# all_value

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


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


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


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


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


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: H
data:
HYDROGEN
S   3
  1     50.9991780              0.0096605        
  2      7.4832181              0.0737289        
  3      1.7774676              0.2958581        
S   1
  1      0.5193295              1.0000000        
S   1
  1      0.1541100              1.0000000        
P   1
  1      0.7500000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: C
data:
CARBON
S   7
  1   5784.1571000              0.0008190        
  2    869.3035000              0.0062935        
  3    198.5116400              0.0317812        
  4     56.4299010              0.1172734        
  5     18.2854570              0.3034763        
  6      6.4487146              0.4535214        
  7      2.3418596              0.2430591        
S   1
  1      5.4595328              1.0000000        
S   1
  1      0.4781968              1.0000000        
S   1
  1      0.1457301              1.0000000        
P   4
  1     34.2585630              0.0058043        
  2      7.8638954              0.0406403        
  3      2.3445193              0.1550219        
  4      0.7961715              0.3531444        
P   1
  1      0.2726804              1.0000000        
P   1
  1      0.0892605              1.0000000        
D   1
  1      0.6000000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: N
data:
NITROGEN
S   7
  1   8104.1761000              0.0007969        
  2   1217.3138000              0.0061289        
  3    277.7399300              0.0310471        
  4     78.8475980              0.1153682        
  5     25.5371610              0.3025738        
  6      9.0045711              0.4557913        
  7      3.2835278              0.2430208        
S   1
  1      7.8493573              1.0000000        
S   1
  1      0.6862239              1.0000000        
S   1
  1      0.2035026              1.0000000        
P   4
  1     49.0146080             -0.0059007        
  2     11.3166710             -0.0416444        
  3      3.4034053             -0.1610249        
  4      1.1611107             -0.3583538        
P   1
  1      0.3953358              1.0000000        
P   1
  1      0.1268981              1.0000000        
D   1
  1      0.7000000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: O
data:
OXYGEN
S   7
  1  10814.4020000              0.0007809        
  2   1623.7532000              0.0060102        
  3    370.1827400              0.0305222        
  4    104.9747500              0.1140089        
  5     33.9844220              0.3019574        
  6     11.9843120              0.4571107        
  7      4.3859704              0.2432478        
S   1
  1     10.6300340              1.0000000        
S   1
  1      0.9398526              1.0000000        
S   1
  1      0.2766213              1.0000000        
P   4
  1     61.5442180              0.0066238        
  2     14.2761940              0.0464642        
  3      4.3317679              0.1744229        
  4      1.4766043              0.3666115        
P   1
  1      0.4959857              1.0000000        
P   1
  1      0.1544836              1.0000000        
D   1
  1      0.8000000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: F
data:
FLUORINE
S   7
  1  13652.1010000              0.0007873        
  2   2050.2870000              0.0060550        
  3    467.6871200              0.0307289        
  4    132.7635000              0.1146453        
  5     43.0763810              0.3037706        
  6     15.2288280              0.4573067        
  7      5.6051180              0.2395779        
S   1
  1     13.8479360              1.0000000        
S   1
  1      1.2266886              1.0000000        
S   1
  1      0.3574564              1.0000000        
P   4
  1     78.9617520              0.0067827        
  2     18.3478800              0.0478976        
  3      5.5871888              0.1793841        
  4      1.9018474              0.3692989        
P   1
  1      0.6333652              1.0000000        
P   1
  1      0.1933455              1.0000000        
D   1
  1      1.0000000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: Al
data:
ALUMINUM
S   7
  1  36088.1520000              0.0005976        
  2   5334.3620000              0.0047091        
  3   1199.0892000              0.0245538        
  4    334.0744700              0.0967110        
  5    106.1290600              0.2768191        
  6     36.8828020              0.4645259        
  7     13.3326880              0.2814003        
S   3
  1     30.1581280              0.0877714        
  2      2.9732774             -0.5715000        
  3      1.0163812             -0.5066880        
S   1
  1      1.4907612              1.0000000        
S   1
  1      0.1693572              1.0000000        
S   1
  1      0.0617897              1.0000000        
P   6
  1    286.9581500              0.0035185        
  2     66.1673080              0.0283355        
  3     20.3217950              0.1262028        
  4      7.0858235              0.3283870        
  5      2.5222104              0.4712921        
  6      0.8630686              0.2733518        
P   1
  1      0.3761255              1.0000000        
P   1
  1      0.1266286              1.0000000        
P   1
  1      0.0426843              1.0000000        
D   1
  1      0.3000000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: Si
data:
SILICON
S   7
  1  42393.9270000             -0.0005895        
  2   6264.1129000             -0.0046483        
  3   1407.8552000             -0.0242470        
  4    392.2039600             -0.0956786        
  5    124.6268800             -0.2748168        
  6     43.3672480             -0.4640238        
  7     15.7102370             -0.2847122        
S   3
  1     35.2235690              0.0900852        
  2      3.5517236             -0.5764525        
  3      1.2528818             -0.5002972        
S   1
  1      1.9452047              1.0000000        
S   1
  1      0.2368547              1.0000000        
S   1
  1      0.0859243              1.0000000        
P   6
  1    368.5214700              0.0031446        
  2     83.6558130              0.0262447        
  3     25.6576850              0.1196279        
  4      8.9925564              0.3209705        
  5      3.2480686              0.4750237        
  6      1.1380729              0.2774066        
P   1
  1      0.5284094              1.0000000        
P   1
  1      0.1831337              1.0000000        
P   1
  1      0.0625550              1.0000000        
D   1
  1      0.4500000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: P
data:
PHOSPHORUS
S   7
  1  48863.3540000             -0.0005865        
  2   7253.0457000             -0.0046008        
  3   1632.6022000             -0.0239864        
  4    454.9823000             -0.0947864        
  5    144.6226000             -0.2730769        
  6     50.3827230             -0.4635665        
  7     18.2866900             -0.2875813        
S   3
  1     40.7125200              0.0921010        
  2      4.1800189             -0.5820485        
  3      1.5111173             -0.4937273        
S   1
  1      2.4442465              1.0000000        
S   1
  1      0.3116418              1.0000000        
S   1
  1      0.1120119              1.0000000        
P   6
  1    435.2945700             -0.0030635        
  2    101.3544900             -0.0248674        
  3     31.4116590             -0.1147112        
  4     11.0759770             -0.3153050        
  5      4.0461809             -0.4779211        
  6      1.4423814             -0.2800161        
P   1
  1      0.7002308              1.0000000        
P   1
  1      0.2448107              1.0000000        
P   1
  1      0.0829896              1.0000000        
D   1
  1      0.5500000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: S
data:
SULFUR
S   7
  1  56415.5800000             -0.0005778        
  2   8345.2689000             -0.0045513        
  3   1876.3041000             -0.0237472        
  4    522.7321600             -0.0939807        
  5    166.1749100             -0.2715021        
  6     57.9454220             -0.4631538        
  7     21.0667450             -0.2901939        
S   3
  1     46.6193150             -0.0938901        
  2      4.8598910              0.5877892        
  3      1.7911819              0.4873486        
S   1
  1      2.9765954              1.0000000        
S   1
  1      0.3942261              1.0000000        
S   1
  1      0.1416732              1.0000000        
P   6
  1    520.4203400             -0.0029302        
  2    120.4299700             -0.0241101        
  3     37.3906240             -0.1121763        
  4     13.2484500             -0.3123067        
  5      4.8881277             -0.4801109        
  6      1.7649320             -0.2793977        
P   1
  1      0.8892067              1.0000000        
P   1
  1      0.3103283              1.0000000        
P   1
  1      0.1030676              1.0000000        
D   1
  1      0.6500000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: Cl
data:
CHLORINE
S   7
  1  63923.6260000             -0.0005741        
  2   9525.9870000             -0.0044851        
  3   2146.3116000             -0.0233937        
  4    598.0274100             -0.0928049        
  5    190.0285500             -0.2693196        
  6     66.2619630             -0.4629613        
  7     24.0966080             -0.2937123        
S   3
  1     52.9332530              0.0954770        
  2      5.5923080             -0.5930161        
  3      2.0939560             -0.4816896        
S   1
  1      3.5576859              1.0000000        
S   1
  1      0.4847469              1.0000000        
S   1
  1      0.1733046              1.0000000        
P   6
  1    583.2011500             -0.0030511        
  2    135.4472500             -0.0249121        
  3     42.3356250             -0.1147106        
  4     15.1542700             -0.3147476        
  5      5.6830677             -0.4781012        
  6      2.0902390             -0.2717695        
P   1
  1      1.0979970              1.0000000        
P   1
  1      0.3822761              1.0000000        
P   1
  1      0.1249985              1.0000000        
D   1
  1      0.7500000              1.0000000


name: TZVP (DFT Orbital)
description: VTZP Valence Triple Zeta + Polarization designed for DFT
elt: Ar
data:
ARGON
S   7
  1  71235.4630000             -0.0005786        
  2  10643.4330000             -0.0045044        
  3   2402.5448000             -0.0234452        
  4    670.3890600             -0.0928603        
  5    213.3600100             -0.2691955        
  6     74.5580880             -0.4623268        
  7     27.1996410             -0.2939969        
S   3
  1     59.6961980              0.0968550        
  2      6.3703543             -0.5988462        
  3      2.4160646             -0.4755397        
S   1
  1      4.1865047              1.0000000        
S   1
  1      0.5830501              1.0000000        
S   1
  1      0.2070069              1.0000000        
P   6
  1    699.4256400              0.0027769        
  2    163.5830400              0.0227069        
  3     51.1460160              0.1073837        
  4     18.2560580              0.3060700        
  5      6.8415056              0.4829578        
  6      2.5182546              0.2816344        
P   1
  1      1.3256352              1.0000000        
P   1
