F   1
  1      1.0620000              1.0000000        
F   1
  1      0.4661980              1.0000000        
F   1
  1      0.2046530              1.0000000        
G   1
  1      4.4216370              1.0000000        
G   1
  1      2.1065440              1.0000000        
G   1
  1      1.0035940              1.0000000        
G   1
  1      0.4781300              1.0000000        
H   1
  1      4.3050000              1.0000000        
H   1
  1      2.0500000              1.0000000        
H   1
  1      0.9761900              1.0000000        
I   1
  1      0.7400000              1.0000000        


name: NASA Ames cc-pCVQZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      3.5544460              1.0000000        
F   1
  1      1.4872160              1.0000000        
F   1
  1      0.6222660              1.0000000        
F   1
  1      0.2603620              1.0000000        
G   1
  1      3.4465200              1.0000000        
G   1
  1      1.4920000              1.0000000        
G   1
  1      0.6458870              1.0000000        
H   1
  1      0.7500000              1.0000000        


name: NASA Ames ANO2
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: V
data:
VANADIUM
S   19
  1 3321857.0000000             0.0000090        
  2 497435.6000000              0.0000690        
  3 113202.7000000              0.0003610        
  4  32063.3300000              0.0015220        
  5  10459.6200000              0.0055120        
  6   3775.5060000              0.0176680        
  7   1472.0400000              0.0503830        
  8    609.9331000              0.1248090        
  9    265.2634000              0.2517260        
 10    119.8607000              0.3592260        
 11     55.4489100              0.2741650        
 12     24.9837200              0.0648620        
 13     11.8805600             -0.0011640        
 14      5.66031100             0.0019800        
 15      2.49570300            -0.0009180        
 16      1.17786600             0.0004040        
 17      0.520044000           -0.0001650        
 18      0.115965000            0.0000680        
 19      0.058938000           -0.0000550        
S   19
  1 3321857.0000000            -0.0000030        
  2 497435.6000000             -0.0000200        
  3 113202.7000000             -0.0001080        
  4  32063.3300000             -0.0004540        
  5  10459.6200000             -0.0016500        
  6   3775.5060000             -0.0053400        
  7   1472.0400000             -0.0155930        
  8    609.9331000             -0.0407240        
  9    265.2634000             -0.0920840        
 10    119.8607000             -0.1663640        
 11     55.4489100             -0.1858060        
 12     24.9837200              0.0458580        
 13     11.8805600              0.5080610        
 14      5.66031100             0.5069380        
 15      2.49570300             0.0942810        
 16      1.17786600            -0.0026620        
 17      0.520044000            0.0023620        
 18      0.115965000           -0.0005850        
 19      0.058938000            0.0004730        
S   19
  1 3321857.0000000             0.0000010        
  2 497435.6000000              0.0000070        
  3 113202.7000000              0.0000400        
  4  32063.3300000              0.0001650        
  5  10459.6200000              0.0006020        
  6   3775.5060000              0.0019490        
  7   1472.0400000              0.0057030        
  8    609.9331000              0.0150030        
  9    265.2634000              0.0343340        
 10    119.8607000              0.0640090        
 11     55.4489100              0.0749970        
 12     24.9837200             -0.0196020        
 13     11.8805600             -0.2870220        
 14      5.66031100            -0.4540940        
 15      2.49570300             0.0910300        
 16      1.17786600             0.7111500        
 17      0.520044000            0.4310330        
 18      0.115965000            0.0260820        
 19      0.058938000           -0.0114010        
S   18
  1 497435.6000000             -0.0000020        
  2 113202.7000000             -0.0000090        
  3  32063.3300000             -0.0000390        
  4  10459.6200000             -0.0001420        
  5   3775.5060000             -0.0004620        
  6   1472.0400000             -0.0013500        
  7    609.9331000             -0.0035550        
  8    265.2634000             -0.0081450        
  9    119.8607000             -0.0152360        
 10     55.4489100             -0.0179490        
 11     24.9837200              0.0046600        
 12     11.8805600              0.0722260        
 13      5.66031100             0.1216230        
 14      2.49570300            -0.0337280        
 15      1.17786600            -0.2473110        
 16      0.520044000           -0.2829190        
 17      0.115965000            0.3308530        
 18      0.058938000            0.5871420        
S   19
  1 3321857.0000000            -0.0000190        
  2 497435.6000000              0.0001450        
  3 113202.7000000             -0.0000960        
  4  32063.3300000             -0.0000400        
  5  10459.6200000             -0.0002700        
  6   3775.5060000             -0.0008590        
  7   1472.0400000             -0.0023670        
  8    609.9331000             -0.0068060        
  9    265.2634000             -0.0138760        
 10    119.8607000             -0.0305530        
 11     55.4489100             -0.0260690        
 12     24.9837200             -0.0092330        
 13     11.8805600              0.1779380        
 14      5.66031100             0.1543150        
 15      2.49570300             0.0921260        
 16      1.17786600            -1.0115070        
 17      0.520044000            0.2281550        
 18      0.115965000            2.1204380        
 19      0.058938000           -1.2643960        
S   19
  1 3321857.0000000            -0.0000440        
  2 497435.6000000              0.0002350        
  3 113202.7000000             -0.0007760        
  4  32063.3300000              0.0031230        
  5  10459.6200000             -0.0027770        
  6   3775.5060000             -0.0002450        
  7   1472.0400000             -0.0044220        
  8    609.9331000             -0.0108530        
  9    265.2634000             -0.0222110        
 10    119.8607000             -0.0513090        
 11     55.4489100             -0.0383960        
 12     24.9837200             -0.0274690        
 13     11.8805600              0.3348540        
 14      5.66031100             0.2493860        
 15      2.49570300             0.0638120        
 16      1.17786600            -2.4167250        
 17      0.520044000            2.6591510        
 18      0.115965000           -0.1076490        
 19      0.058938000           -2.1632850        
S   1
  1      0.026946000            1.0000000        
P   14
  1   5777.3770000              0.0001840        
  2   1368.6740000              0.0016110        
  3    444.1233000              0.0089330        
  4    169.0991000              0.0364080        
  5     71.1019100              0.1125600        
  6     31.9031100              0.2523880        
  7     14.8510900              0.3804890        
  8      7.08522700             0.3104780        
  9      3.32442200             0.0880800        
 10      1.54116400             0.0031980        
 11      0.690520000            0.0013680        
 12      0.285424000           -0.0003880        
 13      0.114200000            0.0002150        
 14      0.045700000           -0.0001030        
P   14
  1   5777.3770000             -0.0000630        
  2   1368.6740000             -0.0005500        
  3    444.1233000             -0.0030750        
  4    169.0991000             -0.0126800        
  5     71.1019100             -0.0404390        
  6     31.9031100             -0.0941680        
  7     14.8510900             -0.1514260        
  8      7.08522700            -0.1125800        
  9      3.32442200             0.1678610        
 10      1.54116400             0.4695080        
 11      0.690520000            0.4201240        
 12      0.285424000            0.1090000        
 13      0.114200000           -0.0012830        
 14      0.045700000            0.0029660        
P   14
  1   5777.3770000              0.0000190        
  2   1368.6740000              0.0001660        
  3    444.1233000              0.0009150        
  4    169.0991000              0.0038240        
  5     71.1019100              0.0120620        
  6     31.9031100              0.0286260        
  7     14.8510900              0.0453740        
  8      7.08522700             0.0357370        
  9      3.32442200            -0.0632290        
 10      1.54116400            -0.1621300        
 11      0.690520000           -0.2105220        
 12      0.285424000            0.1306620        
 13      0.114200000            0.7304420        
 14      0.045700000            0.2787350        
P   14
  1   5777.3770000             -0.0005020        
  2   1368.6740000              0.0005280        
  3    444.1233000              0.0018630        
  4    169.0991000              0.0074810        
  5     71.1019100              0.0254270        
  6     31.9031100              0.0547060        
  7     14.8510900              0.1035950        
  8      7.08522700             0.0621770        
  9      3.32442200            -0.1166360        
 10      1.54116400            -0.5464790        
 11      0.690520000           -0.1494390        
 12      0.285424000            1.3803190        
 13      0.114200000           -0.3515930        
 14      0.045700000           -0.6486200        
P   14
  1   5777.3770000             -0.0018770        
  2   1368.6740000              0.0085150        
  3    444.1233000             -0.0288330        
  4    169.0991000              0.0326910        
  5     71.1019100              0.0171180        
  6     31.9031100              0.0850580        
  7     14.8510900              0.1176090        
  8      7.08522700             0.1477620        
  9      3.32442200            -0.2850060        
 10      1.54116400            -1.1883840        
 11      0.690520000            1.8230990        
 12      0.285424000           -0.2143400        
 13      0.114200000           -1.4357020        
 14      0.045700000            1.3682950        
P   1
  1      0.018300000            1.0000000        
D   10
  1    155.8527000              0.0008550        
  2     46.4977100              0.0071660        
  3     17.6299900              0.0316240        
  4      7.35467200             0.0958440        
  5      3.27405100             0.2061640        
  6      1.48248200             0.3042010        
  7      0.661351000            0.3253210        
  8      0.284826000            0.2666120        
  9      0.112899000            0.1358370        
 10      0.045160000            0.0212920        
D   10
  1    155.8527000             -0.0009320        
  2     46.4977100             -0.0074970        
  3     17.6299900             -0.0340170        
  4      7.35467200            -0.1044940        
  5      3.27405100            -0.2226390        
  6      1.48248200            -0.2784230        
  7      0.661351000           -0.1178410        
  8      0.284826000            0.3542000        
  9      0.112899000            0.5302290        
 10      0.045160000            0.1566310        
D   10
  1    155.8527000              0.0014700        
  2     46.4977100              0.0116580        
  3     17.6299900              0.0542500        
  4      7.35467200             0.1709480        
  5      3.27405100             0.3434530        
  6      1.48248200             0.2393790        
  7      0.661351000           -0.5150960        
  8      0.284826000           -0.5469710        
  9      0.112899000            0.5516150        
 10      0.045160000            0.3451870        
D   10
  1    155.8527000             -0.0105810        
  2     46.4977100              0.0191830        
  3     17.6299900              0.0775000        
  4      7.35467200             0.2167100        
  5      3.27405100             0.4686440        
  6      1.48248200            -0.3055970        
  7      0.661351000           -0.9422950        
  8      0.284826000            1.0558660        
  9      0.112899000            0.0755570        
 10      0.045160000           -0.6885400        
D   10
  1    155.8527000             -0.0254710        
  2     46.4977100              0.1124650        
  3     17.6299900             -0.1882720        
  4      7.35467200            -0.2619330        
  5      3.27405100            -0.5000830        
  6      1.48248200             1.3735240        
  7      0.661351000           -0.7524420        
  8      0.284826000           -0.5906400        
  9      0.112899000            1.3961510        
 10      0.045160000           -1.0661100        
F   6
  1      7.32420000             0.0261020        
  2      2.92970000             0.1169100        
  3      1.17190000             0.3217760        
  4      0.468800000            0.4782430        
  5      0.187500000            0.3204900        
  6      0.075000000            0.0645420        
F   6
  1      7.32420000            -0.0715170        
  2      2.92970000            -0.2948810        
  3      1.17190000            -0.5374860        
  4      0.468800000            0.0630260        
  5      0.187500000            0.5924440        
  6      0.075000000            0.1736520        
F   6
  1      7.32420000            -0.1519690        
  2      2.92970000            -0.5703090        
  3      1.17190000            -0.0422130        
  4      0.468800000            0.8695270        
  5      0.187500000           -0.4745790        
  6      0.075000000           -0.3905660        
G   4
  1      3.51160000             0.1037540        
  2      1.40630000             0.2939900        
  3      0.562500000            0.5433640        
  4      0.225000000            0.3550200        
G   4
  1      3.51160000            -0.3740200        
  2      1.40630000            -0.5442250        
  3      0.562500000            0.0610640        
  4      0.225000000            0.6522650        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: H
data:
HYDROGEN
S   8
  1    402.0099000             -0.0002420        
  2     60.2419600             -0.0017760        
  3     13.7321700             -0.0098970        
  4      3.9045050             -0.0347650        
  5      1.2827090             -0.1213760        
  6      0.4655440             -0.2207770        
  7      0.1811200             -0.1901840        
  8      0.0727910             -0.0506570        
S   8
  1    402.0099000             -0.0003560        
  2     60.2419600             -0.0012740        
  3     13.7321700             -0.0184930        
  4      3.9045050             -0.0175190        
  5      1.2827090             -0.4574310        
  6      0.4655440             -0.3222800        
  7      0.1811200              0.5788380        
  8      0.0727910              0.1181480        
S   8
  1    402.0099000             -0.0004190        
  2     60.2419600             -0.0036150        
  3     13.7321700             -0.0175070        
  4      3.9045050             -0.1636840        
  5      1.2827090             -1.1775920        
  6      0.4655440              1.8452390        
  7      0.1811200             -0.7117840        
  8      0.0727910             -0.1712490        
S   8
  1    402.0099000              0.0003410        
  2     60.2419600             -0.0195380        
  3     13.7321700              0.0513770        
  4      3.9045050             -1.3200520        
  5      1.2827090              1.7404130        
  6      0.4655440             -0.6684020        
  7      0.1811200             -0.4990350        
  8      0.0727910              0.5429700        
P   6
  1      9.8800000              0.0030850        
  2      3.9500000              0.0029690        
  3      1.5800000              0.0838760        
  4      0.6300000              0.3251330        
  5      0.2500000              0.1896030        
  6      0.1000000              0.0177080        
P   6
  1      9.8800000             -0.0173510        
  2      3.9500000              0.0212530        
  3      1.5800000             -0.5528160        
  4      0.6300000             -0.1528990        
  5      0.2500000              0.5248460        
  6      0.1000000              0.0141110        
P   6
  1      9.8800000              0.0037360        
  2      3.9500000             -0.2742180        
  3      1.5800000             -0.7744190        
  4      0.6300000              1.3699310        
  5      0.2500000             -0.7356830        
  6      0.1000000             -0.0227040        
D   4
  1      4.0000000              0.0012650        
  2      1.6000000             -0.1599150        
  3      0.6400000             -0.3822080        
  4      0.2600000             -0.1004870        
D   4
  1      4.0000000             -0.0337990        
  2      1.6000000             -0.6592290        
  3      0.6400000              0.2157450        
  4      0.2600000              0.3213840        
F   3
  1      2.5000000             -0.0408970        
  2      1.0000000             -0.2615790        
  3      0.4000000             -0.1040000        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: B
data:
BORON
S   13
  1  46535.6300000              0.0000380        
  2   6970.7830000              0.0002990        
  3   1586.4320000              0.0015680        
  4    449.3104000              0.0065620        
  5    146.5617000              0.0231910        
  6     52.8838700              0.0697770        
  7     20.5582500              0.1716170        
  8      8.4346280              0.3199740        
  9      3.6075170              0.3757770        
 10      1.5673140              0.1825440        
 11      0.4593870              0.0078890        
 12      0.1837770             -0.0093260        
 13      0.0723520             -0.0023760        
S   13
  1  46535.6300000              0.0000070        
  2   6970.7830000              0.0000580        
  3   1586.4320000              0.0003040        
  4    449.3104000              0.0012650        
  5    146.5617000              0.0045710        
  6     52.8838700              0.0138730        
  7     20.5582500              0.0368460        
  8      8.4346280              0.0755700        
  9      3.6075170              0.1311800        
 10      1.5673140              0.1040660        
 11      0.4593870             -0.2948750        
 12      0.1837770             -0.5951940        
 13      0.0723520             -0.2524680        
S   13
  1  46535.6300000             -0.0000100        
  2   6970.7830000             -0.0000780        
  3   1586.4320000             -0.0004250        
  4    449.3104000             -0.0016870        
  5    146.5617000             -0.0064940        
  6     52.8838700             -0.0183720        
  7     20.5582500             -0.0546770        
  8      8.4346280             -0.0988440        
  9      3.6075170             -0.2216270        
 10      1.5673140             -0.1087330        
 11      0.4593870              1.3673000        
 12      0.1837770             -0.1605360        
 13      0.0723520             -1.0104560        
S   13
  1  46535.6300000             -0.0000160        
  2   6970.7830000             -0.0000850        
  3   1586.4320000             -0.0007330        
  4    449.3104000             -0.0015000        
  5    146.5617000             -0.0126640        
  6     52.8838700             -0.0118850        
  7     20.5582500             -0.1309810        
  8      8.4346280             -0.0009110        
  9      3.6075170             -0.7435660        
 10      1.5673140              0.8805460        
 11      0.4593870              1.5945060        
 12      0.1837770             -3.3625760        
 13      0.0723520              1.9998600        
S   13
  1  46535.6300000             -0.0000280        
  2   6970.7830000             -0.0001330        
  3   1586.4320000             -0.0013340        
  4    449.3104000             -0.0021150        
  5    146.5617000             -0.0241030        
  6     52.8838700             -0.0172690        
  7     20.5582500             -0.2817730        
  8      8.4346280              0.0919280        
  9      3.6075170             -1.6619490        
 10      1.5673140              3.7482510        
 11      0.4593870             -4.3671240        
 12      0.1837770              3.7211240        
 13      0.0723520             -1.4579420        
P   8
  1     69.0708300              0.0007880        
  2     16.3163100              0.0060540        
  3      5.1155360              0.0268150        
  4      1.8218350              0.0876760        
  5      0.7134520              0.2299150        
  6      0.2921230              0.3928250        
  7      0.1211450              0.3591870        
  8      0.0496310              0.1267060        
P   8
  1     69.0708300             -0.0006780        
  2     16.3163100             -0.0046420        
  3      5.1155360             -0.0191090        
  4      1.8218350             -0.0236700        
  5      0.7134520             -0.4489010        
  6      0.2921230             -0.5555940        
  7      0.1211450              0.6756720        
  8      0.0496310              0.4898320        
P   8
  1     69.0708300             -0.0021280        
  2     16.3163100             -0.0213760        
  3      5.1155360             -0.0857400        
  4      1.8218350             -0.4424910        
  5      0.7134520             -0.7928600        
  6      0.2921230              1.2734220        
  7      0.1211450              0.0686900        
  8      0.0496310             -0.6435200        
P   8
  1     69.0708300              0.0042950        
  2     16.3163100              0.0455420        
  3      5.1155360              0.2271550        
  4      1.8218350              1.2038240        
  5      0.7134520             -1.7811720        
  6      0.2921230              0.5551810        
  7      0.1211450              0.8395040        
  8      0.0496310             -0.8663320        
D   6
  1      4.9400000              0.0049470        
  2      1.9800000              0.0211630        
  3      0.7900000              0.2284320        
  4      0.3200000              0.5540020        
  5      0.1300000              0.3358490        
  6      0.0500000              0.0315590        
D   6
  1      4.9400000              0.0012420        
  2      1.9800000              0.0295490        
  3      0.7900000             -0.8524410        
  4      0.3200000             -0.0562740        
  5      0.1300000              0.7923540        
  6      0.0500000              0.0523140        
D   6
  1      4.9400000             -0.0332890        
  2      1.9800000              0.4971840        
  3      0.7900000              0.7012450        
  4      0.3200000             -1.5635310        
  5      0.1300000              0.9384830        
  6      0.0500000              0.1343160        
F   4
  1      2.3700000             -0.0006330        
  2      0.9500000              0.2685220        
  3      0.3800000              0.6569880        
  4      0.1500000              0.2361740        
F   4
  1      2.3700000              0.0234220        
  2      0.9500000             -0.9760110        
  3      0.3800000              0.3028120        
  4      0.1500000              0.5859530        
G   2
  1      1.1400000              0.0226120        
  2      0.4600000              0.0618390        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: C
data:
CARBON
S   13
  1  50557.5000000             -0.0000550        
  2   7524.7860000             -0.0004340        
  3   1694.3280000             -0.0023160        
  4    472.8228000             -0.0098720        
  5    151.7108000             -0.0352170        
  6     53.9187500             -0.1041840        
  7     20.6593100             -0.2412550        
  8      8.3839760             -0.3839290        
  9      3.5770150             -0.3082190        
 10      1.5471180             -0.0685280        
 11      0.6130130             -0.0008300        
 12      0.2460680             -0.0007820        
 13      0.0990870              0.0000400        
S   13
  1  50557.5000000              0.0000120        
  2   7524.7860000              0.0000930        
  3   1694.3280000              0.0004990        
  4    472.8228000              0.0021300        
  5    151.7108000              0.0077300        
  6     53.9187500              0.0235640        
  7     20.6593100              0.0595220        
  8      8.3839760              0.1143360        
  9      3.5770150              0.1522810        
 10      1.5471180              0.0151440        
 11      0.6130130             -0.3771710        
 12      0.2460680             -0.5446960        
 13      0.0990870             -0.2118860        
S   13
  1  50557.5000000              0.0000150        
  2   7524.7860000              0.0001130        
  3   1694.3280000              0.0006190        
  4    472.8228000              0.0025730        
  5    151.7108000              0.0097100        
  6     53.9187500              0.0286220        
  7     20.6593100              0.0784070        
  8      8.3839760              0.1408680        
  9      3.5770150              0.2572040        
 10      1.5471180             -0.1459450        
 11      0.6130130             -1.2807690        
 12      0.2460680              0.3050960        
 13      0.0990870              0.9395570        
S   13
  1  50557.5000000             -0.0000210        
  2   7524.7860000             -0.0001500        
  3   1694.3280000             -0.0009270        
  4    472.8228000             -0.0032930        
  5    151.7108000             -0.0152800        
  6     53.9187500             -0.0361830        
  7     20.6593100             -0.1415290        
  8      8.3839760             -0.1583370        
  9      3.5770150             -0.6198780        
 10      1.5471180              1.6292380        
 11      0.6130130              0.3686210        
 12      0.2460680             -2.6581790        
 13      0.0990870              1.8389120        
S   13
  1  50557.5000000              0.0000270        
  2   7524.7860000              0.0002430        
  3   1694.3280000              0.0010600        
  4    472.8228000              0.0060840        
  5    151.7108000              0.0154970        
  6     53.9187500              0.0841670        
  7     20.6593100              0.1295830        
  8      8.3839760              0.5352150        
  9      3.5770150              0.1404660        
 10      1.5471180             -3.3835810        
 11      0.6130130              5.4782250        
 12      0.2460680             -4.6005230        
 13      0.0990870              1.8602740        
P   8
  1     83.3331600              0.0012590        
  2     19.5576100              0.0096840        
  3      6.0803650              0.0429250        
  4      2.1793170              0.1350750        
  5      0.8651500              0.2877740        
  6      0.3619440              0.3819310        
  7      0.1547400              0.2957000        
  8      0.0654290              0.0894270        
P   8
  1     83.3331600             -0.0014280        
  2     19.5576100             -0.0121100        
  3      6.0803650             -0.0439380        
  4      2.1793170             -0.1715550        
  5      0.8651500             -0.6071950        
  6      0.3619440             -0.1124360        
  7      0.1547400              0.7059750        
  8      0.0654290              0.2946330        
P   8
  1     83.3331600             -0.0033970        
  2     19.5576100             -0.0348970        
  3      6.0803650             -0.1458010        
  4      2.1793170             -0.7141050        
  5      0.8651500             -0.1447190        
  6      0.3619440              1.3380700        
  7      0.1547400             -0.5156130        
  8      0.0654290             -0.4247490        
P   8
  1     83.3331600             -0.0082530        
  2     19.5576100             -0.0463370        
  3      6.0803650             -0.4533180        
  4      2.1793170             -0.8458060        
  5      0.8651500              2.2349810        
  6      0.3619440             -1.7564070        
  7      0.1547400              0.1044810        
  8      0.0654290              0.5895210        
D   6
  1      7.1200000              0.0060430        
  2      2.8500000              0.0323520        
  3      1.1400000              0.2680560        
  4      0.4600000              0.5629150        
  5      0.1800000              0.2947570        
  6      0.0700000              0.0185720        
D   6
  1      7.1200000             -0.0022570        
  2      2.8500000             -0.0814260        
  3      1.1400000             -0.8816000        
  4      0.4600000              0.1898660        
  5      0.1800000              0.6773950        
  6      0.0700000              0.0160090        
D   6
  1      7.1200000              0.0422830        
  2      2.8500000             -0.6511290        
  3      1.1400000             -0.3567930        
  4      0.4600000              1.3926760        
  5      0.1800000             -1.0421080        
  6      0.0700000             -0.0472330        
F   4
  1      3.4200000             -0.0086750        
  2      1.3700000             -0.3177130        
  3      0.5500000             -0.6481920        
  4      0.2200000             -0.1872250        
F   4
  1      3.4200000              0.0577450        
  2      1.3700000              0.9713630        
  3      0.5500000             -0.4559240        
  4      0.2200000             -0.4949370        
G   2
  1      1.6400000              0.2207740        
  2      0.6600000              0.5020490        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: N
data:
NITROGEN
S   13
  1  74761.7200000             -0.0000500        
  2  11123.6500000             -0.0003940        
  3   2512.6060000             -0.0020880        
  4    703.7773000             -0.0089060        
  5    225.4788000             -0.0320810        
  6     79.6158100             -0.0974240        
  7     30.2372800             -0.2317290        
  8     12.2636200             -0.3775390        
  9      5.2650860             -0.3186230        
 10      2.3334710             -0.0825770        
 11      0.9018560             -0.0031020        
 12      0.3583360             -0.0005370        
 13      0.1410930             -0.0000840        
S   13
  1  74761.7200000             -0.0000110        
  2  11123.6500000             -0.0000870        
  3   2512.6060000             -0.0004630        
  4    703.7773000             -0.0019780        
  5    225.4788000             -0.0072440        
  6     79.6158100             -0.0226460        
  7     30.2372800             -0.0586980        
  8     12.2636200             -0.1145750        
  9      5.2650860             -0.1544720        
 10      2.3334710             -0.0237660        
 11      0.9018560              0.3653340        
 12      0.3583360              0.5391500        
 13      0.1410930              0.2361310        
S   13
  1  74761.7200000             -0.0000130        
  2  11123.6500000             -0.0001000        
  3   2512.6060000             -0.0005420        
  4    703.7773000             -0.0022610        
  5    225.4788000             -0.0085640        
  6     79.6158100             -0.0260120        
  7     30.2372800             -0.0722070        
  8     12.2636200             -0.1338020        
  9      5.2650860             -0.2394150        
 10      2.3334710              0.0774780        
 11      0.9018560              1.1802320        
 12      0.3583360             -0.0507720        
 13      0.1410930             -1.0739830        
S   13
  1  74761.7200000             -0.0000190        
  2  11123.6500000             -0.0001380        
  3   2512.6060000             -0.0008490        
  4    703.7773000             -0.0029900        
  5    225.4788000             -0.0140820        
  6     79.6158100             -0.0337100        
  7     30.2372800             -0.1354030        
  8     12.2636200             -0.1584830        
  9      5.2650860             -0.6205340        
 10      2.3334710              1.3741870        
 11      0.9018560              0.8457250        
 12      0.3583360             -2.8973320        
 13      0.1410930              1.8265160        
S   13
  1  74761.7200000             -0.0000260        
  2  11123.6500000             -0.0002170        
  3   2512.6060000             -0.0010290        
  4    703.7773000             -0.0052720        
  5    225.4788000             -0.0156310        
  6     79.6158100             -0.0716750        
  7     30.2372800             -0.1451730        
  8     12.2636200             -0.4828000        
  9      5.2650860             -0.4292830        
 10      2.3334710              3.6558940        
 11      0.9018560             -5.3943790        
 12      0.3583360              4.3124510        
 13      0.1410930             -1.6751360        
P   8
  1    126.6666000             -0.0011590        
  2     29.8373900             -0.0090760        
  3      9.3940380             -0.0410620        
  4      3.4051040             -0.1308640        
  5      1.3500000             -0.2811560        
  6      0.5576960             -0.3794870        
  7      0.2324490             -0.3084750        
  8      0.0942640             -0.1001230        
P   8
  1    126.6666000             -0.0015400        
  2     29.8373900             -0.0127560        
  3      9.3940380             -0.0544030        
  4      3.4051040             -0.1960780        
  5      1.3500000             -0.5721950        
  6      0.5576960             -0.1210980        
  7      0.2324490              0.6800960        
  8      0.0942640              0.3024740        
P   8
  1    126.6666000              0.0029310        
  2     29.8373900              0.0320590        
  3      9.3940380              0.1301490        
  4      3.4051040              0.6577300        
  5      1.3500000              0.2299880        
  6      0.5576960             -1.3505170        
  7      0.2324490              0.4670660        
  8      0.0942640              0.4716270        
P   8
  1    126.6666000             -0.0063820        
  2     29.8373900             -0.0442630        
  3      9.3940380             -0.3604970        
  4      3.4051040             -0.9660740        
  5      1.3500000              2.1275980        
  6      0.5576960             -1.3666180        
  7      0.2324490             -0.2592450        
  8      0.0942640              0.7251700        
D   6
  1      9.8800000             -0.0075870        
  2      3.9500000             -0.0395040        
  3      1.5800000             -0.2954160        
  4      0.6300000             -0.5571910        
  5      0.2500000             -0.2672820        
  6      0.1000000             -0.0226350        
D   6
  1      9.8800000             -0.0070770        
  2      3.9500000             -0.1375520        
  3      1.5800000             -0.8397580        
  4      0.6300000              0.2322790        
  5      0.2500000              0.6454730        
  6      0.1000000              0.0262550        
D   6
  1      9.8800000              0.0405900        
  2      3.9500000             -0.6978630        
  3      1.5800000             -0.2316980        
  4      0.6300000              1.3280670        
  5      0.2500000             -1.0562720        
  6      0.1000000             -0.0453790        
F   4
  1      4.7400000             -0.0156330        
  2      1.9000000             -0.3314390        
  3      0.7600000             -0.6419220        
  4      0.3000000             -0.1791490        
F   4
  1      4.7400000              0.0985510        
  2      1.9000000              0.9406250        
  3      0.7600000             -0.4776820        
  4      0.3000000             -0.4789520        
G   2
  1      2.2800000             -0.1016900        
  2      0.9100000             -0.2182890        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: O
data:
OXYGEN
S   13
  1 105374.9000000             -0.0000460        
  2  15679.2400000             -0.0003610        
  3   3534.5450000             -0.0019200        
  4    987.3652000             -0.0082060        
  5    315.9788000             -0.0297250        
  6    111.6543000             -0.0904520        
  7     42.6994500             -0.2174020        
  8     17.3956000             -0.3687200        
  9      7.4383090             -0.3372770        
 10      3.2228620             -0.0968080        
 11      1.2538770             -0.0026690        
 12      0.4951550             -0.0011980        
 13      0.1916650              0.0000310        
S   13
  1 105374.9000000              0.0000100        
  2  15679.2400000              0.0000820        
  3   3534.5450000              0.0004380        
  4    987.3652000              0.0018750        
  5    315.9788000              0.0069090        
  6    111.6543000              0.0215870        
  7     42.6994500              0.0564730        
  8     17.3956000              0.1132450        
  9      7.4383090              0.1607000        
 10      3.2228620              0.0336720        
 11      1.2538770             -0.3602440        
 12      0.4951550             -0.5470660        
 13      0.1916650             -0.2385320        
S   13
  1 105374.9000000             -0.0000130        
  2  15679.2400000             -0.0000990        
  3   3534.5450000             -0.0005380        
  4    987.3652000             -0.0022490        
  5    315.9788000             -0.0085730        
  6    111.6543000             -0.0260090        
  7     42.6994500             -0.0729130        
  8     17.3956000             -0.1398840        
  9      7.4383090             -0.2605780        
 10      3.2228620              0.0729810        
 11      1.2538770              1.2852860        
 12      0.4951550             -0.2246480        
 13      0.1916650             -0.9668200        
S   13
  1 105374.9000000             -0.0000180        
  2  15679.2400000             -0.0001240        
  3   3534.5450000             -0.0008190        
  4    987.3652000             -0.0026510        
  5    315.9788000             -0.0139020        
  6    111.6543000             -0.0288900        
  7     42.6994500             -0.1371420        
  8     17.3956000             -0.1283230        
  9      7.4383090             -0.7172940        
 10      3.2228620              1.5531810        
 11      1.2538770              0.5737480        
 12      0.4951550             -2.6840910        
 13      0.1916650              1.7723270        
S   13
  1 105374.9000000              0.0000230        
  2  15679.2400000              0.0002010        
  3   3534.5450000              0.0008920        
  4    987.3652000              0.0050000        
  5    315.9788000              0.0130480        
  6    111.6543000              0.0682180        
  7     42.6994500              0.1149180        
  8     17.3956000              0.5126890        
  9      7.4383090              0.4232850        
 10      3.2228620             -3.6436580        
 11      1.2538770              5.3817360        
 12      0.4951550             -4.3016680        
 13      0.1916650              1.6892850        
P   8
  1    200.0000000             -0.0008970        
  2     46.5333700             -0.0074020        
  3     14.6218100             -0.0350850        
  4      5.3130660             -0.1157930        
  5      2.1025250             -0.2588670        
  6      0.8502230             -0.3721680        
  7      0.3375970             -0.3362950        
  8      0.1288920             -0.1400770        
P   8
  1    200.0000000             -0.0011700        
  2     46.5333700             -0.0095360        
  3     14.6218100             -0.0461910        
  4      5.3130660             -0.1547550        
  5      2.1025250             -0.4877390        
  6      0.8502230             -0.2739600        
  7      0.3375970              0.5664240        
  8      0.1288920              0.4606190        
P   8
  1    200.0000000              0.0018200        
  2     46.5333700              0.0201190        
  3     14.6218100              0.0824950        
  4      5.3130660              0.4220310        
  5      2.1025250              0.5872920        
  6      0.8502230             -1.0804780        
  7      0.3375970             -0.2290960        
  8      0.1288920              0.8232930        
P   8
  1    200.0000000              0.0025650        
  2     46.5333700              0.0375240        
  3     14.6218100              0.1474520        
  4      5.3130660              0.9769990        
  5      2.1025250             -0.9891480        
  6      0.8502230             -0.5855570        
  7      0.3375970              1.6715550        
  8      0.1288920             -1.1422140        
D   6
  1     12.6500000              0.0091190        
  2      5.0600000              0.0496170        
  3      2.0200000              0.3304950        
  4      0.8100000              0.5518570        
  5      0.3200000              0.2309480        
  6      0.1300000              0.0191480        
D   6
  1     12.6500000             -0.0069980        
  2      5.0600000             -0.1799800        
  3      2.0200000             -0.7960890        
  4      0.8100000              0.2794970        
  5      0.3200000              0.6241430        
  6      0.1300000              0.0443910        
D   6
  1     12.6500000              0.0181860        
  2      5.0600000             -0.7039470        
  3      2.0200000             -0.1663100        
  4      0.8100000              1.2517420        
  5      0.3200000             -0.9982670        
  6      0.1300000             -0.0947370        
F   4
  1      6.0700000              0.0246300        
  2      2.4300000              0.3305760        
  3      0.9700000              0.6026000        
  4      0.3900000              0.2305680        
F   4
  1      6.0700000              0.1341700        
  2      2.4300000              0.8433330        
  3      0.9700000             -0.3159330        
  4      0.3900000             -0.5806660        
G   2
  1      3.1100000              0.2068850        
  2      1.2400000              0.5142530        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: F
data:
FLUORINE
S   13
  1 103109.5000000             -0.0000640        
  2  15281.0100000             -0.0005030        
  3   3441.5390000             -0.0026680        
  4    967.0948000             -0.0112000        
  5    314.0353000             -0.0390970        
  6    113.4423000             -0.1122630        
  7     44.6447300             -0.2471990        
  8     18.9428700             -0.3680040        
  9      8.5327430             -0.2908630        
 10      3.9194010             -0.0781650        
 11      1.5681570             -0.0035660        
 12      0.6232900             -0.0008280        
 13      0.2408610             -0.0000990        
S   13
  1 103109.5000000              0.0000150        
  2  15281.0100000              0.0001170        
  3   3441.5390000              0.0006210        
  4    967.0948000              0.0026160        
  5    314.0353000              0.0093060        
  6    113.4423000              0.0277210        
  7     44.6447300              0.0673550        
  8     18.9428700              0.1224660        
  9      8.5327430              0.1512910        
 10      3.9194010              0.0079700        
 11      1.5681570             -0.3715510        
 12      0.6232900             -0.5414310        
 13      0.2408610             -0.2241820        
S   13
  1 103109.5000000              0.0000190        
  2  15281.0100000              0.0001450        
  3   3441.5390000              0.0007830        
  4    967.0948000              0.0032360        
  5    314.0353000              0.0118770        
  6    113.4423000              0.0345130        
  7     44.6447300              0.0902000        
  8     18.9428700              0.1573670        
  9      8.5327430              0.2715840        
 10      3.9194010             -0.1756500        
 11      1.5681570             -1.3303090        
 12      0.6232900              0.4295620        
 13      0.2408610              0.8476670        
S   13
  1 103109.5000000              0.0000260        
  2  15281.0100000              0.0001800        
  3   3441.5390000              0.0011590        
  4    967.0948000              0.0037830        
  5    314.0353000              0.0188610        
  6    113.4423000              0.0376680        
  7     44.6447300              0.1712260        
  8     18.9428700              0.1249010        
  9      8.5327430              0.8289720        
 10      3.9194010             -2.0976590        
 11      1.5681570              0.1895160        
 12      0.6232900              2.1772700        
 13      0.2408610             -1.6405690        
S   13
  1 103109.5000000             -0.0000290        
  2  15281.0100000             -0.0002920        
  3   3441.5390000             -0.0010440        
  4    967.0948000             -0.0075170        
  5    314.0353000             -0.0125610        
  6    113.4423000             -0.1025060        
  7     44.6447300             -0.0588260        
  8     18.9428700             -0.8356590        
  9      8.5327430              0.3838160        
 10      3.9194010              2.9238160        
 11      1.5681570             -5.1744710        
 12      0.6232900              4.4094980        
 13      0.2408610             -1.8093660        
P   8
  1    245.3303000              0.0009910        
  2     56.9190100              0.0083130        
  3     17.6045700              0.0408510        
  4      6.2749950              0.1356910        
  5      2.4470300              0.2810480        
  6      0.9950600              0.3605290        
  7      0.4039730              0.3143100        
  8      0.1548100              0.1327170        
P   8
  1    245.3303000             -0.0013410        
  2     56.9190100             -0.0116380        
  3     17.6045700             -0.0560920        
  4      6.2749950             -0.2086300        
  5      2.4470300             -0.5326290        
  6      0.9950600             -0.1370460        
  7      0.4039730              0.5989960        
  8      0.1548100              0.3754710        
P   8
  1    245.3303000              0.0019510        
  2     56.9190100              0.0239850        
  3     17.6045700              0.0941780        
  4      6.2749950              0.5468770        
  5      2.4470300              0.3951900        
  6      0.9950600             -1.2697250        
  7      0.4039730              0.1799660        
  8      0.1548100              0.6445770        
P   8
  1    245.3303000             -0.0035290        
  2     56.9190100             -0.0365300        
  3     17.6045700             -0.2146490        
  4      6.2749950             -1.0303070        
  5      2.4470300              1.5924550        
  6      0.9950600             -0.3210870        
  7      0.4039730             -1.0965660        
  8      0.1548100              1.0024140        
D   6
  1     16.0100000             -0.0106260        
  2      6.4000000             -0.0554180        
  3      2.5600000             -0.3540980        
  4      1.0200000             -0.5453290        
  5      0.4100000             -0.2070190        
  6      0.1600000             -0.0200400        
D   6
  1     16.0100000             -0.0091840        
  2      6.4000000             -0.2110560        
  3      2.5600000             -0.7766530        
  4      1.0200000              0.3275020        
  5      0.4100000              0.5958530        
  6      0.1600000              0.0472610        
D   6
  1     16.0100000              0.0095370        
  2      6.4000000             -0.7489530        
  3      2.5600000             -0.0509370        
  4      1.0200000              1.1930080        
  5      0.4100000             -1.0266900        
  6      0.1600000             -0.0732710        
F   4
  1      7.6800000              0.0279290        
  2      3.0700000              0.3522960        
  3      1.2300000              0.6019790        
  4      0.4900000              0.2047560        
F   4
  1      7.6800000              0.1702670        
  2      3.0700000              0.8225970        
  3      1.2300000             -0.3653600        
  4      0.4900000             -0.5564830        
G   2
  1      3.6900000              0.2422500        
  2      1.4800000              0.4848000        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ne
data:
NEON
S   13
  1 166165.1000000             -0.0000470        
  2  23107.5200000             -0.0004010        
  3   5060.1540000             -0.0021930        
  4   1384.6120000             -0.0095880        
  5    436.5126000             -0.0350740        
  6    153.4715000             -0.1046520        
  7     59.3890900             -0.2377150        
  8     24.8619700             -0.3696030        
  9     11.0157000             -0.3061760        
 10      4.9651750             -0.0841810        
 11      1.9365030             -0.0037260        
 12      0.7657280             -0.0009060        
 13      0.2955380             -0.0000970        
S   13
  1 166165.1000000              0.0000110        
  2  23107.5200000              0.0000940        
  3   5060.1540000              0.0005180        
  4   1384.6120000              0.0022660        
  5    436.5126000              0.0084540        
  6    153.4715000              0.0260490        
  7     59.3890900              0.0652960        
  8     24.8619700              0.1223380        
  9     11.0157000              0.1581770        
 10      4.9651750              0.0068050        
 11      1.9365030             -0.3840260        
 12      0.7657280             -0.5364530        
 13      0.2955380             -0.2153010        
S   13
  1 166165.1000000              0.0000140        
  2  23107.5200000              0.0001180        
  3   5060.1540000              0.0006640        
  4   1384.6120000              0.0028190        
  5    436.5126000              0.0109800        
  6    153.4715000              0.0324570        
  7     59.3890900              0.0893800        
  8     24.8619700              0.1556500        
  9     11.0157000              0.2940090        
 10      4.9651750             -0.2056040        
 11      1.9365030             -1.3584610        
 12      0.7657280              0.5384440        
 13      0.2955380              0.7795870        
S   13
  1 166165.1000000              0.0000200        
  2  23107.5200000              0.0001450        
  3   5060.1540000              0.0009860        
  4   1384.6120000              0.0032570        
  5    436.5126000              0.0174250        
  6    153.4715000              0.0347690        
  7     59.3890900              0.1686180        
  8     24.8619700              0.1210790        
  9     11.0157000              0.8926870        
 10      4.9651750             -2.2664330        
 11      1.9365030              0.5034990        
 12      0.7657280              1.9000480        
 13      0.2955380             -1.5575610        
S   13
  1 166165.1000000              0.0000200        
  2  23107.5200000              0.0002330        
  3   5060.1540000              0.0007730        
  4   1384.6120000              0.0063680        
  5    436.5126000              0.0102500        
  6    153.4715000              0.0926510        
  7     59.3890900              0.0463750        
  8     24.8619700              0.8093540        
  9     11.0157000             -0.3518130        
 10      4.9651750             -2.7602720        
 11      1.9365030              4.9964210        
 12      0.7657280             -4.4339140        
 13      0.2955380              1.8817270        
P   8
  1    234.9450000              0.0015830        
  2     55.0773900              0.0125760        
  3     17.3895500              0.0569980        
  4      6.3895370              0.1681760        
  5      2.5420820              0.3072180        
  6      1.0337640              0.3593200        
  7      0.4187880              0.2777820        
  8      0.1646270              0.0959400        
P   8
  1    234.9450000              0.0022120        
  2     55.0773900              0.0185740        
  3     17.3895500              0.0814830        
  4      6.3895370              0.2938600        
  5      2.5420820              0.5407690        
  6      1.0337640             -0.0952100        
  7      0.4187880             -0.6072760        
  8      0.1646270             -0.2468710        
P   8
  1    234.9450000              0.0034260        
  2     55.0773900              0.0365090        
  3     17.3895500              0.1449930        
  4      6.3895370              0.7390660        
  5      2.5420820             -0.1218540        
  6      1.0337640             -1.2039080        
  7      0.4187880              0.6371190        
  8      0.1646270              0.3705060        
P   8
  1    234.9450000              0.0077930        
  2     55.0773900              0.0407820        
  3     17.3895500              0.4391860        
  4      6.3895370              0.7732630        
  5      2.5420820             -2.1396120        
  6      1.0337640              1.6738260        
  7      0.4187880             -0.0788190        
  8      0.1646270             -0.5969450        
D   6
  1     19.7600000              0.0119140        
  2      7.9100000              0.0617980        
  3      3.1600000              0.3708520        
  4      1.2600000              0.5374730        
  5      0.5100000              0.1918420        
  6      0.2000000              0.0200170        
D   6
  1     19.7600000              0.0115800        
  2      7.9100000              0.2345970        
  3      3.1600000              0.7597520        
  4      1.2600000             -0.3630520        
  5      0.5100000             -0.5749240        
  6      0.2000000             -0.0492910        
D   6
  1     19.7600000             -0.0039030        
  2      7.9100000              0.7860850        
  3      3.1600000             -0.0409080        
  4      1.2600000             -1.1330200        
  5      0.5100000              1.0283870        
  6      0.2000000              0.0623780        
F   4
  1      9.4900000              0.0266600        
  2      3.7900000              0.3877580        
  3      1.5200000              0.6085930        
  4      0.6100000              0.1490020        
F   4
  1      9.4900000             -0.2082060        
  2      3.7900000             -0.7976170        
  3      1.5200000              0.4364530        
  4      0.6100000              0.5219250        
G   2
  1      4.5500000             -0.2514800        
  2      1.8200000             -0.4774010        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Al
data:
ALUMINUM
S   20
  1 446287.3000000             -0.0000220        
  2 192715.4000000             -0.0000080        
  3  83218.1700000             -0.0000990        
  4  35935.1900000             -0.0002020        
  5  15517.5000000             -0.0006550        
  6   6700.7540000             -0.0017980        
  7   2893.5130000             -0.0051340        
  8   1249.4740000             -0.0143840        
  9    539.5468000             -0.0390420        
 10    232.9866000             -0.1002280        
 11    100.6081000             -0.2221490        
 12     43.4444800             -0.3708840        
 13     18.7601600             -0.3193590        
 14      8.1009930             -0.0758620        
 15      3.4981640             -0.0024550        
 16      1.5105740             -0.0008860        
 17      0.6522950             -0.0000390        
 18      0.2816730              0.0000180        
 19      0.1216320             -0.0000110        
 20      0.0525230              0.0000050        
S   20
  1 446287.3000000              0.0000060        
  2 192715.4000000              0.0000020        
  3  83218.1700000              0.0000260        
  4  35935.1900000              0.0000530        
  5  15517.5000000              0.0001710        
  6   6700.7540000              0.0004680        
  7   2893.5130000              0.0013420        
  8   1249.4740000              0.0037890        
  9    539.5468000              0.0104670        
 10    232.9866000              0.0279470        
 11    100.6081000              0.0676130        
 12     43.4444800              0.1380530        
 13     18.7601600              0.1786390        
 14      8.1009930             -0.0028750        
 15      3.4981640             -0.4175210        
 16      1.5105740             -0.5531540        
 17      0.6522950             -0.1552930        
 18      0.2816730              0.0028370        
 19      0.1216320             -0.0022720        
 20      0.0525230              0.0004760        
S   19
  1 446287.3000000              0.0000010        
  2  83218.1700000              0.0000060        
  3  35935.1900000              0.0000120        
  4  15517.5000000              0.0000400        
  5   6700.7540000              0.0001080        
  6   2893.5130000              0.0003130        