  1      0.4621947              1.0000000        
P   1
  1      0.1503712              1.0000000        
D   1
  1      0.8500000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Al
data:
ALUMINUM
S   11
  1 3269000.0000000             0.0000021        
  2 489400.0000000              0.0000166        
  3 111400.0000000              0.0000875        
  4  31560.0000000              0.0003690        
  5  10320.0000000              0.0013390        
  6   3731.0000000              0.0043564        
  7   1456.0000000              0.0128955        
  8    604.1000000              0.0348201        
  9    263.5000000              0.0843530        
 10    119.8000000              0.1759070        
 11     56.3200000              0.2920910        
S   11
  1 3269000.0000000            -0.0000006        
  2 489400.0000000             -0.0000043        
  3 111400.0000000             -0.0000227        
  4  31560.0000000             -0.0000960        
  5  10320.0000000             -0.0003484        
  6   3731.0000000             -0.0011384        
  7   1456.0000000             -0.0033874        
  8    604.1000000             -0.0093151        
  9    263.5000000             -0.0233023        
 10    119.8000000             -0.0523486        
 11     56.3200000             -0.0999499        
S   1
  1     27.1900000              1.0000000        
S   1
  1     13.2600000              1.0000000        
S   1
  1      6.0520000              1.0000000        
S   1
  1      2.9810000              1.0000000        
S   1
  1      1.4760000              1.0000000        
S   1
  1      0.7334000              1.0000000        
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1088000              1.0000000        
S   1
  1      0.0467200              1.0000000        
S   1
  1      0.0177000              1.0000000        
P   3
  1   1461.0000000              0.0002086        
  2    346.2000000              0.0018101        
  3    112.2000000              0.0097343        
P   1
  1     42.5100000              1.0000000        
P   1
  1     17.7200000              1.0000000        
P   1
  1      7.8520000              1.0000000        
P   1
  1      3.5710000              1.0000000        
P   1
  1      1.6370000              1.0000000        
P   1
  1      0.7382000              1.0000000        
P   1
  1      0.2577000              1.0000000        
P   1
  1      0.0977300              1.0000000        
P   1
  1      0.0369000              1.0000000        
P   1
  1      0.0115000              1.0000000        
D   1
  1      1.3170000              1.0000000        
D   1
  1      0.5260000              1.0000000        
D   1
  1      0.2100000              1.0000000        
D   1
  1      0.0840000              1.0000000        
D   1
  1     30.2400000              1.0000000        
D   1
  1     14.2490000              1.0000000        
D   1
  1      6.7142000              1.0000000        
D   1
  1      3.1630000              1.0000000        
D   1
  1      0.0294000              1.0000000        
F   1
  1      0.1300000              1.0000000        
F   1
  1      0.2580000              1.0000000        
F   1
  1      0.5130000              1.0000000        
F   1
  1     15.6410000              1.0000000        
F   1
  1      6.5270000              1.0000000        
F   1
  1      2.7240000              1.0000000        
F   1
  1      0.0509000              1.0000000        
G   1
  1      0.2520000              1.0000000        
G   1
  1      0.5430000              1.0000000        
G   1
  1     11.8300000              1.0000000        
G   1
  1      4.5020000              1.0000000        
G   1
  1      0.1069000              1.0000000        
H   1
  1      0.4460000              1.0000000        
H   1
  1      8.5080000              1.0000000        
H   1
  1      0.2270000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Si
data:
SILICON
S   11
  1 3948000.0000000             0.0000020        
  2 591100.0000000              0.0000158        
  3 134500.0000000              0.0000834        
  4  38120.0000000              0.0003514        
  5  12460.0000000              0.0012766        
  6   4504.0000000              0.0041519        
  7   1758.0000000              0.0123030        
  8    729.1000000              0.0333102        
  9    318.0000000              0.0809845        
 10    144.6000000              0.1702900        
 11     67.9700000              0.2868790        
S   11
  1 3948000.0000000            -0.0000005        
  2 591100.0000000             -0.0000042        
  3 134500.0000000             -0.0000222        
  4  38120.0000000             -0.0000936        
  5  12460.0000000             -0.0003401        
  6   4504.0000000             -0.0011106        
  7   1758.0000000             -0.0033088        
  8    729.1000000             -0.0091160        
  9    318.0000000             -0.0228790        
 10    144.6000000             -0.0517119        
 11     67.9700000             -0.0999091        
S   1
  1     32.8200000              1.0000000        
S   1
  1     16.0300000              1.0000000        
S   1
  1      7.3960000              1.0000000        
S   1
  1      3.6610000              1.0000000        
S   1
  1      1.8230000              1.0000000        
S   1
  1      0.9147000              1.0000000        
S   1
  1      0.3393000              1.0000000        
S   1
  1      0.1500000              1.0000000        
S   1
  1      0.0643800              1.0000000        
S   1
  1      0.0260000              1.0000000        
P   3
  1   1780.0000000              0.0002012        
  2    421.8000000              0.0017494        
  3    136.7000000              0.0094814        
P   1
  1     51.8100000              1.0000000        
P   1
  1     21.6000000              1.0000000        
P   1
  1      9.5630000              1.0000000        
P   1
  1      4.3500000              1.0000000        
P   1
  1      2.0060000              1.0000000        
P   1
  1      0.9205000              1.0000000        
P   1
  1      0.3500000              1.0000000        
P   1
  1      0.1381000              1.0000000        
P   1
  1      0.0533800              1.0000000        
P   1
  1      0.0192000              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.3210000              1.0000000        
D   1
  1      0.8170000              1.0000000        
D   1
  1      2.0820000              1.0000000        
D   1
  1     39.9340000              1.0000000        
D   1
  1     19.4830000              1.0000000        
D   1
  1      9.5050000              1.0000000        
D   1
  1      4.6380000              1.0000000        
D   1
  1      0.0468000              1.0000000        
F   1
  1      0.1690000              1.0000000        
F   1
  1      0.3410000              1.0000000        
F   1
  1      0.6880000              1.0000000        
F   1
  1     18.9640000              1.0000000        
F   1
  1      7.9560000              1.0000000        
F   1
  1      3.3380000              1.0000000        
F   1
  1      0.0735000              1.0000000        
G   1
  1      0.3200000              1.0000000        
G   1
  1      0.7050000              1.0000000        
G   1
  1     14.5040000              1.0000000        
G   1
  1      5.5810000              1.0000000        
G   1
  1      0.1510000              1.0000000        
H   1
  1      0.5830000              1.0000000        
H   1
  1     10.5360000              1.0000000        
H   1
  1      0.3230000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: P
data:
PHOSPHORUS
S   11
  1 4666000.0000000             0.0000020        
  2 698600.0000000              0.0000153        
  3 159000.0000000              0.0000805        
  4  45040.0000000              0.0003397        
  5  14720.0000000              0.0012329        
  6   5323.0000000              0.0040135        
  7   2076.0000000              0.0119124        
  8    861.1000000              0.0322511        
  9    375.7000000              0.0786643        
 10    170.8000000              0.1664580        
 11     80.2900000              0.2830390        
S   11
  1 4666000.0000000            -0.0000005        
  2 698600.0000000             -0.0000042        
  3 159000.0000000             -0.0000218        
  4  45040.0000000             -0.0000923        
  5  14720.0000000             -0.0003351        
  6   5323.0000000             -0.0010951        
  7   2076.0000000             -0.0032680        
  8    861.1000000             -0.0089995        
  9    375.7000000             -0.0226528        
 10    170.8000000             -0.0514650        
 11     80.2900000             -0.1001860        
S   1
  1     38.7700000              1.0000000        
S   1
  1     18.9300000              1.0000000        
S   1
  1      8.7960000              1.0000000        
S   1
  1      4.3580000              1.0000000        
S   1
  1      2.1740000              1.0000000        
S   1
  1      1.0950000              1.0000000        
S   1
  1      0.4400000              1.0000000        
S   1
  1      0.1945000              1.0000000        
S   1
  1      0.0837600              1.0000000        
S   1
  1      0.0335000              1.0000000        
P   3
  1   2010.0000000              0.0002159        
  2    476.3000000              0.0018754        
  3    154.4000000              0.0101742        
P   1
  1     58.5100000              1.0000000        
P   1
  1     24.4000000              1.0000000        
P   1
  1     10.8000000              1.0000000        
P   1
  1      4.9130000              1.0000000        
P   1
  1      2.2690000              1.0000000        
P   1
  1      1.0430000              1.0000000        
P   1
  1      0.4313000              1.0000000        
P   1
  1      0.1767000              1.0000000        
P   1
  1      0.0700900              1.0000000        
P   1
  1      0.0253000              1.0000000        
D   1
  1      0.1660000              1.0000000        
D   1
  1      0.4180000              1.0000000        
D   1
  1      1.0540000              1.0000000        
D   1
  1      2.6560000              1.0000000        
D   1
  1     48.4830000              1.0000000        
D   1
  1     23.8780000              1.0000000        
D   1
  1     11.7600000              1.0000000        
D   1
  1      5.7920000              1.0000000        
D   1
  1      0.0624000              1.0000000        
F   1
  1      0.2190000              1.0000000        
F   1
  1      0.4500000              1.0000000        
F   1
  1      0.9230000              1.0000000        
F   1
  1     22.9200000              1.0000000        
F   1
  1      9.6830000              1.0000000        
F   1
  1      4.0910000              1.0000000        
F   1
  1      0.0950000              1.0000000        
G   1
  1      0.4120000              1.0000000        
G   1
  1      0.9030000              1.0000000        
G   1
  1     17.3220000              1.0000000        
G   1
  1      6.7170000              1.0000000        
G   1
  1      0.1840000              1.0000000        
H   1
  1      0.7450000              1.0000000        
H   1
  1     12.8110000              1.0000000        
H   1
  1      0.3720000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: S
data:
SULFUR
S   11
  1 5481000.0000000             0.0000019        
  2 820600.0000000              0.0000147        
  3 186700.0000000              0.0000775        
  4  52880.0000000              0.0003272        
  5  17250.0000000              0.0011937        
  6   6226.0000000              0.0038839        
  7   2429.0000000              0.0115336        
  8   1007.0000000              0.0312748        