  7   1249.4740000              0.0008770        
  8    539.5468000              0.0024460        
  9    232.9866000              0.0065020        
 10    100.6081000              0.0159470        
 11     43.4444800              0.0328300        
 12     18.7601600              0.0444890        
 13      8.1009930             -0.0021180        
 14      3.4981640             -0.1190750        
 15      1.5105740             -0.2435270        
 16      0.6522950             -0.1841580        
 17      0.2816730              0.2990910        
 18      0.1216320              0.6375160        
 19      0.0525230              0.2822800        
S   20
  1 446287.3000000              0.0000020        
  2 192715.4000000              0.0000010        
  3  83218.1700000              0.0000080        
  4  35935.1900000              0.0000160        
  5  15517.5000000              0.0000540        
  6   6700.7540000              0.0001430        
  7   2893.5130000              0.0004240        
  8   1249.4740000              0.0011640        
  9    539.5468000              0.0033080        
 10    232.9866000              0.0086610        
 11    100.6081000              0.0216430        
 12     43.4444800              0.0439340        
 13     18.7601600              0.0620280        
 14      8.1009930             -0.0079070        
 15      3.4981640             -0.1725310        
 16      1.5105740             -0.3906580        
 17      0.6522950             -0.3168180        
 18      0.2816730              1.8109780        
 19      0.1216320             -0.1964240        
 20      0.0525230             -1.0963580        
S   19
  1 446287.3000000             -0.0000030        
  2  83218.1700000             -0.0000150        
  3  35935.1900000             -0.0000110        
  4  15517.5000000             -0.0001020        
  5   6700.7540000             -0.0001280        
  6   2893.5130000             -0.0007570        
  7   1249.4740000             -0.0011800        
  8    539.5468000             -0.0056330        
  9    232.9866000             -0.0093640        
 10    100.6081000             -0.0367850        
 11     43.4444800             -0.0450640        
 12     18.7601600             -0.1295560        
 13      8.1009930              0.1246950        
 14      3.4981640              0.0317520        
 15      1.5105740              1.3512900        
 16      0.6522950             -1.8128290        
 17      0.2816730             -1.2513990        
 18      0.1216320              3.6932350        
 19      0.0525230             -2.2089260        
S   19
  1 446287.3000000              0.0000040        
  2  83218.1700000              0.0000220        
  3  35935.1900000              0.0000230        
  4  15517.5000000              0.0001450        
  5   6700.7540000              0.0002340        
  6   2893.5130000              0.0010860        
  7   1249.4740000              0.0020650        
  8    539.5468000              0.0081480        
  9    232.9866000              0.0164950        
 10    100.6081000              0.0544180        
 11     43.4444800              0.0827520        
 12     18.7601600              0.1907190        
 13      8.1009930             -0.2269080        
 14      3.4981640             -0.3168100        
 15      1.5105740             -1.8304500        
 16      0.6522950              6.1097180        
 17      0.2816730             -7.9328300        
 18      0.1216320              5.9405300        
 19      0.0525230             -2.2054020        
P   13
  1   1086.6970000             -0.0002650        
  2    439.5274000             -0.0007820        
  3    177.7720000             -0.0041300        
  4     71.9019600             -0.0170060        
  5     29.0815900             -0.0636660        
  6     11.7623900             -0.1870800        
  7      4.7574350             -0.3608060        
  8      1.9242000             -0.4052180        
  9      0.7782650             -0.1795230        
 10      0.3147780             -0.0090350        
 11      0.1273160             -0.0035340        
 12      0.0514940              0.0013060        
 13      0.0208270             -0.0004880        
P   13
  1   1086.6970000             -0.0000500        
  2    439.5274000             -0.0001490        
  3    177.7720000             -0.0007770        
  4     71.9019600             -0.0032370        
  5     29.0815900             -0.0121840        
  6     11.7623900             -0.0367040        
  7      4.7574350             -0.0717950        
  8      1.9242000             -0.0874930        
  9      0.7782650             -0.0305910        
 10      0.3147780              0.2294340        
 11      0.1273160              0.5016700        
 12      0.0514940              0.3680840        
 13      0.0208270              0.0524820        
P   13
  1   1086.6970000             -0.0000630        
  2    439.5274000             -0.0001700        
  3    177.7720000             -0.0009820        
  4     71.9019600             -0.0038320        
  5     29.0815900             -0.0149970        
  6     11.7623900             -0.0434930        
  7      4.7574350             -0.0914300        
  8      1.9242000             -0.1074080        
  9      0.7782650             -0.1370660        
 10      0.3147780              0.8178660        
 11      0.1273160              0.3884830        
 12      0.0514940             -0.9498570        
 13      0.0208270             -0.1469130        
P   13
  1   1086.6970000             -0.0000350        
  2    439.5274000             -0.0005320        
  3    177.7720000             -0.0005580        
  4     71.9019600             -0.0084590        
  5     29.0815900             -0.0142670        
  6     11.7623900             -0.0880600        
  7      4.7574350             -0.0835720        
  8      1.9242000             -0.3565440        
  9      0.7782650              0.3455810        
 10      0.3147780              1.4428600        
 11      0.1273160             -2.2406190        
 12      0.0514940              0.9837240        
 13      0.0208270              0.2398090        
P   13
  1   1086.6970000             -0.0000230        
  2    439.5274000             -0.0012280        
  3    177.7720000             -0.0004040        
  4     71.9019600             -0.0185920        
  5     29.0815900             -0.0226720        
  6     11.7623900             -0.1961010        
  7      4.7574350             -0.1286890        
  8      1.9242000             -0.7614490        
  9      0.7782650              2.6403520        
 10      0.3147780             -2.7866990        
 11      0.1273160              1.4688110        
 12      0.0514940              0.0026120        
 13      0.0208270             -0.5108050        
D   6
  1      3.0700000              0.0126950        
  2      1.2300000              0.0078300        
  3      0.4900000              0.1739390        
  4      0.2000000              0.5921450        
  5      0.0800000              0.3523720        
  6      0.0300000              0.0170190        
D   6
  1      3.0700000              0.0282050        
  2      1.2300000             -0.1334430        
  3      0.4900000              0.7398030        
  4      0.2000000              0.3295820        
  5      0.0800000             -0.9390270        
  6      0.0300000             -0.0534490        
D   6
  1      3.0700000              0.0819980        
  2      1.2300000              0.1220540        
  3      0.4900000             -1.5552120        
  4      0.2000000              1.9529650        
  5      0.0800000             -0.9321900        
  6      0.0300000             -0.1892570        
F   4
  1      1.5800000              0.0210130        
  2      0.6300000             -0.1426860        
  3      0.2500000             -0.6859880        
  4      0.1000000             -0.3185340        
F   4
  1      1.5800000             -0.1496420        
  2      0.6300000              0.7782780        
  3      0.2500000              0.2276380        
  4      0.1000000             -0.8641270        
G   2
  1      1.0600000             -0.0847370        
  2      0.4200000             -0.2321400        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: P
data:
PHOSPHOROUS
S   18
  1 1948462.0000000             0.0000060        
  2 291808.8000000              0.0000460        
  3  66414.4900000              0.0002390        
  4  18812.8200000              0.0010110        
  5   6137.6770000              0.0036670        
  6   2215.7920000              0.0118270        
  7    864.2240000              0.0342030        
  8    358.3963000              0.0875650        
  9    156.1584000              0.1894050        
 10     70.8394000              0.3155000        
 11     33.2032600              0.3324620        
 12     15.7730600              0.1589360        
 13      6.6411840              0.0176790        
 14      3.0675010             -0.0006250        
 15      1.4162150              0.0007260        
 16      0.4708110             -0.0002240        
 17      0.2115790              0.0001060        
 18      0.0887770             -0.0000330        
S   18
  1 1948462.0000000             0.0000020        
  2 291808.8000000              0.0000120        
  3  66414.4900000              0.0000650        
  4  18812.8200000              0.0002740        
  5   6137.6770000              0.0010010        
  6   2215.7920000              0.0032390        
  7    864.2240000              0.0095550        
  8    358.3963000              0.0252490        
  9    156.1584000              0.0593670        
 10     70.8394000              0.1152380        
 11     33.2032600              0.1696200        
 12     15.7730600              0.0984390        
 13      6.6411840             -0.2441630        
 14      3.0675010             -0.5645630        
 15      1.4162150             -0.3347200        
 16      0.4708110             -0.0234800        
 17      0.2115790              0.0042390        
 18      0.0887770             -0.0011790        
S   17
  1 291808.8000000              0.0000030        
  2  66414.4900000              0.0000180        
  3  18812.8200000              0.0000760        
  4   6137.6770000              0.0002770        
  5   2215.7920000              0.0008920        
  6    864.2240000              0.0026480        
  7    358.3963000              0.0069780        
  8    156.1584000              0.0166440        
  9     70.8394000              0.0324560        
 10     33.2032600              0.0499990        
 11     15.7730600              0.0289330        
 12      6.6411840             -0.0800430        
 13      3.0675010             -0.2549410        
 14      1.4162150             -0.2755500        
 15      0.4708110              0.3255040        
 16      0.2115790              0.6461680        
 17      0.0887770              0.2471940        
S   18
  1 1948462.0000000            -0.0000010        
  2 291808.8000000             -0.0000040        
  3  66414.4900000             -0.0000230        
  4  18812.8200000             -0.0000940        
  5   6137.6770000             -0.0003530        
  6   2215.7920000             -0.0011090        
  7    864.2240000             -0.0033970        
  8    358.3963000             -0.0086340        
  9    156.1584000             -0.0216420        
 10     70.8394000             -0.0398620        
 11     33.2032600             -0.0683050        
 12     15.7730600             -0.0296200        
 13      6.6411840              0.1105090        
 14      3.0675010              0.3816900        
 15      1.4162150              0.4086470        
 16      0.4708110             -1.8725740        
 17      0.2115790              0.3640590        
 18      0.0887770              1.0430610        
S   18
  1 1948462.0000000            -0.0000010        
  2 291808.8000000             -0.0000050        
  3  66414.4900000             -0.0000330        
  4  18812.8200000             -0.0001070        
  5   6137.6770000             -0.0005420        
  6   2215.7920000             -0.0011510        
  7    864.2240000             -0.0055720        
  8    358.3963000             -0.0078440        
  9    156.1584000             -0.0394080        
 10     70.8394000             -0.0244150        
 11     33.2032600             -0.1628340        
 12     15.7730600              0.1057660        
 13      6.6411840             -0.1620660        
 14      3.0675010              1.4916960        
 15      1.4162150             -1.1900970        
 16      0.4708110             -2.2231430        
 17      0.2115790              4.2408410        
 18      0.0887770             -2.3273390        
S   18
  1 1948462.0000000            -0.0000010        
  2 291808.8000000             -0.0000090        
  3  66414.4900000             -0.0000630        
  4  18812.8200000             -0.0001890        
  5   6137.6770000             -0.0010430        
  6   2215.7920000             -0.0019740        
  7    864.2240000             -0.0109200        
  8    358.3963000             -0.0129780        
  9    156.1584000             -0.0802040        
 10     70.8394000             -0.0340870        
 11     33.2032600             -0.3651130        
 12     15.7730600              0.3388420        
 13      6.6411840             -0.1131460        
 14      3.0675010              2.9594160        
 15      1.4162150             -5.5133780        
 16      0.4708110              6.1801650        
 17      0.2115790             -5.0965400        
 18      0.0887770              1.8302610        
P   13
  1   2956.2620000              0.0001100        
  2    700.2848000              0.0009690        
  3    227.3139000              0.0053990        
  4     86.5618400              0.0221710        
  5     36.3338600              0.0707110        
  6     16.2934700              0.1715350        
  7      7.5789660              0.3002250        
  8      3.5788590              0.3606170        
  9      1.6980420              0.2356400        
 10      0.7633580              0.0483800        
 11      0.3421190              0.0000720        
 12      0.1486200              0.0009930        
 13      0.0623450             -0.0001870        
P   13
  1   2956.2620000              0.0000260        
  2    700.2848000              0.0002330        
  3    227.3139000              0.0013010        
  4     86.5618400              0.0053800        
  5     36.3338600              0.0174070        
  6     16.2934700              0.0433010        
  7      7.5789660              0.0774580        
  8      3.5788590              0.0983450        
  9      1.6980420              0.0607030        
 10      0.7633580             -0.1418900        
 11      0.3421190             -0.4222190        
 12      0.1486200             -0.4416050        
 13      0.0623450             -0.1532970        
P   13
  1   2956.2620000             -0.0000350        
  2    700.2848000             -0.0002890        
  3    227.3139000             -0.0017140        
  4     86.5618400             -0.0066670        
  5     36.3338600             -0.0229790        
  6     16.2934700             -0.0533610        
  7      7.5789660             -0.1079150        
  8      3.5788590             -0.1079980        
  9      1.6980420             -0.1671540        
 10      0.7633580              0.5282480        
 11      0.3421190              0.7949330        
 12      0.1486200             -0.7142930        
 13      0.0623450             -0.4907260        
P   13
  1   2956.2620000             -0.0000540        
  2    700.2848000             -0.0005150        
  3    227.3139000             -0.0026990        
  4     86.5618400             -0.0120860        
  5     36.3338600             -0.0361920        
  6     16.2934700             -0.1025540        
  7      7.5789660             -0.1715870        
  8      3.5788590             -0.2117410        
  9      1.6980420             -0.0425570        
 10      0.7633580              1.8194620        
 11      0.3421190             -1.6852000        
 12      0.1486200             -0.2280310        
 13      0.0623450              0.8435440        
P   13
  1   2956.2620000              0.0000570        
  2    700.2848000              0.0012260        
  3    227.3139000              0.0029070        
  4     86.5618400              0.0295840        
  5     36.3338600              0.0397020        
  6     16.2934700              0.2830760        
  7      7.5789660              0.0519940        
  8      3.5788590              0.8875690        
  9      1.6980420             -2.5179650        
 10      0.7633580              1.6696120        
 11      0.3421190              0.5680020        
 12      0.1486200             -1.7810500        
 13      0.0623450              1.1614360        
D   6
  1      4.6000000             -0.0198760        
  2      1.8400000             -0.0178410        
  3      0.7400000             -0.3265710        
  4      0.2900000             -0.6084180        
  5      0.1200000             -0.1788950        
  6      0.0470000             -0.0106940        
D   6
  1      4.6000000              0.0063540        
  2      1.8400000              0.0955530        
  3      0.7400000             -1.0098100        
  4      0.2900000              0.2698990        
  5      0.1200000              0.7356150        
  6      0.0470000             -0.0270120        
D   6
  1      4.6000000              0.1852200        
  2      1.8400000             -0.3744200        
  3      0.7400000             -0.8792550        
  4      0.2900000              1.8945390        
  5      0.1200000             -1.4375760        
  6      0.0470000              0.1146880        
F   4
  1      2.2100000              0.0228670        
  2      0.8800000             -0.3152560        
  3      0.3500000             -0.6957360        
  4      0.1400000             -0.1364460        
F   4
  1      2.2100000             -0.1152820        
  2      0.8800000              1.0917640        
  3      0.3500000             -0.4902590        
  4      0.1400000             -0.5043230        
G   2
  1      1.0600000             -0.0847370        
  2      0.4200000             -0.2321400        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   20
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802810        
 11     90.4393690              0.3483980        
 12     43.0207130              0.2217060        
 13     19.1905550              0.0400210        
 14      9.4257164             -0.0021380        
 15      4.6052434              0.0017210        
 16      2.0378343             -0.0008020        
 17      0.9800318              0.0003570        
 18      0.4456254             -0.0001460        
 19      0.1064170              0.0000550        
 20      0.0525705             -0.0000480        
S   20
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067010        
 11     90.4393690             -0.1746820        
 12     43.0207130             -0.1560400        
 13     19.1905550              0.1293030        
 14      9.4257164              0.5384620        
 15      4.6052434              0.4357260        
 16      2.0378343              0.0681210        
 17      0.9800318             -0.0024430        
 18      0.4456254              0.0019660        
 19      0.1064170             -0.0004400        
 20      0.0525705              0.0003920        
S   19
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000780        
  4  16717.4490000              0.0002840        
  5   6035.2659000              0.0009230        
  6   2353.8571000              0.0027420        
  7    976.1464600              0.0074000        
  8    425.4356300              0.0181190        
  9    193.0467700              0.0381030        
 10     90.4393690              0.0648790        
 11     43.0207130              0.0606710        
 12     19.1905550             -0.0552490        
 13      9.4257164             -0.3126030        
 14      4.6052434             -0.4016560        
 15      2.0378343              0.1716870        
 16      0.9800318              0.6894930        
 17      0.4456254              0.3942150        
 18      0.1064170              0.0257010        
 19      0.0525705             -0.0098290        
S   19
  1 794951.6500000             -0.0000010        
  2 180907.5600000             -0.0000050        
  3  51241.9330000             -0.0000200        
  4  16717.4490000             -0.0000720        
  5   6035.2659000             -0.0002330        
  6   2353.8571000             -0.0006940        
  7    976.1464600             -0.0018700        
  8    425.4356300             -0.0045860        
  9    193.0467700             -0.0096410        
 10     90.4393690             -0.0164770        
 11     43.0207130             -0.0154360        
 12     19.1905550              0.0140600        
 13      9.4257164              0.0836810        
 14      4.6052434              0.1124820        
 15      2.0378343             -0.0589590        
 16      0.9800318             -0.2519770        
 17      0.4456254             -0.2809240        
 18      0.1064170              0.3455540        
 19      0.0525705              0.6191300        
S   20
  1 5309148.1000000            -0.0000110        
  2 794951.6500000              0.0000870        
  3 180907.5600000             -0.0000550        
  4  51241.9330000             -0.0000150        
  5  16717.4490000             -0.0001380        
  6   6035.2659000             -0.0003890        
  7   2353.8571000             -0.0012610        
  8    976.1464600             -0.0031060        
  9    425.4356300             -0.0085010        
 10    193.0467700             -0.0154200        
 11     90.4393690             -0.0324540        
 12     43.0207130             -0.0188950        
 13     19.1905550              0.0035420        
 14      9.4257164              0.2003310        
 15      4.6052434              0.1192040        
 16      2.0378343              0.0579660        
 17      0.9800318             -1.0238220        
 18      0.4456254              0.2735190        
 19      0.1064170              2.0478550        
 20      0.0525705             -1.1914050        
S   20
  1 5309148.1000000            -0.0000270        
  2 794951.6500000              0.0001430        
  3 180907.5600000             -0.0004670        
  4  51241.9330000              0.0018390        
  5  16717.4490000             -0.0015630        
  6   6035.2659000              0.0000440        
  7   2353.8571000             -0.0022500        
  8    976.1464600             -0.0046630        
  9    425.4356300             -0.0131890        
 10    193.0467700             -0.0233800        
 11     90.4393690             -0.0517570        
 12     43.0207130             -0.0251040        
 13     19.1905550             -0.0079240        
 14      9.4257164              0.3605940        
 15      4.6052434              0.1640910        
 16      2.0378343              0.0239360        
 17      0.9800318             -2.3564030        
 18      0.4456254              2.6846180        
 19      0.1064170             -0.0331200        
 20      0.0525705             -2.3662390        
S   1
  1      0.0243568              1.0000000        
P   15
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620700        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969640        
  8     10.3304580              0.3688130        
  9      5.1049799              0.2348290        
 10      2.4406904              0.0493470        
 11      1.1512050              0.0009870        
 12      0.5295556              0.0008040        
 13      0.2211900             -0.0002200        
 14      0.0880000              0.0001020        
 15      0.0350000             -0.0000520        
P   15
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002600        
  3    615.1874800             -0.0014730        
  4    234.9274100             -0.0063160        
  5     99.2137530             -0.0213380        
  6     44.9161400             -0.0567710        
  7     21.2497170             -0.1097940        
  8     10.3304580             -0.1471670        
  9      5.1049799             -0.0550630        
 10      2.4406904              0.2449580        
 11      1.1512050              0.4722450        
 12      0.5295556              0.3605120        
 13      0.2211900              0.0811280        
 14      0.0880000             -0.0015090        
 15      0.0350000              0.0021630        
P   15
  1   7999.8045000              0.0000090        
  2   1894.4515000              0.0000800        
  3    615.1874800              0.0004630        
  4    234.9274100              0.0019570        
  5     99.2137530              0.0067220        
  6     44.9161400              0.0176420        
  7     21.2497170              0.0349530        
  8     10.3304580              0.0458190        
  9      5.1049799              0.0180770        
 10      2.4406904             -0.0952170        
 11      1.1512050             -0.1732680        
 12      0.5295556             -0.1884220        
 13      0.2211900              0.2407920        
 14      0.0880000              0.7134350        
 15      0.0350000              0.2069500        
P   15
  1   7999.8045000             -0.0002710        
  2   1894.4515000              0.0002410        
  3    615.1874800              0.0009410        
  4    234.9274100              0.0036340        
  5     99.2137530              0.0131300        
  6     44.9161400              0.0343020        
  7     21.2497170              0.0665440        
  8     10.3304580              0.0971630        
  9      5.1049799              0.0278160        
 10      2.4406904             -0.1818780        
 11      1.1512050             -0.5922540        
 12      0.5295556              0.1263500        
 13      0.2211900              1.2972330        
 14      0.0880000             -0.5587720        
 15      0.0350000             -0.5235050        
P   15
  1   7999.8045000             -0.0009270        
  2   1894.4515000              0.0041830        
  3    615.1874800             -0.0141980        
  4    234.9274100              0.0154300        
  5     99.2137530              0.0058240        
  6     44.9161400              0.0468230        
  7     21.2497170              0.0486290        
  8     10.3304580              0.1661510        
  9      5.1049799             -0.0441020        
 10      2.4406904             -0.1960630        
 11      1.1512050             -1.0183170        
 12      0.5295556              1.7213560        
 13      0.2211900             -0.2841240        
 14      0.0880000             -1.3692490        
 15      0.0350000              1.3006420        
P   1
  1      0.0140000              1.0000000        
D   9
  1     89.5692010              0.0018510        
  2     26.5843560              0.0138540        
  3      9.7710323              0.0547720        
  4      3.9619329              0.1487530        
  5      1.6892689              0.2660780        
  6      0.7156706              0.3261010        
  7      0.2938106              0.3127020        
  8      0.1108305              0.2231590        
  9      0.0440000              0.0882190        
D   9
  1     89.5692010             -0.0016830        
  2     26.5843560             -0.0126890        
  3      9.7710323             -0.0503750        
  4      3.9619329             -0.1390290        
  5      1.6892689             -0.2355330        
  6      0.7156706             -0.2436870        
  7      0.2938106              0.0296290        
  8      0.1108305              0.4467590        
  9      0.0440000              0.4336380        
D   9
  1     89.5692010              0.0025370        
  2     26.5843560              0.0182170        
  3      9.7710323              0.0753840        
  4      3.9619329              0.2077710        
  5      1.6892689              0.3021640        
  6      0.7156706              0.0903610        
  7      0.2938106             -0.5952700        
  8      0.1108305             -0.3623870        
  9      0.0440000              0.6102970        
D   1
  1      0.0180000              1.0000000        
F   6
  1      5.4350000              0.0228890        
  2      2.1740000              0.0913440        
  3      0.8700000              0.2721040        
  4      0.3480000              0.4715640        
  5      0.1390000              0.3691430        
  6      0.0560000              0.1058190        
F   6
  1      5.4350000             -0.0683540        
  2      2.1740000             -0.2725160        
  3      0.8700000             -0.5288800        
  4      0.3480000             -0.0623890        
  5      0.1390000              0.5415990        
  6      0.0560000              0.2653750        


name: NASA Ames ANO
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ni
data:
NICKEL
S   19
  1 5048010.4000000             0.0000090        
  2 755918.1000000              0.0000670        
  3 172026.2500000              0.0003510        
  4  48724.5720000              0.0014800        
  5  15894.8920000              0.0053610        
  6   5737.4685000              0.0171990        
  7   2237.0513000              0.0491280        
  8    927.0302000              0.1221690        
  9    403.3461500              0.2481120        
 10    182.4281600              0.3582690        
 11     84.5891710              0.2791030        
 12     38.4229310              0.0682840        
 13     18.4687910             -0.0011830        
 14      8.8681903              0.0019140        
 15      3.9188697             -0.0008790        
 16      1.8398525              0.0003770        
 17      0.80466260            -0.0001450        
 18      0.16984630             0.0000510        
 19      0.07936990            -0.0000400        
S   19
  1 5048010.4000000            -0.0000030        
  2 755918.1000000             -0.0000200        
  3 172026.2500000             -0.0001080        
  4  48724.5720000             -0.0004540        
  5  15894.8920000             -0.0016510        
  6   5737.4685000             -0.0053460        
  7   2237.0513000             -0.0156420        
  8    927.0302000             -0.0410010        
  9    403.3461500             -0.0933970        
 10    182.4281600             -0.1704110        
 11     84.5891710             -0.1937530        
 12     38.4229310              0.0436140        
 13     18.4687910              0.5194920        
 14      8.8681903              0.5037270        
 15      3.9188697              0.0912950        
 16      1.8398525             -0.0022250        
 17      0.80466260             0.0022260        
 18      0.16984630            -0.0004290        
 19      0.07936990             0.0003630        
S   19
  1 5048010.4000000             0.0000010        
  2 755918.1000000              0.0000070        
  3 172026.2500000              0.0000380        
  4  48724.5720000              0.0001610        
  5  15894.8920000              0.0005870        
  6   5737.4685000              0.0019040        
  7   2237.0513000              0.0055800        
  8    927.0302000              0.0147530        
  9    403.3461500              0.0340360        
 10    182.4281600              0.0643470        
 11     84.5891710              0.0771120        
 12     38.4229310             -0.0185120        
 13     18.4687910             -0.3044200        
 14      8.8681903             -0.4512560        
 15      3.9188697              0.1484940        
 16      1.8398525              0.7133860        
 17      0.80466260             0.3979360        
 18      0.16984630             0.0231230        
 19      0.07936990            -0.0093000        
S   18
  1 755918.1000000             -0.0000020        
  2 172026.2500000             -0.0000090        
  3  48724.5720000             -0.0000370        
  4  15894.8920000             -0.0001340        
  5   5737.4685000             -0.0004340        
  6   2237.0513000             -0.0012710        
  7    927.0302000             -0.0033680        
  8    403.3461500             -0.0077540        
  9    182.4281600             -0.0147500        
 10     84.5891710             -0.0176110        
 11     38.4229310              0.0039920        
 12     18.4687910              0.0730740        
 13      8.8681903              0.1111670        
 14      3.9188697             -0.0440510        
 15      1.8398525             -0.2324210        
 16      0.80466260            -0.2276380        
 17      0.16984630             0.3114210        
 18      0.07936990             0.5468970        
S   19
  1 5048010.4000000             0.0000240        
  2 755918.1000000             -0.0000130        
  3 172026.2500000             -0.0000120        
  4  48724.5720000             -0.0000740        
  5  15894.8920000             -0.0002370        
  6   5737.4685000             -0.0008530        
  7   2237.0513000             -0.0022550        
  8    927.0302000             -0.0066460        
  9    403.3461500             -0.0135760        
 10    182.4281600             -0.0300980        
 11     84.5891710             -0.0268830        
 12     38.4229310             -0.0085890        
 13     18.4687910              0.1758910        
 14      8.8681903              0.1596780        
 15      3.9188697              0.0250370        
 16      1.8398525             -0.9078600        
 17      0.80466260             0.2655870        
 18      0.16984630             1.6122490        
 19      0.07936990            -0.6112430        
S   19
  1 5048010.4000000            -0.0000330        
  2 755918.1000000              0.0002570        
  3 172026.2500000             -0.0001740        
  4  48724.5720000             -0.0000540        
  5  15894.8920000             -0.0005110        
  6   5737.4685000             -0.0014030        
  7   2237.0513000             -0.0043650        
  8    927.0302000             -0.0114870        
  9    403.3461500             -0.0254460        
 10    182.4281600             -0.0533040        
 11     84.5891710             -0.0517320        
 12     38.4229310             -0.0112730        
 13     18.4687910              0.3198380        
 14      8.8681903              0.3950850        
 15      3.9188697             -0.2547270        
 16      1.8398525             -2.1265650        
 17      0.80466260             2.5157580        
 18      0.16984630            -0.2125990        
 19      0.07936990            -1.7291540        
S   1
  1      0.03470020             1.0000000        
P   14
  1   9148.7958000              0.0001740        
  2   2167.1706000              0.0015270        
  3    703.3856600              0.0085220        
  4    268.1342300              0.0351420        
  5    113.0078100              0.1102710        
  6     50.9133950              0.2517370        
  7     23.8774020              0.3825020        
  8     11.4892370              0.3088820        
  9      5.4368839              0.0871670        
 10      2.5338366              0.0039480        
 11      1.1353088              0.0015980        
 12      0.46789110            -0.0002260        
 13      0.18720000             0.0002170        
 14      0.07490000            -0.0000900        
P   14
  1   9148.7958000             -0.0000620        
  2   2167.1706000             -0.0005460        
  3    703.3856600             -0.0030730        
  4    268.1342300             -0.0128270        
  5    113.0078100             -0.0416140        
  6     50.9133950             -0.0991340        
  7     23.8774020             -0.1613400        
  8     11.4892370             -0.1107930        
  9      5.4368839              0.1894650        
 10      2.5338366              0.4753500        
 11      1.1353088              0.4014970        
 12      0.46789110             0.1055720        
 13      0.18720000            -0.0003780        
 14      0.07490000             0.0027960        
P   14
  1   9148.7958000              0.0000300        
  2   2167.1706000              0.0002030        
  3    703.3856600              0.0013380        
  4    268.1342300              0.0051270        
  5    113.0078100              0.0173880        
  6     50.9133950              0.0409150        
  7     23.8774020              0.0680180        
  8     11.4892370              0.0477330        
  9      5.4368839             -0.1038460        
 10      2.5338366             -0.2716260        
 11      1.1353088             -0.1497540        
 12      0.46789110             0.3179060        
 13      0.18720000             0.6163390        
 14      0.07490000             0.2276480        
P   14
  1   9148.7958000             -0.0006630        
  2   2167.1706000              0.0007960        
  3    703.3856600              0.0017760        
  4    268.1342300              0.0108210        
  5    113.0078100              0.0290620        
  6     50.9133950              0.0769940        
  7     23.8774020              0.1227310        
  8     11.4892370              0.1048100        
  9      5.4368839             -0.2597590        
 10      2.5338366             -0.6896980        
 11      1.1353088              0.3688420        
 12      0.46789110             1.0654880        
 13      0.18720000            -0.5344810        
 14      0.07490000            -0.5011200        
P   14
  1   9148.7958000              0.0012770        
  2   2167.1706000             -0.0065500        
  3    703.3856600              0.0063860        
  4    268.1342300              0.0121480        
  5    113.0078100              0.0396830        
  6     50.9133950              0.1071850        
  7     23.8774020              0.1442300        
  8     11.4892370              0.2590020        
  9      5.4368839             -0.8723900        
 10      2.5338366             -0.5578110        
 11      1.1353088              2.0283200        
 12      0.46789110            -1.2357980        
 13      0.18720000            -0.4765670        
 14      0.07490000             0.8967940        
P   1
  1      0.02990000             1.0000000        
D   10
  1    258.8666600              0.0009460        
  2     77.4960410              0.0081190        
  3     29.5897180              0.0370440        
  4     12.5152750              0.1124360        
  5      5.62446750             0.2296360        
  6      2.55130290             0.3134900        
  7      1.12805970             0.3092810        
  8      0.475373000            0.2445290        
  9      0.182127800            0.1321490        
 10      0.072900000            0.0338880        
D   10
  1    258.8666600             -0.0009600        
  2     77.4960410             -0.0082760        
  3     29.5897180             -0.0380530        
  4     12.5152750             -0.1180440        
  5      5.62446750            -0.2418780        
  6      2.55130290            -0.2574680        
  7      1.12805970            -0.0353770        
  8      0.475373000            0.3306340        
  9      0.182127800            0.4644450        
 10      0.072900000            0.2449120        
D   10
  1    258.8666600             -0.0013470        
  2     77.4960410             -0.0119700        
  3     29.5897180             -0.0550130        
  4     12.5152750             -0.1780890        
  5      5.62446750            -0.3537820        
  6      2.55130290            -0.1546950        
  7      1.12805970             0.5064350        
  8      0.475373000            0.4480440        
  9      0.182127800           -0.3629430        
 10      0.072900000           -0.4751770        
D   10
  1    258.8666600              0.0020000        
  2     77.4960410              0.0167890        
  3     29.5897180              0.0774360        
  4     12.5152750              0.2825310        
  5      5.62446750             0.4798750        
  6      2.55130290            -0.5522080        
  7      1.12805970            -0.6441280        
  8      0.475373000            0.8320280        
  9      0.182127800            0.2247390        
 10      0.072900000           -0.6818500        
F   6
  1     19.7642000              0.0171120        
  2      7.90570000             0.0982030        
  3      3.16220000             0.3373790        
  4      1.26490000             0.4757970        
  5      0.506000000            0.3043240        
  6      0.202400000            0.0953710        
F   6
  1     19.7642000              0.0346430        
  2      7.90570000             0.2515000        
  3      3.16220000             0.5566410        
  4      1.26490000            -0.0328550        
  5      0.506000000           -0.5452100        
  6      0.202400000           -0.2765610        