  9    439.5000000              0.0764387        
 10    199.8000000              0.1627000        
 11     93.9200000              0.2793280        
S   11
  1 5481000.0000000            -0.0000005        
  2 820600.0000000             -0.0000041        
  3 186700.0000000             -0.0000214        
  4  52880.0000000             -0.0000905        
  5  17250.0000000             -0.0003301        
  6   6226.0000000             -0.0010778        
  7   2429.0000000             -0.0032187        
  8   1007.0000000             -0.0088722        
  9    439.5000000             -0.0223771        
 10    199.8000000             -0.0510577        
 11     93.9200000             -0.1002250        
S   1
  1     45.3400000              1.0000000        
S   1
  1     22.1500000              1.0000000        
S   1
  1     10.3400000              1.0000000        
S   1
  1      5.1190000              1.0000000        
S   1
  1      2.5530000              1.0000000        
S   1
  1      1.2820000              1.0000000        
S   1
  1      0.5450000              1.0000000        
S   1
  1      0.2411000              1.0000000        
S   1
  1      0.1035000              1.0000000        
S   1
  1      0.0420000              1.0000000        
P   3
  1   2200.0000000              0.0002390        
  2    521.4000000              0.0020769        
  3    169.0000000              0.0112363        
P   1
  1     64.0500000              1.0000000        
P   1
  1     26.7200000              1.0000000        
P   1
  1     11.8300000              1.0000000        
P   1
  1      5.3780000              1.0000000        
P   1
  1      2.4820000              1.0000000        
P   1
  1      1.1160000              1.0000000        
P   1
  1      0.4848000              1.0000000        
P   1
  1      0.2006000              1.0000000        
P   1
  1      0.0795100              1.0000000        
P   1
  1      0.0294000              1.0000000        
D   1
  1      0.2050000              1.0000000        
D   1
  1      0.5120000              1.0000000        
D   1
  1      1.2810000              1.0000000        
D   1
  1      3.2030000              1.0000000        
D   1
  1     56.6940000              1.0000000        
D   1
  1     28.0700000              1.0000000        
D   1
  1     13.8980000              1.0000000        
D   1
  1      6.8810000              1.0000000        
D   1
  1      0.0794000              1.0000000        
F   1
  1      0.2550000              1.0000000        
F   1
  1      0.5290000              1.0000000        
F   1
  1      1.0960000              1.0000000        
F   1
  1     26.3820000              1.0000000        
F   1
  1     11.0720000              1.0000000        
F   1
  1      4.6470000              1.0000000        
F   1
  1      0.1188000              1.0000000        
G   1
  1      0.4630000              1.0000000        
G   1
  1      1.0710000              1.0000000        
G   1
  1     20.3460000              1.0000000        
G   1
  1      7.9080000              1.0000000        
G   1
  1      0.2200000              1.0000000        
H   1
  1      0.8720000              1.0000000        
H   1
  1     15.3060000              1.0000000        
H   1
  1      0.4720000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Cl
data:
CHLORINE
S   11
  1 6410000.0000000             0.0000018        
  2 959600.0000000              0.0000141        
  3 218300.0000000              0.0000742        
  4  61810.0000000              0.0003141        
  5  20140.0000000              0.0011464        
  6   7264.0000000              0.0037389        
  7   2832.0000000              0.0110946        
  8   1175.0000000              0.0301152        
  9    512.6000000              0.0739145        
 10    233.0000000              0.1582580        
 11    109.5000000              0.2747530        
S   11
  1 6410000.0000000            -0.0000005        
  2 959600.0000000             -0.0000040        
  3 218300.0000000             -0.0000208        
  4  61810.0000000             -0.0000881        
  5  20140.0000000             -0.0003217        
  6   7264.0000000             -0.0010528        
  7   2832.0000000             -0.0031418        
  8   1175.0000000             -0.0086636        
  9    512.6000000             -0.0219353        
 10    233.0000000             -0.0502584        
 11    109.5000000             -0.0995414        
S   1
  1     52.8600000              1.0000000        
S   1
  1     25.8400000              1.0000000        
S   1
  1     12.1700000              1.0000000        
S   1
  1      6.0300000              1.0000000        
S   1
  1      3.0120000              1.0000000        
S   1
  1      1.5110000              1.0000000        
S   1
  1      0.6604000              1.0000000        
S   1
  1      0.2926000              1.0000000        
S   1
  1      0.1254000              1.0000000        
S   1
  1      0.0479000              1.0000000        
P   3
  1   2548.0000000              0.0002357        
  2    603.7000000              0.0020516        
  3    195.6000000              0.0111543        
P   1
  1     74.1500000              1.0000000        
P   1
  1     30.9400000              1.0000000        
P   1
  1     13.6900000              1.0000000        
P   1
  1      6.2290000              1.0000000        
P   1
  1      2.8780000              1.0000000        
P   1
  1      1.2820000              1.0000000        
P   1
  1      0.5641000              1.0000000        
P   1
  1      0.2348000              1.0000000        
P   1
  1      0.0931200              1.0000000        
P   1
  1      0.0348000              1.0000000        
D   1
  1      0.2500000              1.0000000        
D   1
  1      0.6180000              1.0000000        
D   1
  1      1.5290000              1.0000000        
D   1
  1      3.7810000              1.0000000        
D   1
  1     65.8370000              1.0000000        
D   1
  1     32.6870000              1.0000000        
D   1
  1     16.2280000              1.0000000        
D   1
  1      8.0570000              1.0000000        
D   1
  1      0.1003000              1.0000000        
F   1
  1      0.3200000              1.0000000        
F   1
  1      0.6560000              1.0000000        
F   1
  1      1.3450000              1.0000000        
F   1
  1     30.6910000              1.0000000        
F   1
  1     12.8840000              1.0000000        
F   1
  1      5.4090000              1.0000000        
F   1
  1      0.1640000              1.0000000        
G   1
  1      0.5560000              1.0000000        
G   1
  1      1.3020000              1.0000000        
G   1
  1     23.4460000              1.0000000        
G   1
  1      9.1210000              1.0000000        
G   1
  1      0.2770000              1.0000000        
H   1
  1      1.0530000              1.0000000        
H   1
  1     18.0660000              1.0000000        
H   1
  1      0.6070000              1.0000000


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Ar
data:
ARGON
S   11
  1 7401000.0000000             0.0000018        
  2 1108000.0000000             0.0000136        
  3 252100.0000000              0.0000716        
  4  71380.0000000              0.0003030        
  5  23260.0000000              0.0011061        
  6   8390.0000000              0.0036067        
  7   3271.0000000              0.0107132        
  8   1357.0000000              0.0291068        
  9    592.0000000              0.0716601        
 10    269.1000000              0.1541405        
 11    126.5000000              0.2704171        
S   11
  1 7401000.0000000            -0.0000005        
  2 1108000.0000000            -0.0000039        
  3 252100.0000000             -0.0000203        
  4  71380.0000000             -0.0000861        
  5  23260.0000000             -0.0003144        
  6   8390.0000000             -0.0010284        
  7   3271.0000000             -0.0030727        
  8   1357.0000000             -0.0084753        
  9    592.0000000             -0.0215201        
 10    269.1000000             -0.0494493        
 11    126.5000000             -0.0987759        
S   1
  1     61.0300000              1.0000000        
S   1
  1     29.8600000              1.0000000        
S   1
  1     14.1700000              1.0000000        
S   1
  1      7.0220000              1.0000000        
S   1
  1      3.5110000              1.0000000        
S   1
  1      1.7580000              1.0000000        
S   1
  1      0.7841000              1.0000000        
S   1
  1      0.3480000              1.0000000        
S   1
  1      0.1491000              1.0000000        
S   1
  1      0.0538000              1.0000000        
P   3
  1   2927.0000000              0.0002320        
  2    693.5000000              0.0020233        
  3    224.7000000              0.0110340        
P   1
  1     85.1700000              1.0000000        
P   1
  1     35.5300000              1.0000000        
P   1
  1     15.7300000              1.0000000        
P   1
  1      7.1650000              1.0000000        
P   1
  1      3.3220000              1.0000000        
P   1
  1      1.4780000              1.0000000        
P   1
  1      0.6552000              1.0000000        
P   1
  1      0.2751000              1.0000000        
P   1
  1      0.1097000              1.0000000        
P   1
  1      0.0402000              1.0000000        
D   1
  1      0.3090000              1.0000000        
D   1
  1      0.7700000              1.0000000        
D   1
  1      1.9170000              1.0000000        
D   1
  1      4.7760000              1.0000000        
D   1
  1     76.8080000              1.0000000        
D   1
  1     38.7370000              1.0000000        
D   1
  1     19.5370000              1.0000000        
D   1
  1      9.8530000              1.0000000        
D   1
  1      0.1210000              1.0000000        
F   1
  1      0.4080000              1.0000000        
F   1
  1      0.8250000              1.0000000        
F   1
  1      1.6680000              1.0000000        
F   1
  1     35.8730000              1.0000000        
F   1
  1     15.1400000              1.0000000        
F   1
  1      6.3900000              1.0000000        
F   1
  1      0.2090000              1.0000000        
G   1
  1      0.6650000              1.0000000        
G   1
  1      1.5620000              1.0000000        
G   1
  1     26.5600000              1.0000000        
G   1
  1     10.3060000              1.0000000        
G   1
  1      0.3340000              1.0000000        
H   1
  1      1.2640000              1.0000000        
H   1
  1     21.1040000              1.0000000        
H   1
  1      0.7420000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   8
  1   1469.0000000              0.0007660        
  2    220.5000000              0.0058920        
  3     50.2600000              0.0296710        
  4     14.2400000              0.1091800        
  5      4.5810000              0.2827890        
  6      1.5800000              0.4531230        
  7      0.5640000              0.2747740        
  8      0.0734500              0.0097510        
S   8
  1   1469.0000000             -0.0001200        
  2    220.5000000             -0.0009230        
  3     50.2600000             -0.0046890        
  4     14.2400000             -0.0176820        
  5      4.5810000             -0.0489020        
  6      1.5800000             -0.0960090        
  7      0.5640000             -0.1363800        
  8      0.0734500              0.5751020        
S   1
  1      0.0280500              1.0000000        
S   1
  1      0.9060000              1.0000000        
S   1
  1      0.0086400              1.0000000        