name: NASA Ames cc-pCVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      2.7440000              1.0000000        
F   1
  1      0.9800000              1.0000000        
F   1
  1      0.3500000              1.0000000        
G   1
  1      0.6300000              1.0000000        


name: NASA Ames cc-pV5Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      3.6826500              1.0000000        
F   1
  1      1.2324800              1.0000000        
F   1
  1      0.4124770              1.0000000        
F   1
  1      0.1380440              1.0000000        
G   1
  1      2.5336800              1.0000000        
G   1
  1      0.8160000              1.0000000        
G   1
  1      0.2628020              1.0000000        
H   1
  1      1.8434270              1.0000000        
H   1
  1      0.4988980              1.0000000        
I   1
  1      0.7400000              1.0000000        


name: NASA Ames cc-pV5Z
description: V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   18
  1 4316265.3000000             0.0000090        
  2 646342.4200000              0.0000670        
  3 147089.7300000              0.0003540        
  4  41661.5220000              0.0014940        
  5  13590.7650000              0.0054110        
  6   4905.7500000              0.0173530        
  7   1912.7458000              0.0495400        
  8    792.6043400              0.1230340        
  9    344.8064800              0.2492910        
 10    155.8998900              0.3585690        
 11     72.2309080              0.2774790        
 12     32.7250650              0.0672010        
 13     15.6676220             -0.0011550        
 14      7.5034830              0.0019310        
 15      3.3122230             -0.0008930        
 16      1.5584710              0.0003850        
 17      0.6839140             -0.0001510        
 18      0.1467570              0.0000560        
S   18
  1 4316265.3000000            -0.0000030        
  2 646342.4200000             -0.0000200        
  3 147089.7300000             -0.0001080        
  4  41661.5220000             -0.0004540        
  5  13590.7650000             -0.0016500        
  6   4905.7500000             -0.0053420        
  7   1912.7458000             -0.0156190        
  8    792.6043400             -0.0408880        
  9    344.8064800             -0.0929070        
 10    155.8998900             -0.1689370        
 11     72.2309080             -0.1909910        
 12     32.7250650              0.0439680        
 13     15.6676220              0.5154530        
 14      7.5034830              0.5051630        
 15      3.3122230              0.0923750        
 16      1.5584710             -0.0024030        
 17      0.6839140              0.0022460        
 18      0.1467570             -0.0004940        
S   18
  1 4316265.3000000             0.0000010        
  2 646342.4200000              0.0000080        
  3 147089.7300000              0.0000400        
  4  41661.5220000              0.0001680        
  5  13590.7650000              0.0006110        
  6   4905.7500000              0.0019840        
  7   1912.7458000              0.0058060        
  8    792.6043400              0.0153280        
  9    344.8064800              0.0352100        
 10    155.8998900              0.0662250        
 11     72.2309080              0.0784520        
 12     32.7250650             -0.0187860        
 13     15.6676220             -0.3051870        
 14      7.5034830             -0.4593380        
 15      3.3122230              0.1270580        
 16      1.5584710              0.7292350        
 17      0.6839140              0.3992630        
 18      0.1467570              0.0164900        
S   17
  1 646342.4200000              0.0000020        
  2 147089.7300000              0.0000090        
  3  41661.5220000              0.0000360        
  4  13590.7650000              0.0001310        
  5   4905.7500000              0.0004250        
  6   1912.7458000              0.0012420        
  7    792.6043400              0.0032840        
  8    344.8064800              0.0075530        
  9    155.8998900              0.0142720        
 10     72.2309080              0.0169960        
 11     32.7250650             -0.0040380        
 12     15.6676220             -0.0696300        
 13      7.5034830             -0.1100960        
 14      3.3122230              0.0384720        
 15      1.5584710              0.2262400        
 16      0.6839140              0.2506610        
 17      0.1467570             -0.3198270        
S   1
  1      0.0705830              1.0000000        
S   1
  1      0.0314490              1.0000000        
P   9
  1   7721.4886000              0.0001760        
  2   1829.1258000              0.0015510        
  3    593.6279500              0.0086390        
  4    226.2053600              0.0354820        
  5     95.2614540              0.1108050        
  6     42.8592030              0.2515360        
  7     20.0497130              0.3816690        
  8      9.6208850              0.3099100        
  9      4.5413710              0.0878640        
P   9
  1   7721.4886000             -0.0000640        
  2   1829.1258000             -0.0005620        
  3    593.6279500             -0.0031560        
  4    226.2053600             -0.0131090        
  5     95.2614540             -0.0422830        
  6     42.8592030             -0.0998510        
  7     20.0497130             -0.1620460        
  8      9.6208850             -0.1149630        
  9      4.5413710              0.1817420        
P   1
  1      2.1135000              1.0000000        
P   1
  1      0.9472010              1.0000000        
P   1
  1      0.3912430              1.0000000        
P   1
  1      0.1564800              1.0000000        
P   1
  1      0.0625920              1.0000000        
P   1
  1      0.0250370              1.0000000        
D   5
  1    217.3688300              0.0009450        
  2     64.9997550              0.0080600        
  3     24.7731370              0.0365040        
  4     10.4361400              0.1110340        
  5      4.6796530              0.2325450        
D   1
  1      2.1256230              1.0000000        
D   1
  1      0.9452420              1.0000000        
D   1
  1      0.4026850              1.0000000        
D   1
  1      0.1566510              1.0000000        
D   1
  1      0.0626600              1.0000000        
F   1
  1      7.4759170              1.0000000        
F   1
  1      2.5690440              1.0000000        
F   1
  1      0.8828330              1.0000000        
F   1
  1      0.3033790              1.0000000        
G   1
  1      5.7133720              1.0000000        
G   1
  1      1.9070000              1.0000000        
G   1
  1      0.6365150              1.0000000        
H   1
  1      4.3197450              1.0000000        
H   1
  1      1.3190060              1.0000000        
I   1
  1      3.2100000              1.0000000        


name: NASA Ames cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      2.3450000              1.0000000        
F   1
  1      0.6700000              1.0000000        
F   1
  1      0.1914290              1.0000000        
G   1
  1      1.5354000              1.0000000        
G   1
  1      0.3911850              1.0000000        
H   1
  1      0.7500000              1.0000000        


name: NASA Ames cc-pVQZ
description: VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   18
  1 4316265.3000000             0.0000090        
  2 646342.4200000              0.0000670        
  3 147089.7300000              0.0003540        
  4  41661.5220000              0.0014940        
  5  13590.7650000              0.0054110        
  6   4905.7500000              0.0173530        
  7   1912.7458000              0.0495400        
  8    792.6043400              0.1230340        
  9    344.8064800              0.2492910        
 10    155.8998900              0.3585690        
 11     72.2309080              0.2774790        
 12     32.7250650              0.0672010        
 13     15.6676220             -0.0011550        
 14      7.5034830              0.0019310        
 15      3.3122230             -0.0008930        
 16      1.5584710              0.0003850        
 17      0.6839140             -0.0001510        
 18      0.1467570              0.0000560        
S   18
  1 4316265.3000000            -0.0000030        
  2 646342.4200000             -0.0000200        
  3 147089.7300000             -0.0001080        
  4  41661.5220000             -0.0004540        
  5  13590.7650000             -0.0016500        
  6   4905.7500000             -0.0053420        
  7   1912.7458000             -0.0156190        
  8    792.6043400             -0.0408880        
  9    344.8064800             -0.0929070        
 10    155.8998900             -0.1689370        
 11     72.2309080             -0.1909910        
 12     32.7250650              0.0439680        
 13     15.6676220              0.5154530        
 14      7.5034830              0.5051630        
 15      3.3122230              0.0923750        
 16      1.5584710             -0.0024030        
 17      0.6839140              0.0022460        
 18      0.1467570             -0.0004940        
S   18
  1 4316265.3000000             0.0000010        
  2 646342.4200000              0.0000080        
  3 147089.7300000              0.0000400        
  4  41661.5220000              0.0001680        
  5  13590.7650000              0.0006110        
  6   4905.7500000              0.0019840        
  7   1912.7458000              0.0058060        
  8    792.6043400              0.0153280        
  9    344.8064800              0.0352100        
 10    155.8998900              0.0662250        
 11     72.2309080              0.0784520        
 12     32.7250650             -0.0187860        
 13     15.6676220             -0.3051870        
 14      7.5034830             -0.4593380        
 15      3.3122230              0.1270580        
 16      1.5584710              0.7292350        
 17      0.6839140              0.3992630        
 18      0.1467570              0.0164900        
S   17
  1 646342.4200000              0.0000020        
  2 147089.7300000              0.0000090        
  3  41661.5220000              0.0000360        
  4  13590.7650000              0.0001310        
  5   4905.7500000              0.0004250        
  6   1912.7458000              0.0012420        
  7    792.6043400              0.0032840        
  8    344.8064800              0.0075530        
  9    155.8998900              0.0142720        
 10     72.2309080              0.0169960        
 11     32.7250650             -0.0040380        
 12     15.6676220             -0.0696300        
 13      7.5034830             -0.1100960        
 14      3.3122230              0.0384720        
 15      1.5584710              0.2262400        
 16      0.6839140              0.2506610        
 17      0.1467570             -0.3198270        
S   1
  1      0.0705830              1.0000000        
S   1
  1      0.0314490              1.0000000        
P   9
  1   7721.4886000              0.0001760        
  2   1829.1258000              0.0015510        
  3    593.6279500              0.0086390        
  4    226.2053600              0.0354820        
  5     95.2614540              0.1108050        
  6     42.8592030              0.2515360        
  7     20.0497130              0.3816690        
  8      9.6208850              0.3099100        
  9      4.5413710              0.0878640        
P   9
  1   7721.4886000             -0.0000640        
  2   1829.1258000             -0.0005620        
  3    593.6279500             -0.0031560        
  4    226.2053600             -0.0131090        
  5     95.2614540             -0.0422830        
  6     42.8592030             -0.0998510        
  7     20.0497130             -0.1620460        
  8      9.6208850             -0.1149630        
  9      4.5413710              0.1817420        
P   1
  1      2.1135000              1.0000000        
P   1
  1      0.9472010              1.0000000        
P   1
  1      0.3912430              1.0000000        
P   1
  1      0.1564800              1.0000000        
P   1
  1      0.0625920              1.0000000        
P   1
  1      0.0250370              1.0000000        
D   5
  1    217.3688300              0.0009450        
  2     64.9997550              0.0080600        
  3     24.7731370              0.0365040        
  4     10.4361400              0.1110340        
  5      4.6796530              0.2325450        
D   1
  1      2.1256230              1.0000000        
D   1
  1      0.9452420              1.0000000        
D   1
  1      0.4026850              1.0000000        
D   1
  1      0.1566510              1.0000000        
D   1
  1      0.0626600              1.0000000        
F   1
  1      5.1387770              1.0000000        
F   1
  1      1.5190000              1.0000000        
F   1
  1      0.4490100              1.0000000        
G   1
  1      3.7058090              1.0000000        
G   1
  1      1.0114110              1.0000000        
H   1
  1      2.4800000              1.0000000        


name: NASA Ames cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   17
  1 5309148.1000000             0.0000040        
  2 794951.6500000              0.0000340        
  3 180907.5600000              0.0001800        
  4  51241.9330000              0.0007590        
  5  16717.4490000              0.0027570        
  6   6035.2659000              0.0089250        
  7   2353.8571000              0.0260620        
  8    976.1464600              0.0681900        
  9    425.4356300              0.1543490        
 10    193.0467700              0.2802820        
 11     90.4393690              0.3484000        
 12     43.0207130              0.2217050        
 13     19.1905550              0.0400180        
 14      9.4257160             -0.0021380        
 15      4.6052430              0.0017220        
 16      2.0378340             -0.0008020        
 17      0.9800320              0.0003560        
S   17
  1 5309148.1000000            -0.0000010        
  2 794951.6500000             -0.0000100        
  3 180907.5600000             -0.0000530        
  4  51241.9330000             -0.0002240        
  5  16717.4490000             -0.0008180        
  6   6035.2659000             -0.0026590        
  7   2353.8571000             -0.0078790        
  8    976.1464600             -0.0212220        
  9    425.4356300             -0.0514220        
 10    193.0467700             -0.1067020        
 11     90.4393690             -0.1746860        
 12     43.0207130             -0.1560410        
 13     19.1905550              0.1293230        
 14      9.4257160              0.5384640        
 15      4.6052430              0.4357080        
 16      2.0378340              0.0681170        
 17      0.9800320             -0.0024360        
S   16
  1 794951.6500000              0.0000040        
  2 180907.5600000              0.0000180        
  3  51241.9330000              0.0000810        
  4  16717.4490000              0.0002890        
  5   6035.2659000              0.0009510        
  6   2353.8571000              0.0028120        
  7    976.1464600              0.0076020        
  8    425.4356300              0.0185920        
  9    193.0467700              0.0390850        
 10     90.4393690              0.0664980        
 11     43.0207130              0.0620460        
 12     19.1905550             -0.0562490        
 13      9.4257160             -0.3180890        
 14      4.6052430             -0.4058270        
 15      2.0378340              0.1704320        
 16      0.9800320              0.6975960        
S   1
  1      0.4456250              1.0000000        
S   1
  1      0.1064170              1.0000000        
S   1
  1      0.0525710              1.0000000        
S   1
  1      0.0243570              1.0000000        
P   10
  1   7999.8045000              0.0000880        
  2   1894.4515000              0.0007770        
  3    615.1874800              0.0044040        
  4    234.9274100              0.0186640        
  5     99.2137530              0.0620720        
  6     44.9161400              0.1590770        
  7     21.2497170              0.2969700        
  8     10.3304580              0.3688010        
  9      5.1049800              0.2348260        
 10      2.4406900              0.0493560        
P   10
  1   7999.8045000             -0.0000290        
  2   1894.4515000             -0.0002610        
  3    615.1874800             -0.0014820        
  4    234.9274100             -0.0063570        
  5     99.2137530             -0.0214770        
  6     44.9161400             -0.0571340        
  7     21.2497170             -0.1104660        
  8     10.3304580             -0.1481470        
  9      5.1049800             -0.0554260        
 10      2.4406900              0.2455620        
P   1
  1      1.1512050              1.0000000        
P   1
  1      0.5295560              1.0000000        
P   1
  1      0.2211900              1.0000000        
P   1
  1      0.0880000              1.0000000        
P   1
  1      0.0350000              1.0000000        
P   1
  1      0.0140000              1.0000000        
D   4
  1     89.5692010              0.0019660        
  2     26.5843560              0.0147190        
  3      9.7710320              0.0582080        
  4      3.9619330              0.1581680        
D   1
  1      1.6892690              1.0000000        
D   1
  1      0.7156710              1.0000000        
D   1
  1      0.2938110              1.0000000        
D   1
  1      0.1108310              1.0000000        
D   1
  1      0.0440000              1.0000000        
F   1
  1      1.2752200              1.0000000        
F   1
  1      0.2927500              1.0000000        
G   1
  1      0.6300000              1.0000000        


name: NASA Ames cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   18
  1 4316265.3000000             0.0000090        
  2 646342.4200000              0.0000670        
  3 147089.7300000              0.0003540        
  4  41661.5220000              0.0014940        
  5  13590.7650000              0.0054110        
  6   4905.7500000              0.0173530        
  7   1912.7458000              0.0495400        
  8    792.6043400              0.1230340        
  9    344.8064800              0.2492910        
 10    155.8998900              0.3585600        
 11     72.2309080              0.2774790        
 12     32.7250650              0.0672010        
 13     15.6676220             -0.0011550        
 14      7.5034830              0.0019310        
 15      3.3122230             -0.0008930        
 16      1.5584710              0.0003850        
 17      0.6839140             -0.0001510        
 18      0.1467570              0.0000560        
S   18
  1 4316265.3000000            -0.0000030        
  2 646342.4200000             -0.0000200        
  3 147089.7300000             -0.0001080        
  4  41661.5220000             -0.0004540        
  5  13590.7650000             -0.0016500        
  6   4905.7500000             -0.0053420        
  7   1912.7458000             -0.0156190        
  8    792.6043400             -0.0408880        
  9    344.8064800             -0.0929070        
 10    155.8998900             -0.1689370        
 11     72.2309080             -0.1909910        
 12     32.7250650              0.0439680        
 13     15.6676220              0.5154530        
 14      7.5034830              0.5051630        
 15      3.3122230              0.0923750        
 16      1.5584710             -0.0024030        
 17      0.6839140              0.0022460        
 18      0.1467570             -0.0004940        
S   18
  1 4316265.3000000             0.0000010        
  2 646342.4200000              0.0000080        
  3 147089.7300000              0.0000400        
  4  41661.5220000              0.0001680        
  5  13590.7650000              0.0006110        
  6   4905.7500000              0.0019840        
  7   1912.7458000              0.0058060        
  8    792.6043400              0.0153280        
  9    344.8064800              0.0352100        
 10    155.8998900              0.0662250        
 11     72.2309080              0.0784520        
 12     32.7250650             -0.0187860        
 13     15.6676220             -0.3051870        
 14      7.5034830             -0.4593380        
 15      3.3122230              0.1270580        
 16      1.5584710              0.7292350        
 17      0.6839140              0.3992630        
 18      0.1467570              0.0164900        
S   17
  1 646342.4200000              0.0000020        
  2 147089.7300000              0.0000090        
  3  41661.5220000              0.0000360        
  4  13590.7650000              0.0001310        
  5   4905.7500000              0.0004250        
  6   1912.7458000              0.0012420        
  7    792.6043400              0.0032840        
  8    344.8064800              0.0075530        
  9    155.8998900              0.0142720        
 10     72.2309080              0.0169960        
 11     32.7250650             -0.0040380        
 12     15.6676220             -0.0696300        
 13      7.5034830             -0.1100960        
 14      3.3122230              0.0384720        
 15      1.5584710              0.2262400        
 16      0.6839140              0.2506610        
 17      0.1467570             -0.3198270        
S   1
  1      0.0705830              1.0000000        
S   1
  1      0.0314490              1.0000000        
P   9
  1   7721.4886000              0.0001760        
  2   1829.1258000              0.0015510        
  3    593.6279500              0.0086390        
  4    226.2053600              0.0354820        
  5     95.2614540              0.1108050        
  6     42.8592030              0.2515360        
  7     20.0497130              0.3816690        
  8      9.6208850              0.3099100        
  9      4.5413710              0.0878640        
P   9
  1   7721.4886000             -0.0000640        
  2   1829.1258000             -0.0005620        
  3    593.6279500             -0.0031560        
  4    226.2053600             -0.0131090        
  5     95.2614540             -0.0422830        
  6     42.8592030             -0.0998510        
  7     20.0497130             -0.1620460        
  8      9.6208850             -0.1149630        
  9      4.5413710              0.1817420        
P   1
  1      2.1135000              1.0000000        
P   1
  1      0.9472010              1.0000000        
P   1
  1      0.3912430              1.0000000        
P   1
  1      0.1564800              1.0000000        
P   1
  1      0.0625920              1.0000000        
P   1
  1      0.0250370              1.0000000        
D   5
  1    217.3688300              0.0009450        
  2     64.9997550              0.0080600        
  3     24.7731370              0.0365040        
  4     10.4361400              0.1110340        
  5      4.6796530              0.2325450        
D   1
  1      2.1256230              1.0000000        
D   1
  1      0.9452420              1.0000000        
D   1
  1      0.4026850              1.0000000        
D   1
  1      0.1566510              1.0000000        
D   1
  1      0.0626600              1.0000000        
F   1
  1      3.2659530              1.0000000        
F   1
  1      0.7867870              1.0000000        
G   1
  1      2.2480000              1.0000000        


name: NLO-V
description: N/A
elt: H
data:
HYDROGEN
S   3
  1     13.01070100000          0.0175900        
  2      4.089700000000         0.0136300        
  3      1.962257200000         0.1066300        
S   3
  1      0.965800000000         0.0372100        
  2      0.444537960000         0.4552300        
  3      0.121949620000         0.5076800        
P   2
  1      2.616630000000         0.0023400        
  2      0.462800000000         0.5239200        


name: NLO-V
description: N/A
elt: B
data:
BORON
S   4
  1    839.3183008600           0.0056800        
  2    126.2646484300           0.0427700        
  3     28.62060076300          0.1811100        
  4     11.17200000000          0.0430600        
S   3
  1      7.879372271000         0.4034300        
  2      2.617600000000         0.4344400        
  3      2.408885717200         0.0004900        
S   3
  1      0.588240000000         0.0624300        
  2      0.251051090360         0.6498700        
  3      0.083648866069         0.3870500        
P   4
  1     34.10060000000          0.0023900        
  2      8.312000000000         0.0244500        
  3      6.033222361900         0.0269700        
  4      3.859000000000         0.0550900        
P   4
  1      1.249915786600         0.1191400        
  2      0.898600000000         0.0791100        
  3      0.338716763500         0.4843500        
  4      0.096415632351         0.8329900        
D   2
  1      1.013920000000         0.0072900        
  2      0.253290000000         0.0435300        


name: NLO-V
description: N/A
elt: C
data:
CARBON
S   4
  1   1238.401693800            0.0012100        
  2    186.2900499200           0.0090900        
  3     42.25117634600          0.0423900        
  4     11.67655793200          0.1268100        
S   3
  1      3.623200000000         0.5093300        
  2      3.593050648200         0.3131700        
  3      0.987470000000         0.1062900        
S   3
  1      0.402451473630         0.4967600        
  2      0.305400000000         0.1332900        
  3      0.130901826680         0.3943700        
P   4
  1      9.468097062100         0.0379000        
  2      2.010354514200         0.1917400        
  3      0.783900000000         0.1066100        
  4      0.547710047070         0.3137800        
P   4
  1      0.197330000000         0.5806300        
  2      0.152686137950         0.3063800        
  3      0.101660000000         0.2935100        
  4      0.043029300000         0.0405300        
D   2
  1      2.486000000000         0.0022600        
  2      0.164120000000         0.0099700        


name: NLO-V
description: N/A
elt: N
data:
NITROGEN
S   4
  1   1712.841585300            0.0055400        
  2    257.6481267700           0.0409900        
  3     58.45824585300          0.1840000        
  4     16.19836790500          0.4573900        
S   3
  1      5.035732000000         0.4793200        
  2      5.005260080900         0.3738400        
  3      4.775700000000         0.4381800        
S   3
  1      1.475900000000         0.0604000        
  2      0.587318565710         0.0106400        
  3      0.187645922530         0.0028700        
P   4
  1     13.57147023300          0.0411200        
  2      2.925737287400         0.2064600        
  3      1.149209000000         0.1125900        
  4      0.799277507540         0.3379600        
P   4
  1      0.281150000000         0.6387600        
  2      0.219543480340         0.3901400        
  3      0.148770000000         0.2817400        
  4      0.059277000000         0.0196600        
D   2
  1      8.522000000000         0.0007400        
  2      2.803000000000         0.0055000        


name: NLO-V
description: N/A
elt: O
data:
OXYGEN
S   4
  1   2266.176778500            0.0054900        
  2    340.8701019100           0.0406100        
  3     77.36313516700          0.1831900        
  4     21.47964494000          0.4563200        
S   3
  1      6.658943312400         0.7555400        
  2      6.115900000000         0.3479700        
  3      2.074130000000         0.0766200        
S   3
  1      0.809759756680         0.0502800        
  2      0.608900000000         0.0380700        
  3      0.255307722340         0.0033100        
P   4
  1     81.60080000000          0.0044600        
  2     17.72150431700          0.0265600        
  3      8.721800000000         0.0429700        
  4      3.863550544000         0.1375200        
P   4
  1      3.588800000000         0.3463800        
  2      1.048092088300         0.4872200        
  3      0.276415444110         0.4524800        
  4      0.067065000000         0.0487700        
D   2
  1      7.198000000000         0.0013300        
  2      0.282200000000         0.0085500        


name: NLO-V
description: N/A
elt: F
data:
FLUORINE
S   4
  1   2894.832599000            0.0054400        
  2    435.4193912000           0.0403200        
  3     98.84332886600          0.1823600        
  4     27.48519800100          0.4556200        
S   3
  1      8.540549817100         0.6750300        
  2      7.606400000000         0.0631800        
  3      2.757004000000         0.0987900        
S   3
  1      1.065457803800         0.4677200        
  2      0.816992000000         0.1681100        
  3      0.332473467480         0.4054000        
P   4
  1     22.69663392400          0.0415600        
  2      8.546200000000         0.0277700        
  3      4.987233925700         0.1882700        
  4      1.960299000000         0.1528700        
P   4
  1      1.349161395400         0.3407400        
  2      0.475750000000         0.2881400        
  3      0.348298819770         0.1703900        
  4      0.079310000000         0.0527200        
D   2
  1      5.275600000000         0.0019200        
  2      1.258140000000         0.0098600        


name: NLO-V
description: N/A
elt: Si
data:
SILICON
S   6
  1   6903.711868600            0.0055600        
  2   1038.434641900            0.0423700        
  3    235.8758148000           0.1807600        
  4     66.06938516900          0.3361200        
  5     59.10000040000          0.7510000        
  6     34.35348173000          0.3816400        
S   3
  1     20.24794576100          0.1569200        
  2     19.75041540000          0.0154000        
  3      9.009500000000         0.1157800        
S   3
  1      5.275000000000         0.1454500        
  2      3.637078819200         0.5542600        
  3      1.400204859900         0.5385100        
S   2
  1      0.204844148050         0.7923400        
  2      0.077994095468         0.3437900        
P   5
  1    179.8390737300           0.0102200        
  2     41.90725884600          0.0681900        
  3     15.01200000000          0.0874800        
  4     12.95529436700          0.1346500        
  5      5.812000000000         0.1916500        
P   4
  1      4.438326739300         0.2518100        
  2      1.687000000000         0.5651000        
  3      1.546224790400         0.8767600        
  4      0.813920000000         0.1747700        
P   3
  1      0.356076123020         0.4031500        
  2      0.295403000000         0.0557800        
  3      0.100085137620         0.7083400        
D   2
  1      1.890000000000         0.0001200        
  2      0.095830000000         0.0154200        


name: NLO-V
description: N/A
elt: P
data:
PHOSPHOROUS
S   6
  1   8002.479510600            0.0055000        
  2   1203.681359000            0.0419500        
  3    273.4422703100           0.1793300        
  4     76.65554151700          0.0693100        
  5     69.99900000000          0.8197700        
  6     39.79168343900          0.0531400        
S   3
  1     38.52639900000          0.3148400        
  2     23.51692743500          0.1605500        
  3     10.69997000000          0.1167500        
S   3
  1      5.818000000000         0.1754400        
  2      4.277034332300         0.3867500        
  3      1.694025688800         0.2751600        
S   2
  1      0.275676746440         0.7972800        
  2      0.104955900990         0.3536400        
P   5
  1    219.5075582300           0.0095100        
  2     51.27415503000          0.0670200        
  3     15.92159589200          0.2488200        
  4      5.506991348100         0.4670300        
  5      1.989900000000         0.7966700        
P   4
  1      1.953771942600         0.7771200        
  2      0.625200000000         0.1311500        
  3      0.478033979320         0.1165300        
  4      0.259420000000         0.3957100        
P   3
  1      0.136579526210         0.2832400        
  2      0.076630000000         0.1716500        
  3      0.037503000000         0.0283200        
D   2
  1      0.986950000000         0.0071000        
  2      0.256409000000         0.0335700        


name: NLO-V
description: N/A
elt: S
data:
SULFUR
S   6
  1   9184.930301000            0.0054500        
  2   1381.510550300            0.0415100        
  3    313.8714758000           0.1788200        
  4     89.52000100000          0.3295200        
  5     88.05387062300          0.3524100        
  6     83.44800000000          0.7282800        
S   3
  1     45.64873130300          0.2374300        
  2     27.03991490500          0.2867100        
  3      6.488000000000         0.1576100        
S   3
  1      4.966452232600         0.5390300        
  2      2.011624204700         0.3372200        
  3      0.507419900000         0.1956800        
S   2
  1      0.356610770130         0.5733200        
  2      0.135072214770         0.4258900        
P   5
  1    261.9823343900           0.0090600        
  2     61.30689473600          0.0644800        
  3     19.10372988700          0.2426500        
  4      6.656772037800         0.4641700        
  5      2.395963516100         1.9630600        
P   4
  1      2.364920000000         1.5972900        
  2      0.814400000000         0.1245900        
  3      0.617761616790         0.1719300        
  4      0.325180000000         0.3540900        
P   3
  1      0.169933768710         0.3238200        
  2      0.080394000000         0.1702000        
  3      0.041696000000         0.0159300        
D   2
  1      2.920600000000         0.0015900        
  2      0.124270000000         0.0106600        


name: NLO-V
description: N/A
elt: Cl
data:
CHLORINE
S   6
  1  10449.82756600             0.0054000        
  2   1571.736522100            0.0412700        
  3    357.1206552300           0.1766500        
  4    100.2518593500           0.8717300        
  5     97.58000000000          0.7513100        
  6     51.92378943400          0.3085100        
S   3
  1     30.81272755400          0.2218300        
  2     10.54800000000          0.1878600        
  3      7.304000000000         0.2275600        
S   3
  1      5.704576097500         0.7094300        
  2      2.350837680900         0.4713200        
  3      1.059000000000         0.0412900        
S   2
  1      0.446051246720         0.7169300        
  2      0.168488561900         0.4144600        
P   5
  1    307.6679056900           0.0088000        
  2     72.10201551500          0.0631600        
  3     22.53268026200          0.2406500        
  4      7.899176544400         0.4673100        
  5      2.876726832100         0.4970100        
P   4
  1      2.379910000000         0.1474300        
  2      1.064900000000         0.1280600        
  3      0.774593639550         0.2962400        
  4      0.404530000000         0.3183400        
P   3
  1      0.210376996980         0.3884300        
  2      0.067470000000         0.1550200        
  3      0.047460500000         0.0571100        
D   2
  1      0.560800000000         0.1509500        
  2      0.149060000000         0.7820100        