P   3
  1      1.5340000              0.0227840        
  2      0.2749000              0.1391070        
  3      0.0736200              0.5003750        
P   1
  1      0.0240300              1.0000000        
P   1
  1      3.2420000              1.0000000        
P   1
  1      0.0057900              1.0000000        
D   1
  1      0.1239000              1.0000000        
D   1
  1      0.0725000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   8
  1   2940.0000000              0.0006800        
  2    441.2000000              0.0052360        
  3    100.5000000              0.0266060        
  4     28.4300000              0.0999930        
  5      9.1690000              0.2697020        
  6      3.1960000              0.4514690        
  7      1.1590000              0.2950740        
  8      0.1811000              0.0125870        
S   8
  1   2940.0000000             -0.0001230        
  2    441.2000000             -0.0009660        
  3    100.5000000             -0.0048310        
  4     28.4300000             -0.0193140        
  5      9.1690000             -0.0532800        
  6      3.1960000             -0.1207230        
  7      1.1590000             -0.1334350        
  8      0.1811000              0.5307670        
S   1
  1      0.0589000              1.0000000        
S   1
  1      1.8600000              1.0000000        
S   1
  1      0.0187700              1.0000000        
P   3
  1      3.6190000              0.0291110        
  2      0.7110000              0.1693650        
  3      0.1951000              0.5134580        
P   1
  1      0.0601800              1.0000000        
P   1
  1      6.1630000              1.0000000        
P   1
  1      0.0085000              1.0000000        
D   1
  1      0.2380000              1.0000000        
D   1
  1      0.0740000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: B
data:
BORON
S   8
  1   4570.0000000              0.0006960        
  2    685.9000000              0.0053530        
  3    156.5000000              0.0271340        
  4     44.4700000              0.1013800        
  5     14.4800000              0.2720550        
  6      5.1310000              0.4484030        
  7      1.8980000              0.2901230        
  8      0.3329000              0.0143220        
S   8
  1   4570.0000000             -0.0001390        
  2    685.9000000             -0.0010970        
  3    156.5000000             -0.0054440        
  4     44.4700000             -0.0219160        
  5     14.4800000             -0.0597510        
  6      5.1310000             -0.1387320        
  7      1.8980000             -0.1314820        
  8      0.3329000              0.5395260        
S   1
  1      0.1043000              1.0000000        
S   1
  1      3.0660000              1.0000000        
S   1
  1      0.0310500              1.0000000        
P   3
  1      6.0010000              0.0354810        
  2      1.2410000              0.1980720        
  3      0.3364000              0.5052300        
P   1
  1      0.0953800              1.0000000        
P   1
  1      9.9400000              1.0000000        
P   1
  1      0.0237800              1.0000000        
D   1
  1      0.3430000              1.0000000        
D   1
  1      0.0904000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: C
data:
CARBON
S   8
  1   6665.0000000              0.0006920        
  2   1000.0000000              0.0053290        
  3    228.0000000              0.0270770        
  4     64.7100000              0.1017180        
  5     21.0600000              0.2747400        
  6      7.4950000              0.4485640        
  7      2.7970000              0.2850740        
  8      0.5215000              0.0152040        
S   8
  1   6665.0000000             -0.0001460        
  2   1000.0000000             -0.0011540        
  3    228.0000000             -0.0057250        
  4     64.7100000             -0.0233120        
  5     21.0600000             -0.0639550        
  6      7.4950000             -0.1499810        
  7      2.7970000             -0.1272620        
  8      0.5215000              0.5445290        
S   1
  1      0.1596000              1.0000000        
S   1
  1      4.5300000              1.0000000        
S   1
  1      0.0469000              1.0000000        
P   3
  1      9.4390000              0.0381090        
  2      2.0020000              0.2094800        
  3      0.5456000              0.5085570        
P   1
  1      0.1517000              1.0000000        
P   1
  1     14.5570000              1.0000000        
P   1
  1      0.0404100              1.0000000        
D   1
  1      0.5500000              1.0000000        
D   1
  1      0.1510000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   8
  1   9046.0000000              0.0007000        
  2   1357.0000000              0.0053890        
  3    309.3000000              0.0274060        
  4     87.7300000              0.1032070        
  5     28.5600000              0.2787230        
  6     10.2100000              0.4485400        
  7      3.8380000              0.2782380        
  8      0.7466000              0.0154400        
S   8
  1   9046.0000000             -0.0001530        
  2   1357.0000000             -0.0012080        
  3    309.3000000             -0.0059920        
  4     87.7300000             -0.0245440        
  5     28.5600000             -0.0674590        
  6     10.2100000             -0.1580780        
  7      3.8380000             -0.1218310        
  8      0.7466000              0.5490030        
S   1
  1      0.2248000              1.0000000        
S   1
  1      6.2330000              1.0000000        
S   1
  1      0.0612400              1.0000000        
P   3
  1     13.5500000              0.0399190        
  2      2.9170000              0.2171690        
  3      0.7973000              0.5103190        
P   1
  1      0.2185000              1.0000000        
P   1
  1     19.9770000              1.0000000        
P   1
  1      0.0561100              1.0000000        
D   1
  1      0.8170000              1.0000000        
D   1
  1      0.2300000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   8
  1  11720.0000000              0.0007100        
  2   1759.0000000              0.0054700        
  3    400.8000000              0.0278370        
  4    113.7000000              0.1048000        
  5     37.0300000              0.2830620        
  6     13.2700000              0.4487190        
  7      5.0250000              0.2709520        
  8      1.0130000              0.0154580        
S   8
  1  11720.0000000             -0.0001600        
  2   1759.0000000             -0.0012630        
  3    400.8000000             -0.0062670        
  4    113.7000000             -0.0257160        
  5     37.0300000             -0.0709240        
  6     13.2700000             -0.1654110        
  7      5.0250000             -0.1169550        
  8      1.0130000              0.5573680        
S   1
  1      0.3023000              1.0000000        
S   1
  1      8.2150000              1.0000000        
S   1
  1      0.0789600              1.0000000        
P   3
  1     17.7000000              0.0430180        
  2      3.8540000              0.2289130        
  3      1.0460000              0.5087280        
P   1
  1      0.2753000              1.0000000        
P   1
  1     26.0560000              1.0000000        
P   1
  1      0.0685600              1.0000000        
D   1
  1      1.1850000              1.0000000        
D   1
  1      0.3320000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   8
  1  14710.0000000              0.0007210        
  2   2207.0000000              0.0055530        
  3    502.8000000              0.0282670        
  4    142.6000000              0.1064440        
  5     46.4700000              0.2868140        
  6     16.7000000              0.4486410        
  7      6.3560000              0.2647610        
  8      1.3160000              0.0153330        
S   8
  1  14710.0000000             -0.0001650        
  2   2207.0000000             -0.0013080        
  3    502.8000000             -0.0064950        
  4    142.6000000             -0.0266910        
  5     46.4700000             -0.0736900        
  6     16.7000000             -0.1707760        
  7      6.3560000             -0.1123270        
  8      1.3160000              0.5628140        
S   1
  1      0.3897000              1.0000000        
S   1
  1     10.4260000              1.0000000        
S   1
  1      0.0986300              1.0000000        
P   3
  1     22.6700000              0.0448780        
  2      4.9770000              0.2357180        
  3      1.3470000              0.5085210        
P   1
  1      0.3471000              1.0000000        
P   1
  1     32.8300000              1.0000000        
P   1
  1      0.0850200              1.0000000        
D   1
  1      1.6400000              1.0000000        
D   1
  1      0.4640000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Ne
data:
NEON
S   8
  1  17880.0000000              0.0007380        
  2   2683.0000000              0.0056770        
  3    611.5000000              0.0288830        
  4    173.5000000              0.1085400        
  5     56.6400000              0.2909070        
  6     20.4200000              0.4483240        
  7      7.8100000              0.2580260        
  8      1.6530000              0.0150630        
S   8
  1  17880.0000000             -0.0001720        
  2   2683.0000000             -0.0013570        
  3    611.5000000             -0.0067370        
  4    173.5000000             -0.0276630        
  5     56.6400000             -0.0762080        
  6     20.4200000             -0.1752270        
  7      7.8100000             -0.1070380        
  8      1.6530000              0.5670500        
S   1
  1      0.4869000              1.0000000        
S   1
  1     12.8540000              1.0000000        
S   1
  1      0.1230000              1.0000000        
P   3
  1     28.3900000              0.0460870        
  2      6.2700000              0.2401810        
  3      1.6950000              0.5087440        
P   1
  1      0.4317000              1.0000000        
P   1
  1     40.1840000              1.0000000        
P   1
  1      0.1064000              1.0000000        
D   1
  1      2.2020000              1.0000000        
D   1
  1      0.6310000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Na
data:
SODIUM
S   11
  1  31700.0000000              0.458878E-03     
  2   4755.0000000              0.355070E-02     
  3   1082.0000000              0.182618E-01     
  4    306.4000000              0.716650E-01     
  5     99.5300000              0.212346E+00     
  6     35.4200000              0.416203E+00     
  7     13.3000000              0.373020E+00     
  8      4.3920000              0.625054E-01     
  9      1.6760000             -0.624532E-02     
 10      0.5889000              0.243374E-02     
 11      0.0564000             -0.442381E-03     
S   11
  1  31700.0000000             -0.112162E-03     
  2   4755.0000000             -0.868512E-03     
  3   1082.0000000             -0.451330E-02     
  4    306.4000000             -0.181436E-01     
  5     99.5300000             -0.580799E-01     
  6     35.4200000             -0.137653E+00     
  7     13.3000000             -0.193908E+00     
  8      4.3920000              0.858009E-01     
  9      1.6760000              0.604419E+00     
 10      0.5889000              0.441719E+00     
 11      0.0564000              0.130547E-01     
S   11
  1  31700.0000000              0.170160E-04     
  2   4755.0000000              0.130693E-03     
  3   1082.0000000              0.687784E-03     
  4    306.4000000              0.272359E-02     
  5     99.5300000              0.895529E-02     
  6     35.4200000              0.207832E-01     
  7     13.3000000              0.319380E-01     
  8      4.3920000             -0.191368E-01     
  9      1.6760000             -0.102595E+00     
 10      0.5889000             -0.198945E+00     
 11      0.0564000              0.655952E+00     
S   1
  1      0.0230700              1.0000000        
S   1
  1      0.7040000              1.0000000        
S   1
  1      0.0072500              1.0000000        
P   7
  1    138.1000000              0.579641E-02     
  2     32.2400000              0.415756E-01     
  3      9.9850000              0.162873E+00     
  4      3.4840000              0.359401E+00     
  5      1.2310000              0.449988E+00     
  6      0.4177000              0.227507E+00     
  7      0.0651300              0.808247E-02     
P   7
  1    138.1000000             -0.581531E-03     
  2     32.2400000             -0.407306E-02     
  3      9.9850000             -0.167937E-01     
  4      3.4840000             -0.353268E-01     
  5      1.2310000             -0.521971E-01     
  6      0.4177000             -0.168359E-01     
  7      0.0651300              0.434613E+00     
P   1
  1      0.0205300              1.0000000        
P   1
  1      0.7610000              1.0000000        
P   1
  1      0.0063300              1.0000000        
D   1
  1      0.0973000              1.0000000        
D   1
  1      2.9490000              1.0000000        
D   1
  1      0.0468000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   11
  1  47390.0000000              0.346023E-03     
  2   7108.0000000              0.268077E-02     
  3   1618.0000000              0.138367E-01     
  4    458.4000000              0.551767E-01     
  5    149.3000000              0.169660E+00     
  6     53.5900000              0.364703E+00     
  7     20.7000000              0.406856E+00     
  8      8.3840000              0.135089E+00     
  9      2.5420000              0.490884E-02     
 10      0.8787000              0.286460E-03     
 11      0.1077000              0.264590E-04     
S   11
  1  47390.0000000             -0.877839E-04     
  2   7108.0000000             -0.674725E-03     
  3   1618.0000000             -0.355603E-02     
  4    458.4000000             -0.142154E-01     
  5    149.3000000             -0.476748E-01     
  6     53.5900000             -0.114892E+00     
  7     20.7000000             -0.200676E+00     
  8      8.3840000             -0.341224E-01     
  9      2.5420000              0.570454E+00     
 10      0.8787000              0.542309E+00     
 11      0.1077000              0.218128E-01     
S   11
  1  47390.0000000              0.169628E-04     
  2   7108.0000000              0.129865E-03     
  3   1618.0000000              0.688831E-03     
  4    458.4000000              0.273533E-02     
  5    149.3000000              0.931224E-02     
  6     53.5900000              0.223265E-01     
  7     20.7000000              0.411195E-01     
  8      8.3840000              0.545642E-02     
  9      2.5420000             -0.134012E+00     
 10      0.8787000             -0.256176E+00     
 11      0.1077000              0.605856E+00     
S   1
  1      0.0399900              1.0000000        
S   1
  1      3.4220000              1.0000000        
S   1
  1      0.0148800              1.0000000        
P   7
  1    179.9000000              0.538161E-02     
  2     42.1400000              0.392418E-01     
  3     13.1300000              0.157445E+00     
  4      4.6280000              0.358535E+00     
  5      1.6700000              0.457226E+00     
  6      0.5857000              0.215918E+00     
  7      0.1311000              0.664948E-02     
P   7
  1    179.9000000             -0.865948E-03     
  2     42.1400000             -0.615978E-02     
  3     13.1300000             -0.261519E-01     
  4      4.6280000             -0.570647E-01     
  5      1.6700000             -0.873906E-01     
  6      0.5857000             -0.122990E-01     
  7      0.1311000              0.502085E+00     
P   1
  1      0.0411200              1.0000000        
P   1
  1      8.2790000              1.0000000        
P   1
  1      0.0093500              1.0000000        
D   1
  1      0.1870000              1.0000000        
D   1
  1      3.7040000              1.0000000        
D   1
  1      0.0595000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   11
  1  64150.0000000              0.290250E-03     
  2   9617.0000000              0.225064E-02     
  3   2189.0000000              0.116459E-01     
  4    620.5000000              0.467377E-01     
  5    202.7000000              0.146299E+00     
  6     73.1500000              0.330283E+00     
  7     28.5500000              0.415861E+00     
  8     11.7700000              0.189253E+00     
  9      3.3000000              0.115889E-01     
 10      1.1730000             -0.128385E-02     
 11      0.1752000              0.425883E-03     
S   11
  1  64150.0000000             -0.758048E-04     
  2   9617.0000000             -0.581791E-03     
  3   2189.0000000             -0.308113E-02     
  4    620.5000000             -0.123112E-01     
  5    202.7000000             -0.419781E-01     
  6     73.1500000             -0.103371E+00     
  7     28.5500000             -0.196308E+00     
  8     11.7700000             -0.830002E-01     
  9      3.3000000              0.541040E+00     
 10      1.1730000              0.578796E+00     
 11      0.1752000              0.288147E-01     
S   11
  1  64150.0000000              0.175078E-04     
  2   9617.0000000              0.134208E-03     
  3   2189.0000000              0.712442E-03     
  4    620.5000000              0.284330E-02     
  5    202.7000000              0.976842E-02     
  6     73.1500000              0.241850E-01     
  7     28.5500000              0.474993E-01     
  8     11.7700000              0.203621E-01     
  9      3.3000000             -0.158788E+00     
 10      1.1730000             -0.311694E+00     
 11      0.1752000              0.620147E+00     
S   1
  1      0.0647300              1.0000000        
S   1
  1      4.0300000              1.0000000        
S   1
  1      0.0231000              1.0000000        
P   7
  1    258.8000000              0.406847E-02     
  2     60.8900000              0.306815E-01     
  3     19.1400000              0.129149E+00     
  4      6.8810000              0.320831E+00     
  5      2.5740000              0.453815E+00     
  6      0.9572000              0.275066E+00     
  7      0.2099000              0.190807E-01     
P   7
  1    258.8000000             -0.748053E-03     
  2     60.8900000             -0.545796E-02     
  3     19.1400000             -0.245371E-01     
  4      6.8810000             -0.582138E-01     
  5      2.5740000             -0.983756E-01     
  6      0.9572000             -0.260064E-01     
  7      0.2099000              0.464020E+00     
P   1
  1      0.0598600              1.0000000        
P   1
  1      1.5290000              1.0000000        
P   1
  1      0.0153000              1.0000000        
D   1
  1      0.1890000              1.0000000        
D   1
  1      4.7250000              1.0000000        
D   1
  1      0.0535000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Si
data:
SILICON
S   11
  1  78860.0000000              0.270443E-03     
  2  11820.0000000              0.209717E-02     
  3   2692.0000000              0.108506E-01     
  4    763.4000000              0.436754E-01     
  5    249.6000000              0.137653E+00     
  6     90.2800000              0.316644E+00     
  7     35.2900000              0.418581E+00     
  8     14.5100000              0.210212E+00     
  9      4.0530000              0.144952E-01     
 10      1.4820000             -0.203590E-02     
 11      0.2517000              0.624186E-03     
S   11
  1  78860.0000000             -0.723177E-04     
  2  11820.0000000             -0.555116E-03     
  3   2692.0000000             -0.293805E-02     
  4    763.4000000             -0.117687E-01     
  5    249.6000000             -0.402907E-01     
  6     90.2800000             -0.100609E+00     
  7     35.2900000             -0.196528E+00     
  8     14.5100000             -0.102382E+00     
  9      4.0530000              0.527190E+00     
 10      1.4820000              0.593251E+00     
 11      0.2517000              0.332652E-01     
S   11
  1  78860.0000000              0.185113E-04     
  2  11820.0000000              0.142236E-03     
  3   2692.0000000              0.752185E-03     
  4    763.4000000              0.302279E-02     
  5    249.6000000              0.103677E-01     
  6     90.2800000              0.262563E-01     
  7     35.2900000              0.523989E-01     
  8     14.5100000              0.290959E-01     
  9      4.0530000             -0.178003E+00     
 10      1.4820000             -0.346874E+00     
 11      0.2517000              0.623020E+00     
S   1
  1      0.0924300              1.0000000        
S   1
  1      4.9590000              1.0000000        
S   1
  1      0.0332000              1.0000000        
P   7
  1    315.9000000              0.392656E-02     
  2     74.4200000              0.298811E-01     
  3     23.4800000              0.127212E+00     
  4      8.4880000              0.320943E+00     
  5      3.2170000              0.455429E+00     
  6      1.2290000              0.268563E+00     
  7      0.2964000              0.188336E-01     
P   7
  1    315.9000000             -0.858302E-03     
  2     74.4200000             -0.630328E-02     
  3     23.4800000             -0.288255E-01     
  4      8.4880000             -0.694560E-01     
  5      3.2170000             -0.119493E+00     
  6      1.2290000             -0.199581E-01     
  7      0.2964000              0.510268E+00     
P   1
  1      0.0876800              1.0000000        
P   1
  1      1.9980000              1.0000000        
P   1
  1      0.0250000              1.0000000        
D   1
  1      0.2750000              1.0000000        
D   1
  1      5.8060000              1.0000000        
D   1
  1      0.0823000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   11
  1  94840.0000000              0.255509E-03     
  2  14220.0000000              0.198193E-02     
  3   3236.0000000              0.102760E-01     
  4    917.1000000              0.414823E-01     
  5    299.5000000              0.131984E+00     
  6    108.1000000              0.308662E+00     
  7     42.1800000              0.420647E+00     
  8     17.2800000              0.222878E+00     
  9      4.8580000              0.164035E-01     
 10      1.8180000             -0.254255E-02     
 11      0.3372000              0.748050E-03     
S   11
  1  94840.0000000             -0.696939E-04     
  2  14220.0000000             -0.535266E-03     
  3   3236.0000000             -0.283709E-02     
  4    917.1000000             -0.113983E-01     
  5    299.5000000             -0.392929E-01     
  6    108.1000000             -0.996364E-01     
  7     42.1800000             -0.197983E+00     
  8     17.2800000             -0.114860E+00     
  9      4.8580000              0.518595E+00     
 10      1.8180000              0.601847E+00     
 11      0.3372000              0.368612E-01     
S   11
  1  94840.0000000              0.191199E-04     
  2  14220.0000000              0.147223E-03     
  3   3236.0000000              0.777912E-03     
  4    917.1000000              0.314546E-02     
  5    299.5000000              0.108200E-01     
  6    108.1000000              0.279957E-01     
  7     42.1800000              0.563978E-01     
  8     17.2800000              0.358190E-01     