name: O-ANOL
description: N/A
elt: O
data:
OXYGEN
S   12
  1  36120.6397268736           0.0000474630     
  2   5413.8412505244           0.0003661616     
  3   1232.1914276079           0.0019422902     
  4    348.9112588503           0.0080182609     
  5    113.6888260778           0.0292150858     
  6     40.8253120574           0.0837812315     
  7     15.6997591621           0.2381515912     
  8      6.3470520684           0.3052735764     
  9      2.5233160573          -2.2760472586     
 10      0.9933408224           2.8444209743     
 11      0.3816471925          -0.7734121113     
 12      0.1409903227          -0.8478688061     
S   11
  1  36120.6397268736          -0.0000575715     
  2   5413.8412505244          -0.0004561854     
  3   1232.1914276079          -0.0023226972     
  4    348.9112588503          -0.0100655581     
  5    113.6888260778          -0.0336863732     
  6     40.8253120574          -0.1039505395     
  7     15.6997591621          -0.2389001460     
  8      6.3470520684          -0.4136661737     
  9      2.5233160573           1.7737045696     
 10      0.9933408224          -0.6098116431     
 11      0.3816471925          -0.8906113709     
S   10
  1  36120.6397268736          -0.0000701523     
  2   5413.8412505244          -0.0005506875     
  3   1232.1914276079          -0.0028351355     
  4    348.9112588503          -0.0119995156     
  5    113.6888260778          -0.0401411313     
  6     40.8253120574          -0.1166020454     
  7     15.6997591621          -0.2441901310     
  8      6.3470520684          -0.3732753416     
  9      2.5233160573           0.6722943628     
 10      0.9933408224           0.6301932484     
S   9
  1  36120.6397268736           0.0001742035     
  2   5413.8412505244           0.0013510423     
  3   1232.1914276079           0.0070366117     
  4    348.9112588503           0.0287238761     
  5    113.6888260778           0.0946993816     
  6     40.8253120574           0.2399638196     
  7     15.6997591621           0.4062009411     
  8      6.3470520684           0.3181341885     
  9      2.5233160573           0.0587438913     
P   8
  1    113.6888260778          -0.0018537723     
  2     40.8253120574          -0.0174425365     
  3     15.6997591621          -0.0335689679     
  4      6.3470520684          -0.3148417412     
  5      2.5233160573          -0.1703705582     
  6      0.9933408224           1.1319732046     
  7      0.3816471925          -0.6896145271     
  8      0.1409903227          -0.6523051627     
P   7
  1    113.6888260778          -0.0029954601     
  2     40.8253120574          -0.0194669060     
  3     15.6997591621          -0.0517481422     
  4      6.3470520684          -0.3418109311     
  5      2.5233160573          -0.4501567325     
  6      0.9933408224           0.9264933039     
  7      0.3816471925           0.3311766962     
P   6
  1    113.6888260778           0.0043308722     
  2     40.8253120574           0.0196938443     
  3     15.6997591621           0.0691943918     
  4      6.3470520684           0.3032807924     
  5      2.5233160573           0.6317200996     
  6      0.9933408224           0.0969371613     
D   4
  1      6.3470520684          -0.1409351508     
  2      2.5233160573          -0.6418873358     
  3      0.9933408224           0.4437639625     
  4      0.3816471925           0.7008478169     
D   3
  1      6.3470520684           0.1077344220     
  2      2.5233160573           0.5762714245     
  3      0.9933408224           0.4398161342     
F   2
  1      2.5233160573           0.4898974717     
  2      0.9933408224           0.6182348455     


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: H
data:
HYDROGEN
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: He
data:
HELIUM
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Li
data:
LITHIUM
D   1
  1      0.4000000              1.0000000        
D   1
  1      0.1000000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Be
data:
BERYLLIUM
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1275000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: B
data:
BORON
D   1
  1      0.8020000              1.0000000        
D   1
  1      0.2005000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: C
data:
CARBON
D   1
  1      1.2520000              1.0000000        
D   1
  1      0.3130000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: N
data:
NITROGEN
D   1
  1      1.8260000              1.0000000        
D   1
  1      0.4565000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: O
data:
OXYGEN
D   1
  1      2.5840000              1.0000000        
D   1
  1      0.6460000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: F
data:
FLUORINE
D   1
  1      3.5000000              1.0000000        
D   1
  1      0.8750000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Ne
data:
NEON
D   1
  1      4.6080000              1.0000000        
D   1
  1      1.1520000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Na
data:
SODIUM
D   1
  1      0.3500000              1.0000000        
D   1
  1      0.0875000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Mg
data:
MAGNESIUM
D   1
  1      0.3500000              1.0000000        
D   1
  1      0.0875000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Al
data:
ALUMINUM
D   1
  1      0.6500000              1.0000000        
D   1
  1      0.1625000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Si
data:
SILICON
D   1
  1      0.9000000              1.0000000        
D   1
  1      0.2250000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: P
data:
PHOSPHOROUS
D   1
  1      1.1000000              1.0000000        
D   1
  1      0.2750000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: S
data:
SULFUR
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.3250000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Cl
data:
CHLORINE
D   1
  1      1.5000000              1.0000000        
D   1
  1      0.3750000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Ar
data:
ARGON
D   1
  1      1.7000000              1.0000000        
D   1
  1      0.4250000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: K
data:
POTASSIUM
D   1
  1      0.4580000              1.0000000        
D   1
  1      0.1145000              1.0000000        


name: Pople (2d,2p) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Ca
data:
CALCIUM
D   1
  1      0.5200000              1.0000000        
D   1
  1      0.1300000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: H
data:
HYDROGEN
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        
D   1
  1      1.0000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: He
data:
HELIUM
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        
D   1
  1      2.0000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Li
data:
LITHIUM
D   1
  1      0.4000000              1.0000000        
D   1
  1      0.1000000              1.0000000        
F   1
  1      0.1500000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Be
data:
BERYLLIUM
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1275000              1.0000000        
F   1
  1      0.2600000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: B
data:
BORON
D   1
  1      0.8020000              1.0000000        
D   1
  1      0.2005000              1.0000000        
F   1
  1      0.5000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: C
data:
CARBON
D   1
  1      1.2520000              1.0000000        
D   1
  1      0.3130000              1.0000000        
F   1
  1      0.8000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: N
data:
NITROGEN
D   1
  1      1.8260000              1.0000000        
D   1
  1      0.4565000              1.0000000        
F   1
  1      1.0000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: O
data:
OXYGEN
D   1
  1      2.5840000              1.0000000        
D   1
  1      0.6460000              1.0000000        
F   1
  1      1.4000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: F
data:
FLUORINE
D   1
  1      3.5000000              1.0000000        
D   1
  1      0.8750000              1.0000000        
F   1
  1      1.8500000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Ne
data:
NEON
D   1
  1      4.6080000              1.0000000        
D   1
  1      1.1520000              1.0000000        
F   1
  1      2.5000000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: K
data:
POTASSIUM
D   1
  1      0.4580000              1.0000000        
D   1
  1      0.1145000              1.0000000        
F   1
  1      1.1100000              1.0000000        


name: Pople (2df,2pd) Polarization
description: 2P Polarization functions associated with 6-311G
elt: Ca
data:
CALCIUM
D   1
  1      0.5200000              1.0000000        
D   1
  1      0.1300000              1.0000000        
F   1
  1      1.3300000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: H
data:
HYDROGEN
P   1
  1      3.0000000              1.0000000        
P   1
  1      0.7500000              1.0000000        
P   1
  1      0.1875000              1.0000000        
D   1
  1      1.0000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: He
data:
HELIUM
P   1
  1      3.0000000              1.0000000        
P   1
  1      0.7500000              1.0000000        
P   1
  1      0.1875000              1.0000000        
D   1
  1      2.0000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Li
data:
LITHIUM
D   1
  1      0.8000000              1.0000000        
D   1
  1      0.2000000              1.0000000        
D   1
  1      0.0500000              1.0000000        
F   1
  1      0.1500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Be
data:
BERYLLIUM
D   1
  1      1.0200000              1.0000000        
D   1
  1      0.2550000              1.0000000        
D   1
  1      0.0637500              1.0000000        
F   1
  1      0.2600000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: B
data:
BORON
D   1
  1      1.6040000              1.0000000        
D   1
  1      0.4010000              1.0000000        
D   1
  1      0.1002500              1.0000000        
F   1
  1      0.5000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: C
data:
CARBON
D   1
  1      2.5040000              1.0000000        
D   1
  1      0.6260000              1.0000000        
D   1
  1      0.1565000              1.0000000        
F   1
  1      0.8000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: N
data:
NITROGEN
D   1
  1      3.6520000              1.0000000        
D   1
  1      0.9130000              1.0000000        
D   1
  1      0.2282500              1.0000000        
F   1
  1      1.0000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: O
data:
OXYGEN
D   1
  1      5.1600000              1.0000000        
D   1
  1      1.2920000              1.0000000        
D   1
  1      0.3225000              1.0000000        
F   1
  1      1.4000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: F
data:
FLUORINE
D   1
  1      7.0000000              1.0000000        
D   1
  1      1.7500000              1.0000000        
D   1
  1      0.4375000              1.0000000        
F   1
  1      1.8500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Ne
data:
NEON
D   1
  1      9.2160000              1.0000000        
D   1
  1      2.3040000              1.0000000        
D   1
  1      0.5760000              1.0000000        
F   1
  1      2.5000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Na
data:
SODIUM
D   1
  1      0.7000000              1.0000000        
D   1
  1      0.1750000              1.0000000        
D   1
  1      0.0437500              1.0000000        
F   1
  1      0.1500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Mg
data:
MAGNESIUM
D   1
  1      0.7000000              1.0000000        
D   1
  1      0.1750000              1.0000000        
D   1
  1      0.0437500              1.0000000        
F   1
  1      0.2000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Al
data:
ALUMINUM
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.3250000              1.0000000        
D   1
  1      0.0812500              1.0000000        
F   1
  1      0.2500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Si
data:
SILICON
D   1
  1      1.8000000              1.0000000        
D   1
  1      0.4500000              1.0000000        
D   1
  1      0.1125000              1.0000000        
F   1
  1      0.3200000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: P
data:
PHOSPHOROUS
D   1
  1      2.2000000              1.0000000        
D   1
  1      0.5500000              1.0000000        
D   1
  1      0.1375000              1.0000000        
F   1
  1      0.4500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: S
data:
SULFUR
D   1
  1      2.6000000              1.0000000        
D   1
  1      0.6500000              1.0000000        
D   1
  1      0.1625000              1.0000000        
F   1
  1      0.5500000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Cl
data:
CHLORINE
D   1
  1      3.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000        
D   1
  1      0.1875000              1.0000000        
F   1
  1      0.7000000              1.0000000        