  9      4.8580000             -0.193387E+00     
 10      1.8180000             -0.372097E+00     
 11      0.3372000              0.624246E+00     
S   1
  1      0.1232000              1.0000000        
S   1
  1      5.9770000              1.0000000        
S   1
  1      0.0417000              1.0000000        
P   7
  1    370.5000000              0.395005E-02     
  2     87.3300000              0.302492E-01     
  3     27.5900000              0.129554E+00     
  4     10.0000000              0.327594E+00     
  5      3.8250000              0.456992E+00     
  6      1.4940000              0.253086E+00     
  7      0.3921000              0.168798E-01     
P   7
  1    370.5000000             -0.959832E-03     
  2     87.3300000             -0.711177E-02     
  3     27.5900000             -0.327122E-01     
  4     10.0000000             -0.795784E-01     
  5      3.8250000             -0.135016E+00     
  6      1.4940000             -0.910585E-02     
  7      0.3921000              0.537802E+00     
P   1
  1      0.1186000              1.0000000        
P   1
  1      2.5240000              1.0000000        
P   1
  1      0.0343000              1.0000000        
D   1
  1      0.3730000              1.0000000        
D   1
  1      7.0200000              1.0000000        
D   1
  1      0.1130000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: S
data:
SULFUR
S   11
  1 110800.0000000              0.247635E-03     
  2  16610.0000000              0.192026E-02     
  3   3781.0000000              0.996192E-02     
  4   1071.0000000              0.402975E-01     
  5    349.8000000              0.128604E+00     
  6    126.3000000              0.303480E+00     
  7     49.2600000              0.421432E+00     
  8     20.1600000              0.230781E+00     
  9      5.7200000              0.178971E-01     
 10      2.1820000             -0.297516E-02     
 11      0.4327000              0.849522E-03     
S   11
  1 110800.0000000             -0.687039E-04     
  2  16610.0000000             -0.527681E-03     
  3   3781.0000000             -0.279671E-02     
  4   1071.0000000             -0.112651E-01     
  5    349.8000000             -0.388834E-01     
  6    126.3000000             -0.995025E-01     
  7     49.2600000             -0.199740E+00     
  8     20.1600000             -0.123360E+00     
  9      5.7200000              0.513194E+00     
 10      2.1820000              0.607120E+00     
 11      0.4327000              0.396753E-01     
S   11
  1 110800.0000000              0.199077E-04     
  2  16610.0000000              0.153483E-03     
  3   3781.0000000              0.809503E-03     
  4   1071.0000000              0.328974E-02     
  5    349.8000000              0.112967E-01     
  6    126.3000000              0.296385E-01     
  7     49.2600000              0.599851E-01     
  8     20.1600000              0.413248E-01     
  9      5.7200000             -0.207474E+00     
 10      2.1820000             -0.392889E+00     
 11      0.4327000              0.632840E+00     
S   1
  1      0.1570000              1.0000000        
S   1
  1      7.0830000              1.0000000        
S   1
  1      0.0507000              1.0000000        
P   7
  1    399.7000000              0.447541E-02     
  2     94.1900000              0.341708E-01     
  3     29.7500000              0.144250E+00     
  4     10.7700000              0.353928E+00     
  5      4.1190000              0.459085E+00     
  6      1.6250000              0.206383E+00     
  7      0.4726000              0.102141E-01     
P   7
  1    399.7000000             -0.116251E-02     
  2     94.1900000             -0.865664E-02     
  3     29.7500000             -0.390886E-01     
  4     10.7700000             -0.934625E-01     
  5      4.1190000             -0.147994E+00     
  6      1.6250000              0.301904E-01     
  7      0.4726000              0.561573E+00     
P   1
  1      0.1407000              1.0000000        
P   1
  1      3.0890000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   1
  1      0.4790000              1.0000000        
D   1
  1      8.3630000              1.0000000        
D   1
  1      0.1520000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   11
  1 127900.0000000              0.241153E-03     
  2  19170.0000000              0.187095E-02     
  3   4363.0000000              0.970827E-02     
  4   1236.0000000              0.393153E-01     
  5    403.6000000              0.125932E+00     
  6    145.7000000              0.299341E+00     
  7     56.8100000              0.421886E+00     
  8     23.2300000              0.237201E+00     
  9      6.6440000              0.191531E-01     
 10      2.5750000             -0.334792E-02     
 11      0.5371000              0.929883E-03     
S   11
  1 127900.0000000             -0.678922E-04     
  2  19170.0000000             -0.521836E-03     
  3   4363.0000000             -0.276513E-02     
  4   1236.0000000             -0.111537E-01     
  5    403.6000000             -0.385919E-01     
  6    145.7000000             -0.994848E-01     
  7     56.8100000             -0.201392E+00     
  8     23.2300000             -0.130313E+00     
  9      6.6440000              0.509443E+00     
 10      2.5750000              0.610725E+00     
 11      0.5371000              0.421549E-01     
S   11
  1 127900.0000000              0.204986E-04     
  2  19170.0000000              0.158298E-03     
  3   4363.0000000              0.833639E-03     
  4   1236.0000000              0.339880E-02     
  5    403.6000000              0.116738E-01     
  6    145.7000000              0.309622E-01     
  7     56.8100000              0.629533E-01     
  8     23.2300000              0.460257E-01     
  9      6.6440000             -0.219312E+00     
 10      2.5750000             -0.408773E+00     
 11      0.5371000              0.638465E+00     
S   1
  1      0.1938000              1.0000000        
S   1
  1      8.2730000              1.0000000        
S   1
  1      0.0608000              1.0000000        
P   7
  1    417.6000000              0.525982E-02     
  2     98.3300000              0.398332E-01     
  3     31.0400000              0.164655E+00     
  4     11.1900000              0.387322E+00     
  5      4.2490000              0.457072E+00     
  6      1.6240000              0.151636E+00     
  7      0.5322000              0.181615E-02     
P   7
  1    417.6000000             -0.143570E-02     
  2     98.3300000             -0.107796E-01     
  3     31.0400000             -0.470075E-01     
  4     11.1900000             -0.111030E+00     
  5      4.2490000             -0.153275E+00     
  6      1.6240000              0.894609E-01     
  7      0.5322000              0.579444E+00     
P   1
  1      0.1620000              1.0000000        
P   1
  1      3.6970000              1.0000000        
P   1
  1      0.0466000              1.0000000        
D   1
  1      0.6000000              1.0000000        
D   1
  1      9.8440000              1.0000000        
D   1
  1      0.1960000              1.0000000


name: aug-cc-pCVDZ
description: DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
elt: Ar
data:
ARGON
S   11
  1 145700.0000000              0.236700E-03     
  2  21840.0000000              0.183523E-02     
  3   4972.0000000              0.952860E-02     
  4   1408.0000000              0.386283E-01     
  5    459.7000000              0.124081E+00     
  6    165.9000000              0.296471E+00     
  7     64.6900000              0.422068E+00     
  8     26.4400000              0.241711E+00     
  9      7.6280000              0.200509E-01     
 10      2.9960000             -0.361000E-02     
 11      0.6504000              0.975607E-03     
S   11
  1 145700.0000000             -0.674910E-04     
  2  21840.0000000             -0.518522E-03     
  3   4972.0000000             -0.274825E-02     
  4   1408.0000000             -0.111007E-01     
  5    459.7000000             -0.384820E-01     
  6    165.9000000             -0.997599E-01     
  7     64.6900000             -0.203088E+00     
  8     26.4400000             -0.135608E+00     
  9      7.6280000              0.507195E+00     
 10      2.9960000              0.612898E+00     
 11      0.6504000              0.442968E-01     
S   11
  1 145700.0000000              0.210457E-04     
  2  21840.0000000              0.162565E-03     
  3   4972.0000000              0.855463E-03     
  4   1408.0000000              0.349745E-02     
  5    459.7000000              0.120156E-01     
  6    165.9000000              0.321368E-01     
  7     64.6900000              0.655279E-01     
  8     26.4400000              0.499370E-01     
  9      7.6280000             -0.229769E+00     
 10      2.9960000             -0.421006E+00     
 11      0.6504000              0.642331E+00     
S   1
  1      0.2337000              1.0000000        
S   1
  1      9.5480000              1.0000000        
S   1
  1      0.0709000              1.0000000        
P   7
  1    453.7000000              0.570555E-02     
  2    106.8000000              0.430460E-01     
  3     33.7300000              0.176591E+00     
  4     12.1300000              0.406863E+00     
  5      4.5940000              0.452549E+00     
  6      1.6780000              0.122801E+00     
  7      0.5909000             -0.445996E-02     
P   7
  1    453.7000000             -0.160655E-02     
  2    106.8000000             -0.121714E-01     
  3     33.7300000             -0.520789E-01     
  4     12.1300000             -0.123737E+00     
  5      4.5940000             -0.151619E+00     
  6      1.6780000              0.142425E+00     
  7      0.5909000              0.584501E+00     
P   1
  1      0.1852000              1.0000000        
P   1
  1      4.3610000              1.0000000        
P   1
  1      0.0533000              1.0000000        
D   1
  1      0.7380000              1.0000000        
D   1
  1     11.4590000              1.0000000        
D   1
  1      0.2400000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   8
  1   1469.0000000              0.0008088        
  2    220.5000000              0.0059351        
  3     50.2600000              0.0297426        
  4     14.2400000              0.1092518        
  5      4.5810000              0.2828208        
  6      1.5800000              0.4530721        
  7      0.5640000              0.2747044        
  8      0.0734500              0.0097522        
S   8
  1   1469.0000000             -0.0001265        
  2    220.5000000             -0.0009296        
  3     50.2600000             -0.0047009        
  4     14.2400000             -0.0176977        
  5      4.5810000             -0.0489110        
  6      1.5800000             -0.0960241        
  7      0.5640000             -0.1363226        
  8      0.0734500              0.5752286        
S   1
  1      0.0280500              1.0000000        
S   1
  1      0.9060000              1.0000000        
S   1
  1      0.0086400              1.0000000        
P   3
  1      1.5340000              0.0227857        
  2      0.2749000              0.1391025        
  3      0.0736200              0.5003752        
P   1
  1      0.0240300              1.0000000        
P   1
  1      3.2420000              1.0000000        
P   1
  1      0.0057900              1.0000000        
D   1
  1      0.1239000              1.0000000        
D   1
  1      0.0725000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   8
  1   2940.0000000              0.0007540        
  2    441.2000000              0.0053133        
  3    100.5000000              0.0267325        
  4     28.4300000              0.1001318        
  5      9.1690000              0.2697812        