name: Pople (3df,3pd) Polarization
description: 3P Polarization functions associated with 6-31G and 6-311G
elt: Ar
data:
ARGON
D   1
  1      3.4000000              1.0000000        
D   1
  1      0.8500000              1.0000000        
D   1
  1      0.2125000              1.0000000        
F   1
  1      0.8500000              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Sc
data:
SCANDIUM
S   1
  1 14228140.0000000            1.0000000        
S   1
  1 2129471.0000000             1.0000000        
S   1
  1 484447.9000000              1.0000000        
S   1
  1 137186.9000000              1.0000000        
S   1
  1  44749.8500000              1.0000000        
S   1
  1  16154.4900000              1.0000000        
S   1
  1   6300.9270000              1.0000000        
S   1
  1   2613.8920000              1.0000000        
S   1
  1   1140.6110000              1.0000000        
S   1
  1    519.1924000              1.0000000        
S   1
  1    244.8586000              1.0000000        
S   1
  1    119.0198000              1.0000000        
S   1
  1     59.3018400              1.0000000        
S   1
  1     29.8943600              1.0000000        
S   1
  1     14.1487700              1.0000000        
S   1
  1      7.1230790              1.0000000        
S   1
  1      3.6024530              1.0000000        
S   1
  1      1.6481300              1.0000000        
S   1
  1      0.8014280              1.0000000        
S   1
  1      0.3761780              1.0000000        
S   1
  1      0.0977590              1.0000000        
S   1
  1      0.0477060              1.0000000        
S   1
  1      0.0222420              1.0000000        
P   1
  1  15494.1000000              1.0000000        
P   1
  1   3666.6120000              1.0000000        
P   1
  1   1190.9240000              1.0000000        
P   1
  1    455.9083000              1.0000000        
P   1
  1    193.6241000              1.0000000        
P   1
  1     88.3229900              1.0000000        
P   1
  1     42.4671900              1.0000000        
P   1
  1     21.1481200              1.0000000        
P   1
  1     10.7603000              1.0000000        
P   1
  1      5.5703580              1.0000000        
P   1
  1      2.8766040              1.0000000        
P   1
  1      1.4537960              1.0000000        
P   1
  1      0.7190290              1.0000000        
P   1
  1      0.3460740              1.0000000        
P   1
  1      0.1419070              1.0000000        
D   1
  1    232.9690000              1.0000000        
D   1
  1     69.7482300              1.0000000        
D   1
  1     26.9284400              1.0000000        
D   1
  1     11.6380500              1.0000000        
D   1
  1      5.3198170              1.0000000        
D   1
  1      2.5503140              1.0000000        
D   1
  1      1.2418130              1.0000000        
D   1
  1      0.6006520              1.0000000        
D   1
  1      0.2861940              1.0000000        
D   1
  1      0.1319550              1.0000000        
D   1
  1      0.0572870              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Ti
data:
TITANIUM
S   1
  1 15688460.0000000            1.0000000        
S   1
  1 2348898.0000000             1.0000000        
S   1
  1 534521.8000000              1.0000000        
S   1
  1 151404.7000000              1.0000000        
S   1
  1  49398.7500000              1.0000000        
S   1
  1  17836.3900000              1.0000000        
S   1
  1   6958.2960000              1.0000000        
S   1
  1   2887.1390000              1.0000000        
S   1
  1   1260.0750000              1.0000000        
S   1
  1    573.6763000              1.0000000        
S   1
  1    270.6123000              1.0000000        
S   1
  1    131.5738000              1.0000000        
S   1
  1     65.5831100              1.0000000        
S   1
  1     33.0887500              1.0000000        
S   1
  1     15.6988800              1.0000000        
S   1
  1      7.9331840              1.0000000        
S   1
  1      4.0251500              1.0000000        
S   1
  1      1.8541480              1.0000000        
S   1
  1      0.9007890              1.0000000        
S   1
  1      0.4218080              1.0000000        
S   1
  1      0.1085430              1.0000000        
S   1
  1      0.0520430              1.0000000        
S   1
  1      0.0239520              1.0000000        
P   1
  1  17401.2000000              1.0000000        
P   1
  1   4118.6290000              1.0000000        
P   1
  1   1337.9480000              1.0000000        
P   1
  1    512.2883000              1.0000000        
P   1
  1    217.6497000              1.0000000        
P   1
  1     99.3449300              1.0000000        
P   1
  1     47.8083000              1.0000000        
P   1
  1     23.8407100              1.0000000        
P   1
  1     12.1557200              1.0000000        
P   1
  1      6.3079780              1.0000000        
P   1
  1      3.2660550              1.0000000        
P   1
  1      1.6553820              1.0000000        
P   1
  1      0.8203180              1.0000000        
P   1
  1      0.3949300              1.0000000        
P   1
  1      0.1625260              1.0000000        
D   1
  1    292.1649000              1.0000000        
D   1
  1     87.4401800              1.0000000        
D   1
  1     33.7444400              1.0000000        
D   1
  1     14.6443400              1.0000000        
D   1
  1      6.7292290              1.0000000        
D   1
  1      3.2411920              1.0000000        
D   1
  1      1.5897870              1.0000000        
D   1
  1      0.7750830              1.0000000        
D   1
  1      0.3719630              1.0000000        
D   1
  1      0.1724550              1.0000000        
D   1
  1      0.0746870              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: V
data:
VANADIUM
S   1
  1 17242380.0000000            1.0000000        
S   1
  1 2581538.0000000             1.0000000        
S   1
  1 587483.2000000              1.0000000        
S   1
  1 166412.7000000              1.0000000        
S   1
  1  54297.2000000              1.0000000        
S   1
  1  19605.5700000              1.0000000        
S   1
  1   7648.6050000              1.0000000        
S   1
  1   3173.5880000              1.0000000        
S   1
  1   1385.1060000              1.0000000        
S   1
  1    630.6174000              1.0000000        
S   1
  1    297.4967000              1.0000000        
S   1
  1    144.6682000              1.0000000        
S   1
  1     72.1311500              1.0000000        
S   1
  1     36.4185600              1.0000000        
S   1
  1     17.3129200              1.0000000        
S   1
  1      8.7753250              1.0000000        
S   1
  1      4.4631810              1.0000000        
S   1
  1      2.0656460              1.0000000        
S   1
  1      1.0019660              1.0000000        
S   1
  1      0.4679380              1.0000000        
S   1
  1      0.1188030              1.0000000        
S   1
  1      0.0561220              1.0000000        
S   1
  1      0.0255500              1.0000000        
P   1
  1  19450.8800000              1.0000000        
P   1
  1   4603.3660000              1.0000000        
P   1
  1   1495.3130000              1.0000000        
P   1
  1    572.5294000              1.0000000        
P   1
  1    243.2758000              1.0000000        
P   1
  1    111.0804000              1.0000000        
P   1
  1     53.4865800              1.0000000        
P   1
  1     26.7007400              1.0000000        
P   1
  1     13.6375900              1.0000000        
P   1
  1      7.0910430              1.0000000        
P   1
  1      3.6792360              1.0000000        
P   1
  1      1.8687360              1.0000000        
P   1
  1      0.9271050              1.0000000        
P   1
  1      0.4463160              1.0000000        
P   1
  1      0.1843720              1.0000000        
D   1
  1    332.1785000              1.0000000        
D   1
  1     99.6685400              1.0000000        
D   1
  1     38.5666700              1.0000000        
D   1
  1     16.8067800              1.0000000        
D   1
  1      7.7667940              1.0000000        
D   1
  1      3.7601230              1.0000000        
D   1
  1      1.8530900              1.0000000        
D   1
  1      0.9072600              1.0000000        
D   1
  1      0.4365920              1.0000000        
D   1
  1      0.2026990              1.0000000        
D   1
  1      0.0875540              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Cr
data:
CHROMIUM
S   1
  1 18273400.0000000            1.0000000        
S   1
  1 2736169.0000000             1.0000000        
S   1
  1 622721.5000000              1.0000000        
S   1
  1 176403.1000000              1.0000000        
S   1
  1  57557.1200000              1.0000000        
S   1
  1  20782.0500000              1.0000000        
S   1
  1   8107.2140000              1.0000000        
S   1
  1   3363.6970000              1.0000000        
S   1
  1   1467.9890000              1.0000000        
S   1
  1    668.3000000              1.0000000        
S   1
  1    315.2450000              1.0000000        
S   1
  1    153.2895000              1.0000000        
S   1
  1     76.4313000              1.0000000        
S   1
  1     38.6244500              1.0000000        
S   1
  1     18.4522900              1.0000000        
S   1
  1      9.3682850              1.0000000        
S   1
  1      4.7709900              1.0000000        
S   1
  1      2.1955980              1.0000000        
S   1
  1      1.0522080              1.0000000        
S   1
  1      0.4815670              1.0000000        
S   1
  1      0.1174470              1.0000000        
S   1
  1      0.0559040              1.0000000        
S   1
  1      0.0252330              1.0000000        
P   1
  1  21337.7900000              1.0000000        
P   1
  1   5049.4980000              1.0000000        
P   1
  1   1640.1310000              1.0000000        
P   1
  1    627.9602000              1.0000000        
P   1
  1    266.8501000              1.0000000        
P   1
  1    121.8754000              1.0000000        
P   1
  1     58.7085600              1.0000000        
P   1
  1     29.3272500              1.0000000        
P   1
  1     14.9964900              1.0000000        
P   1
  1      7.8050300              1.0000000        
P   1
  1      4.0493280              1.0000000        
P   1
  1      2.0563890              1.0000000        
P   1
  1      1.0157240              1.0000000        
P   1
  1      0.4844630              1.0000000        
P   1
  1      0.2035720              1.0000000        
D   1
  1    317.6249000              1.0000000        
D   1
  1     95.2146500              1.0000000        
D   1
  1     36.7953200              1.0000000        
D   1
  1     15.9388600              1.0000000        
D   1
  1      7.3309550              1.0000000        
D   1
  1      3.5220990              1.0000000        
D   1
  1      1.7073720              1.0000000        
D   1
  1      0.8147770              1.0000000        
D   1
  1      0.3775320              1.0000000        
D   1
  1      0.1678180              1.0000000        
D   1
  1      0.0699560              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Mn
data:
MANGANESE
S   1
  1 20492660.0000000            1.0000000        
S   1
  1 3068183.0000000             1.0000000        
S   1
  1 698235.9000000              1.0000000        
S   1
  1 197786.6000000              1.0000000        
S   1
  1  64534.0200000              1.0000000        
S   1
  1  23301.7500000              1.0000000        
S   1
  1   9090.4910000              1.0000000        
S   1
  1   3771.8210000              1.0000000        
S   1
  1   1646.1930000              1.0000000        
S   1
  1    749.5010000              1.0000000        
S   1
  1    353.6151000              1.0000000        
S   1
  1    171.9954000              1.0000000        
S   1
  1     85.7953800              1.0000000        
S   1
  1     43.3735600              1.0000000        
S   1
  1     20.7009100              1.0000000        
S   1
  1     10.5415200              1.0000000        
S   1
  1      5.3797600              1.0000000        
S   1
  1      2.5043880              1.0000000        
S   1
  1      1.2099100              1.0000000        
S   1
  1      0.5619180              1.0000000        
S   1
  1      0.1379240              1.0000000        
S   1
  1      0.0635630              1.0000000        
S   1
  1      0.0284360              1.0000000        
P   1
  1  23784.7300000              1.0000000        
P   1
  1   5628.8020000              1.0000000        
P   1
  1   1828.3740000              1.0000000        
P   1
  1    700.0849000              1.0000000        
P   1
  1    297.5632000              1.0000000        
P   1
  1    135.9586000              1.0000000        
P   1
  1     65.5339200              1.0000000        
P   1
  1     32.7745200              1.0000000        
P   1
  1     16.7886700              1.0000000        
P   1
  1      8.7569260              1.0000000        
P   1
  1      4.5572080              1.0000000        
P   1
  1      2.3211360              1.0000000        
P   1
  1      1.1528680              1.0000000        
P   1
  1      0.5547620              1.0000000        
P   1
  1      0.2309120              1.0000000        
D   1
  1    424.6654000              1.0000000        
D   1
  1    127.6252000              1.0000000        
D   1
  1     49.4635600              1.0000000        
D   1
  1     21.6417400              1.0000000        
D   1
  1     10.0647600              1.0000000        
D   1
  1      4.8989800              1.0000000        
D   1
  1      2.4252420              1.0000000        
D   1
  1      1.1910260              1.0000000        
D   1
  1      0.5733020              1.0000000        
D   1
  1      0.2656280              1.0000000        
D   1
  1      0.1138010              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Fe
data:
IRON
S   1
  1 22219490.0000000            1.0000000        
S   1
  1 3328111.0000000             1.0000000        
S   1
  1 757610.9000000              1.0000000        
S   1
  1 214653.0000000              1.0000000        
S   1
  1  70049.9600000              1.0000000        
S   1
  1  25297.3500000              1.0000000        
S   1
  1   9870.3540000              1.0000000        
S   1
  1   4095.8950000              1.0000000        
S   1
  1   1787.8330000              1.0000000        
S   1
  1    814.0833000              1.0000000        
S   1
  1    384.1415000              1.0000000        
S   1
  1    186.8802000              1.0000000        
S   1
  1     93.2485900              1.0000000        
S   1
  1     47.1721300              1.0000000        
S   1
  1     22.5525100              1.0000000        
S   1
  1     11.5079800              1.0000000        
S   1
  1      5.8816590              1.0000000        
S   1
  1      2.7462910              1.0000000        
S   1
  1      1.3263780              1.0000000        
S   1
  1      0.6151170              1.0000000        
S   1
  1      0.1505770              1.0000000        
S   1
  1      0.0684860              1.0000000        
S   1
  1      0.0302880              1.0000000        
P   1
  1  26045.2800000              1.0000000        
P   1
  1   6164.1570000              1.0000000        
P   1
  1   2002.3880000              1.0000000        
P   1
  1    766.7725000              1.0000000        
P   1
  1    325.9611000              1.0000000        
P   1
  1    148.9799000              1.0000000        
P   1
  1     71.8437300              1.0000000        
P   1
  1     35.9581100              1.0000000        
P   1
  1     18.4423400              1.0000000        
P   1
  1      9.6317930              1.0000000        
P   1
  1      5.0180680              1.0000000        
P   1
  1      2.5588520              1.0000000        
P   1
  1      1.2719850              1.0000000        
P   1
  1      0.6118170              1.0000000        
P   1
  1      0.2542560              1.0000000        
D   1
  1    460.4508000              1.0000000        
D   1
  1    138.4285000              1.0000000        
D   1
  1     53.6718300              1.0000000        
D   1
  1     23.4926200              1.0000000        
D   1
  1     10.9407000              1.0000000        
D   1
  1      5.3296440              1.0000000        
D   1
  1      2.6344480              1.0000000        
D   1
  1      1.2885860              1.0000000        
D   1
  1      0.6158810              1.0000000        
D   1
  1      0.2826910              1.0000000        
D   1
  1      0.1198400              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Co
data:
COBALT
S   1
  1 24078730.0000000            1.0000000        
S   1
  1 3605440.0000000             1.0000000        
S   1
  1 820548.8000000              1.0000000        
S   1
  1 232444.6000000              1.0000000        
S   1
  1  75845.9200000              1.0000000        
S   1
  1  27387.5900000              1.0000000        
S   1
  1  10685.0000000              1.0000000        
S   1
  1   4433.6270000              1.0000000        
S   1
  1   1935.1290000              1.0000000        
S   1
  1    881.1123000              1.0000000        
S   1
  1    415.7653000              1.0000000        
S   1
  1    202.2726000              1.0000000        
S   1
  1    100.9430000              1.0000000        
S   1
  1     51.0890000              1.0000000        
S   1
  1     24.4633600              1.0000000        
S   1
  1     12.5034200              1.0000000        
S   1
  1      6.3972580              1.0000000        
S   1
  1      2.9927150              1.0000000        
S   1
  1      1.4440090              1.0000000        
S   1
  1      0.6684110              1.0000000        
S   1
  1      0.1623140              1.0000000        
S   1
  1      0.0729790              1.0000000        
S   1
  1      0.0319670              1.0000000        
P   1
  1  28432.6500000              1.0000000        
P   1
  1   6729.0070000              1.0000000        
P   1
  1   2185.8230000              1.0000000        
P   1
  1    837.0114000              1.0000000        
P   1
  1    355.8506000              1.0000000        
P   1
  1    162.6782000              1.0000000        
P   1
  1     78.4791000              1.0000000        
P   1
  1     39.3053200              1.0000000        
P   1
  1     20.1807400              1.0000000        
P   1
  1     10.5510100              1.0000000        
P   1
  1      5.5019070              1.0000000        
P   1
  1      2.8078680              1.0000000        
P   1
  1      1.3962900              1.0000000        
P   1
  1      0.6712470              1.0000000        
P   1
  1      0.2789200              1.0000000        
D   1
  1    502.1198000              1.0000000        
D   1
  1    151.0207000              1.0000000        
D   1
  1     58.5805900              1.0000000        
D   1
  1     25.6604500              1.0000000        
D   1
  1     11.9695700              1.0000000        
D   1
  1      5.8369490              1.0000000        
D   1
  1      2.8838880              1.0000000        
D   1
  1      1.4077020              1.0000000        
D   1
  1      0.6700770              1.0000000        
D   1
  1      0.3058290              1.0000000        
D   1
  1      0.1287160              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Ni
data:
NICKEL
S   1
  1 26074180.0000000            1.0000000        
S   1
  1 3900623.0000000             1.0000000        
S   1
  1 887188.9000000              1.0000000        
S   1
  1 251219.4000000              1.0000000        
S   1
  1  81947.8100000              1.0000000        
S   1
  1  29584.0600000              1.0000000        
S   1
  1  11539.6400000              1.0000000        
S   1
  1   4787.4170000              1.0000000        
S   1
  1   2089.2230000              1.0000000        
S   1
  1    951.1524000              1.0000000        
S   1
  1    448.7763000              1.0000000        
S   1
  1    218.3280000              1.0000000        
S   1
  1    108.9656000              1.0000000        
S   1
  1     55.1729800              1.0000000        
S   1
  1     26.4504800              1.0000000        
S   1
  1     13.5376100              1.0000000        
S   1
  1      6.9320720              1.0000000        
S   1
  1      3.2473880              1.0000000        
S   1
  1      1.5651640              1.0000000        
S   1
  1      0.7230710              1.0000000        
S   1
  1      0.1739960              1.0000000        
S   1
  1      0.0774060              1.0000000        
S   1
  1      0.0336080              1.0000000        
P   1
  1  30916.6400000              1.0000000        
P   1
  1   7316.7400000              1.0000000        
P   1
  1   2376.6990000              1.0000000        
P   1
  1    910.1014000              1.0000000        
P   1
  1    386.9528000              1.0000000        
P   1
  1    176.9320000              1.0000000        
P   1
  1     85.3835100              1.0000000        
P   1
  1     42.7887100              1.0000000        
P   1
  1     21.9904800              1.0000000        
P   1
  1     11.5080500              1.0000000        
P   1
  1      6.0055610              1.0000000        
P   1
  1      3.0671070              1.0000000        
P   1
  1      1.5256580              1.0000000        
P   1
  1      0.7330650              1.0000000        
P   1
  1      0.3046300              1.0000000        
D   1
  1    545.9420000              1.0000000        
D   1
  1    164.2648000              1.0000000        
D   1
  1     63.7446100              1.0000000        
D   1
  1     27.9427100              1.0000000        
D   1
  1     13.0535400              1.0000000        
D   1
  1      6.3713500              1.0000000        
D   1
  1      3.1467670              1.0000000        
D   1
  1      1.5334380              1.0000000        
D   1
  1      0.7274700              1.0000000        
D   1
  1      0.3304260              1.0000000        
D   1
  1      0.1381830              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Cu
data:
COPPER
S   1
  1 26284110.0000000            1.0000000        
S   1
  1 3934593.0000000             1.0000000        
S   1
  1 895242.5000000              1.0000000        
S   1
  1 253557.7000000              1.0000000        
S   1
  1  82725.4600000              1.0000000        
S   1
  1  29869.4300000              1.0000000        
S   1
  1  11652.7500000              1.0000000        
S   1
  1   4835.0090000              1.0000000        
S   1
  1   2110.1320000              1.0000000        
S   1
  1    960.6121000              1.0000000        
S   1
  1    453.1518000              1.0000000        
S   1
  1    220.3899000              1.0000000        
S   1
  1    109.9379000              1.0000000        
S   1
  1     55.6835700              1.0000000        
S   1
  1     26.9558600              1.0000000        
S   1
  1     13.7925500              1.0000000        
S   1
  1      7.0636980              1.0000000        
S   1
  1      3.2864320              1.0000000        
S   1
  1      1.5609070              1.0000000        
S   1
  1      0.7058490              1.0000000        
S   1
  1      0.1422580              1.0000000        
S   1
  1      0.0636040              1.0000000        
S   1
  1      0.0280480              1.0000000        
P   1
  1  32794.5200000              1.0000000        
P   1
  1   7760.8990000              1.0000000        
P   1
  1   2520.9300000              1.0000000        
P   1
  1    965.3069000              1.0000000        
P   1
  1    410.4222000              1.0000000        
P   1
  1    187.6788000              1.0000000        
P   1
  1     90.5851100              1.0000000        
P   1
  1     45.4055200              1.0000000        
P   1
  1     23.3472000              1.0000000        
P   1
  1     12.2177600              1.0000000        
P   1
  1      6.3647770              1.0000000        
P   1
  1      3.2455280              1.0000000        
P   1
  1      1.6075990              1.0000000        
P   1
  1      0.7657230              1.0000000        
P   1
  1      0.3179970              1.0000000        
D   1
  1      0.1095070              1.0000000        
D   1
  1      0.2735920              1.0000000        
D   1
  1      0.6287960              1.0000000        
D   1
  1      1.3719030              1.0000000        
D   1
  1      2.8839060              1.0000000        
D   1
  1      5.9334720              1.0000000        
D   1
  1     12.2549800              1.0000000        
D   1
  1     26.3421000              1.0000000        
D   1
  1     60.3647700              1.0000000        
D   1
  1    155.6931000              1.0000000        
D   1
  1    517.8221000              1.0000000        


name: Partridge Uncontracted 4
description: 1D UNCONTR Uncontracted (s,p) Sets (Large)
elt: Zn
data:
ZINC
S   1
  1 29917080.0000000            1.0000000        
S   1
  1 4476643.0000000             1.0000000        
S   1
  1 1017976.0000000             1.0000000        
S   1
  1 288174.9000000              1.0000000        
S   1
  1  93987.8500000              1.0000000        
S   1
  1  33928.4600000              1.0000000        
S   1
  1  13234.1200000              1.0000000        
S   1
  1   5490.5690000              1.0000000        
S   1
  1   2396.2280000              1.0000000        
S   1
  1   1091.0360000              1.0000000        
S   1
  1    514.8647000              1.0000000        
S   1
  1    250.5454000              1.0000000        
S   1
  1    125.0976000              1.0000000        
S   1
  1     63.4104300              1.0000000        
S   1
  1     30.5261900              1.0000000        
S   1
  1     15.6624100              1.0000000        
S   1
  1      8.0329980              1.0000000        
S   1
  1      3.7727060              1.0000000        
S   1
  1      1.8141180              1.0000000        
S   1
  1      0.8350250              1.0000000        
S   1
  1      0.1967750              1.0000000        
S   1
  1      0.0858600              1.0000000        
S   1
  1      0.0366980              1.0000000        
P   1
  1  35979.9100000              1.0000000        
P   1
  1   8513.2220000              1.0000000        
P   1
  1   2764.9790000              1.0000000        
P   1
  1   1058.7420000              1.0000000        
P   1
  1    450.2005000              1.0000000        
P   1
  1    205.9238000              1.0000000        
P   1
  1     99.4351100              1.0000000        
P   1
  1     49.8851900              1.0000000        
P   1
  1     25.6845900              1.0000000        
P   1
  1     13.4647400              1.0000000        
P   1
  1      7.0351420              1.0000000        
P   1
  1      3.5973760              1.0000000        
P   1
  1      1.7905270              1.0000000        
P   1
  1      0.8598090              1.0000000        
P   1
  1      0.3574970              1.0000000        
D   1
  1    639.7212000              1.0000000        
D   1
  1    192.6631000              1.0000000        
D   1
  1     74.8429500              1.0000000        
D   1
  1     32.8605200              1.0000000        
D   1
  1     15.3934900              1.0000000        
D   1
  1      7.5255420              1.0000000        
D   1
  1      3.7154170              1.0000000        
D   1
  1      1.8064470              1.0000000        
D   1
  1      0.8529740              1.0000000        
D   1
  1      0.3847640              1.0000000        
D   1
  1      0.1593350              1.0000000        


name: Partridge Uncontracted 2
description: 1D UNCONTR Uncontracted (s,p) Sets (Intermediate)
elt: Li
data:
LITHIUM
S   1
  1 108401.4000000              1.0000000        
S   1
  1  16230.8500000              1.0000000        
S   1
  1   3693.6390000              1.0000000        
S   1
  1   1046.2250000              1.0000000        
S   1
  1    341.3346000              1.0000000        
S   1
  1    123.2364000              1.0000000        
S   1
  1     48.0716200              1.0000000        
S   1
  1     19.9343700              1.0000000        
S   1
  1      8.6713340              1.0000000        
S   1
  1      3.9042020              1.0000000        
S   1
  1      1.8006620              1.0000000        
S   1
  1      0.8451410              1.0000000        
S   1
  1      0.3926530              1.0000000        
S   1
  1      0.0978060              1.0000000        
S   1
  1      0.0450120              1.0000000        
S   1
  1      0.0206420              1.0000000        