  6      3.1960000              0.4513833        
  7      1.1590000              0.2949205        
  8      0.1811000              0.0125867        
S   8
  1   2940.0000000             -0.0001366        
  2    441.2000000             -0.0009801        
  3    100.5000000             -0.0048561        
  4     28.4300000             -0.0193487        
  5      9.1690000             -0.0533058        
  6      3.1960000             -0.1207608        
  7      1.1590000             -0.1332909        
  8      0.1811000              0.5309727        
S   1
  1      0.0589000              1.0000000        
S   1
  1      1.8600000              1.0000000        
S   1
  1      0.0187700              1.0000000        
P   3
  1      3.6190000              0.0291050        
  2      0.7110000              0.1694665        
  3      0.1951000              0.5129691        
P   1
  1      0.0601800              1.0000000        
P   1
  1      6.1630000              1.0000000        
P   1
  1      0.0085000              1.0000000        
D   1
  1      0.2380000              1.0000000        
D   1
  1      0.0740000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: B
data:
BORON
S   8
  1   4570.0000000              0.0008100        
  2    685.9000000              0.0054774        
  3    156.5000000              0.0273355        
  4     44.4700000              0.1016067        
  5     14.4800000              0.2721905        
  6      5.1310000              0.4482545        
  7      1.8980000              0.2898816        
  8      0.3329000              0.0143047        
S   8
  1   4570.0000000             -0.0001625        
  2    685.9000000             -0.0011233        
  3    156.5000000             -0.0054882        
  4     44.4700000             -0.0219811        
  5     14.4800000             -0.0598059        
  6      5.1310000             -0.1388011        
  7      1.8980000             -0.1312193        
  8      0.3329000              0.5399343        
S   1
  1      0.1043000              1.0000000        
S   1
  1      3.0660000              1.0000000        
S   1
  1      0.0310500              1.0000000        
P   3
  1      6.0010000              0.0355071        
  2      1.2410000              0.1980586        
  3      0.3364000              0.5051304        
P   1
  1      0.0953800              1.0000000        
P   1
  1      9.9400000              1.0000000        
P   1
  1      0.0237800              1.0000000        
D   1
  1      0.3430000              1.0000000        
D   1
  1      0.0904000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: C
data:
CARBON
S   8
  1   6665.0000000              0.0008517        
  2   1000.0000000              0.0055121        
  3    228.0000000              0.0273690        
  4     64.7100000              0.1020568        
  5     21.0600000              0.2749479        
  6      7.4950000              0.4483409        
  7      2.7970000              0.2847131        
  8      0.5215000              0.0151750        
S   8
  1   6665.0000000             -0.0001803        
  2   1000.0000000             -0.0011949        
  3    228.0000000             -0.0057943        
  4     64.7100000             -0.0234166        
  5     21.0600000             -0.0640500        
  6      7.4950000             -0.1500919        
  7      2.7970000             -0.1268376        
  8      0.5215000              0.5451602        
S   1
  1      0.1596000              1.0000000        
S   1
  1      4.5300000              1.0000000        
S   1
  1      0.0469000              1.0000000        
P   3
  1      9.4390000              0.0381635        
  2      2.0020000              0.2094925        
  3      0.5456000              0.5084477        
P   1
  1      0.1517000              1.0000000        
P   1
  1     14.5570000              1.0000000        
P   1
  1      0.0404100              1.0000000        
D   1
  1      0.5500000              1.0000000        
D   1
  1      0.1510000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: N
data:
NITROGEN
S   8
  1   9046.0000000              0.0009106        
  2   1357.0000000              0.0056444        
  3    309.3000000              0.0278072        
  4     87.7300000              0.1036805        
  5     28.5600000              0.2790142        
  6     10.2100000              0.4482216        
  7      3.8380000              0.2777373        
  8      0.7466000              0.0153993        
S   8
  1   9046.0000000             -0.0001995        
  2   1357.0000000             -0.0012669        
  3    309.3000000             -0.0060906        
  4     87.7300000             -0.0246970        
  5     28.5600000             -0.0676028        
  6     10.2100000             -0.1582335        
  7      3.8380000             -0.1212060        
  8      0.7466000              0.5498871        
S   1
  1      0.2248000              1.0000000        
S   1
  1      6.2330000              1.0000000        
S   1
  1      0.0612400              1.0000000        
P   3
  1     13.5500000              0.0400103        
  2      2.9170000              0.2172132        
  3      0.7973000              0.5101907        
P   1
  1      0.2185000              1.0000000        
P   1
  1     19.9770000              1.0000000        
P   1
  1      0.0561100              1.0000000        
D   1
  1      0.8170000              1.0000000        
D   1
  1      0.2300000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: O
data:
OXYGEN
S   8
  1  11720.0000000              0.0009775        
  2   1759.0000000              0.0058106        
  3    400.8000000              0.0283649        
  4    113.7000000              0.1054311        
  5     37.0300000              0.2834470        
  6     13.2700000              0.4482844        
  7      5.0250000              0.2702944        
  8      1.0130000              0.0154031        
S   8
  1  11720.0000000             -0.0002206        
  2   1759.0000000             -0.0013435        
  3    400.8000000             -0.0064010        
  4    113.7000000             -0.0259275        
  5     37.0300000             -0.0711286        
  6     13.2700000             -0.1656153        
  7      5.0250000             -0.1160807        
  8      1.0130000              0.5585241        
S   1
  1      0.3023000              1.0000000        
S   1
  1      8.2150000              1.0000000        
S   1
  1      0.0789600              1.0000000        
P   3
  1     17.7000000              0.0431553        
  2      3.8540000              0.2289863        
  3      1.0460000              0.5086083        
P   1
  1      0.2753000              1.0000000        
P   1
  1     26.0560000              1.0000000        
P   1
  1      0.0685600              1.0000000        
D   1
  1      1.1850000              1.0000000        
D   1
  1      0.3320000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: F
data:
FLUORINE
S   8
  1  14710.0000000              0.0010485        
  2   2207.0000000              0.0059913        
  3    502.8000000              0.0289399        
  4    142.6000000              0.1072562        
  5     46.4700000              0.2873039        
  6     16.7000000              0.4480684        
  7      6.3560000              0.2639263        
  8      1.3160000              0.0152658        
S   8
  1  14710.0000000             -0.0002416        
  2   2207.0000000             -0.0014140        
  3    502.8000000             -0.0066702        
  4    142.6000000             -0.0269705        
  5     46.4700000             -0.0739670        
  6     16.7000000             -0.1710341        
  7      6.3560000             -0.1111695        
  8      1.3160000              0.5643084        
S   1
  1      0.3897000              1.0000000        
S   1
  1     10.4260000              1.0000000        
S   1
  1      0.0986300              1.0000000        
P   3
  1     22.6700000              0.0450688        
  2      4.9770000              0.2358286        
  3      1.3470000              0.5083765        
P   1
  1      0.3471000              1.0000000        
P   1
  1     32.8300000              1.0000000        
P   1
  1      0.0850200              1.0000000        
D   1
  1      1.6400000              1.0000000        
D   1
  1      0.4640000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ne
data:
NEON
S   8
  1  17880.0000000              0.0011307        
  2   2683.0000000              0.0062267        
  3    611.5000000              0.0297204        
  4    173.5000000              0.1095553        
  5     56.6400000              0.2915077        
  6     20.4200000              0.4475884        
  7      7.8100000              0.2570002        
  8      1.6530000              0.0149818        
S   8
  1  17880.0000000             -0.0002646        
  2   2683.0000000             -0.0014920        
  3    611.5000000             -0.0069592        
  4    173.5000000             -0.0280213        
  5     56.6400000             -0.0765658        
  6     20.4200000             -0.1755371        
  7      7.8100000             -0.1055539        
  8      1.6530000              0.5688922        
S   1
  1      0.4869000              1.0000000        
S   1
  1     12.8540000              1.0000000        
S   1
  1      0.1230000              1.0000000        
P   3
  1     28.3900000              0.0463396        
  2      6.2700000              0.2403369        
  3      1.6950000              0.5085722        
P   1
  1      0.4317000              1.0000000        
P   1
  1     40.1840000              1.0000000        
P   1
  1      0.1064000              1.0000000        
D   1
  1      2.2020000              1.0000000        
D   1
  1      0.6310000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Na
data:
SODIUM
S   11
  1  31700.0000000              0.0008311        
  2   4755.0000000              0.0041340        
  3   1082.0000000              0.0191397        
  4    306.4000000              0.0728293        
  5     99.5300000              0.2133784        
  6     35.4200000              0.4159265        
  7     13.3000000              0.3715352        
  8      4.3920000              0.0621051        
  9      1.6760000             -0.0061919        
 10      0.5889000              0.0024142        
 11      0.0564000             -0.0004383        
S   11
  1  31700.0000000             -0.0002038        
  2   4755.0000000             -0.0010156        
  3   1082.0000000             -0.0047499        
  4    306.4000000             -0.0185222        
  5     99.5300000             -0.0585794        
  6     35.4200000             -0.1380784        
  7     13.3000000             -0.1930778        
  8      4.3920000              0.0879880        
  9      1.6760000              0.6050688        
 10      0.5889000              0.4394039        
 11      0.0564000              0.0128079        
S   11
  1  31700.0000000              0.0000309        
  2   4755.0000000              0.0001529        
  3   1082.0000000              0.0007238        
  4    306.4000000              0.0027815        
  5     99.5300000              0.0090308        
  6     35.4200000              0.0208612        
  7     13.3000000              0.0317768        
  8      4.3920000             -0.0194200        
  9      1.6760000             -0.1031810        
 10      0.5889000             -0.1979506        
 11      0.0564000              0.6591622        
S   1
  1      0.0230700              1.0000000        
S   1
  1      0.7040000              1.0000000        
S   1
  1      0.0072500              1.0000000        
P   7
  1    138.1000000              0.0059396        
  2     32.2400000              0.0418154        
  3      9.9850000              0.1631422        
  4      3.4840000              0.3593556        
  5      1.2310000              0.4497397        
  6      0.4177000              0.2275315        
  7      0.0651300              0.0081254        
P   7
  1    138.1000000             -0.0005957        
  2     32.2400000             -0.0040976        
  3      9.9850000             -0.0168211        
  4      3.4840000             -0.0353193        
  5      1.2310000             -0.0521735        
  6      0.4177000             -0.0168239        
  7      0.0651300              0.4346322        
P   1
  1      0.0205300              1.0000000        
P   1
  1      0.7610000              1.0000000        
P   1
  1      0.0063300              1.0000000        
D   1
  1      0.0973000              1.0000000        
D   1
  1      2.9490000              1.0000000        
D   1
  1      0.0468000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   11
  1  47390.0000000              0.0007178        
  2   7108.0000000              0.0033145        
  3   1618.0000000              0.0147967        
  4    458.4000000              0.0564860        
  5    149.3000000              0.1710009        
  6     53.5900000              0.3648575        
  7     20.7000000              0.4052922        
  8      8.3840000              0.1341815        
  9      2.5420000              0.0048781        
 10      0.8787000              0.0002821        
 11      0.1077000              0.0000277        
S   11
  1  47390.0000000             -0.0001825        
  2   7108.0000000             -0.0008391        
  3   1618.0000000             -0.0038204        
  4    458.4000000             -0.0146306        
  5    149.3000000             -0.0482828        
  6     53.5900000             -0.1154055        
  7     20.7000000             -0.2004640        
  8      8.3840000             -0.0317073        
  9      2.5420000              0.5725837        
 10      0.8787000              0.5391743        
 11      0.1077000              0.0214564        
S   11
  1  47390.0000000              0.0000352        
  2   7108.0000000              0.0001616        
  3   1618.0000000              0.0007401        
  4    458.4000000              0.0028164        
  5    149.3000000              0.0094299        
  6     53.5900000              0.0224423        
  7     20.7000000              0.0410435        
  8      8.3840000              0.0050180        
  9      2.5420000             -0.1350467        
 10      0.8787000             -0.2547294        
 11      0.1077000              0.6092437        
S   1
  1      0.0399900              1.0000000        
S   1
  1      3.4220000              1.0000000        
S   1
  1      0.0148800              1.0000000        
P   7
  1    179.9000000              0.0055546        
  2     42.1400000              0.0395455        
  3     13.1300000              0.1578179        
  4      4.6280000              0.3585344        
  5      1.6700000              0.4569075        
  6      0.5857000              0.2158495        
  7      0.1311000              0.0067001        
P   7
  1    179.9000000             -0.0008908        
  2     42.1400000             -0.0061865        
  3     13.1300000             -0.0261337        
  4      4.6280000             -0.0568221        
  5      1.6700000             -0.0871624        
  6      0.5857000             -0.0121730        
  7      0.1311000              0.4982604        
P   1
  1      0.0411200              1.0000000        
P   1
  1      8.2790000              1.0000000        
P   1
  1      0.0093500              1.0000000        
D   1
  1      0.1870000              1.0000000        
D   1
  1      3.7040000              1.0000000        
D   1
  1      0.0595000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   11
  1  64150.0000000              0.0006736        
  2   9617.0000000              0.0029457        
  3   2189.0000000              0.0127173        
  4    620.5000000              0.0482122        
  5    202.7000000              0.1479148        
  6     73.1500000              0.3307763        
  7     28.5500000              0.4142651        
  8     11.7700000              0.1878554        
  9      3.3000000              0.0114868        
 10      1.1730000             -0.0012718        
 11      0.1752000              0.0004225        
S   11
  1  64150.0000000             -0.0001763        
  2   9617.0000000             -0.0007667        
  3   2189.0000000             -0.0033824        
  4    620.5000000             -0.0127779        
  5    202.7000000             -0.0426908        
  6     73.1500000             -0.1039923        
  7     28.5500000             -0.1964148        
  8     11.7700000             -0.0801420        
  9      3.3000000              0.5440095        
 10      1.1730000              0.5750364        
 11      0.1752000              0.0282815        
S   11
  1  64150.0000000              0.0000407        
  2   9617.0000000              0.0001769        
  3   2189.0000000              0.0007821        
  4    620.5000000              0.0029518        
  5    202.7000000              0.0099318        
  6     73.1500000              0.0243442        
  7     28.5500000              0.0474816        
  8     11.7700000              0.0197081        
  9      3.3000000             -0.1602974        
 10      1.1730000             -0.3096187        
 11      0.1752000              0.6239180        
S   1
  1      0.0647300              1.0000000        
S   1
  1      4.0300000              1.0000000        
S   1
  1      0.0231000              1.0000000        
P   7
  1    258.8000000              0.0042537        
  2     60.8900000              0.0310267        
  3     19.1400000              0.1296450        
  4      6.8810000              0.3209730        
  5      2.5740000              0.4534894        
  6      0.9572000              0.2747866        
  7      0.2099000              0.0191205        
P   7
  1    258.8000000             -0.0007811        
  2     60.8900000             -0.0055179        
  3     19.1400000             -0.0246142        
  4      6.8810000             -0.0581875        
  5      2.5740000             -0.0982407        
  6      0.9572000             -0.0258070        
  7      0.2099000              0.4633873        
P   1
  1      0.0598600              1.0000000        
P   1
  1      1.5290000              1.0000000        
P   1
  1      0.0153000              1.0000000        
D   1
  1      0.1890000              1.0000000        
D   1
  1      4.7250000              1.0000000        
D   1
  1      0.0535000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Si
data:
SILICON
S   11
  1  78860.0000000              0.0006815        
  2  11820.0000000              0.0028736        
  3   2692.0000000              0.0120698        
  4    763.4000000              0.0453586        
  5    249.6000000              0.1395458        
  6     90.2800000              0.3173537        
  7     35.2900000              0.4168447        
  8     14.5100000              0.2084412        
  9      4.0530000              0.0143428        
 10      1.4820000             -0.0020126        
 11      0.2517000              0.0006174        
S   11
  1  78860.0000000             -0.0001827        
  2  11820.0000000             -0.0007666        
  3   2692.0000000             -0.0032882        
  4    763.4000000             -0.0123094        
  5    249.6000000             -0.0411277        
  6     90.2800000             -0.1013628        
  7     35.2900000             -0.1967629        
  8     14.5100000             -0.0990262        
  9      4.0530000              0.5309218        
 10      1.4820000              0.5887603        
 11      0.2517000              0.0325794        
S   11
  1  78860.0000000              0.0000468        
  2  11820.0000000              0.0001964        
  3   2692.0000000              0.0008420        
  4    763.4000000              0.0031628        
  5    249.6000000              0.0105819        
  6     90.2800000              0.0264728        
  7     35.2900000              0.0524161        
  8     14.5100000              0.0282323        
  9      4.0530000             -0.1800982        
 10      1.4820000             -0.3441170        
 11      0.2517000              0.6275986        
S   1
  1      0.0924300              1.0000000        
S   1
  1      4.9590000              1.0000000        
S   1
  1      0.0332000              1.0000000        
P   7
  1    315.9000000              0.0041444        
  2     74.4200000              0.0302971        
  3     23.4800000              0.1278303        
  4      8.4880000              0.3211623        
  5      3.2170000              0.4550327        
  6      1.2290000              0.2681699        
  7      0.2964000              0.0188480        
P   7
  1    315.9000000             -0.0009048        
  2     74.4200000             -0.0063916        
  3     23.4800000             -0.0289531        
  4      8.4880000             -0.0694552        
  5      3.2170000             -0.1193365        
  6      1.2290000             -0.0196342        
  7      0.2964000              0.5098641        
P   1
  1      0.0876800              1.0000000        
P   1
  1      1.9980000              1.0000000        
P   1
  1      0.0250000              1.0000000        
D   1
  1      0.2750000              1.0000000        
D   1
  1      5.8060000              1.0000000        
D   1
  1      0.0823000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   11
  1  94840.0000000              0.0006956        
  2  14220.0000000              0.0028421        
  3   3236.0000000              0.0116561        
  4    917.1000000              0.0433935        
  5    299.5000000              0.1341765        
  6    108.1000000              0.3095842        
  7     42.1800000              0.4187323        
  8     17.2800000              0.2207409        
  9      4.8580000              0.0162017        
 10      1.8180000             -0.0025086        
 11      0.3372000              0.0007383        
S   11
  1  94840.0000000             -0.0001903        
  2  14220.0000000             -0.0007743        
  3   3236.0000000             -0.0032408        
  4    917.1000000             -0.0120211        
  5    299.5000000             -0.0402672        
  6    108.1000000             -0.1005414        
  7     42.1800000             -0.1983197        
  8     17.2800000             -0.1109545        
  9      4.8580000              0.5231147        
 10      1.8180000              0.5965584        
 11      0.3372000              0.0360259        
S   11
  1  94840.0000000              0.0000523        
  2  14220.0000000              0.0002129        
  3   3236.0000000              0.0008890        
  4    917.1000000              0.0033187        
  5    299.5000000              0.0110884        
  6    108.1000000              0.0282751        
  7     42.1800000              0.0564463        
  8     17.2800000              0.0347289        
  9      4.8580000             -0.1961133        
 10      1.8180000             -0.3685818        
 11      0.3372000              0.6296116        
S   1
  1      0.1232000              1.0000000        
S   1
  1      5.9770000              1.0000000        
S   1
  1      0.0417000              1.0000000        
P   7
  1    370.5000000              0.0042075        
  2     87.3300000              0.0307497        
  3     27.5900000              0.1303114        
  4     10.0000000              0.3278826        
  5      3.8250000              0.4565077        
  6      1.4940000              0.2525705        
  7      0.3921000              0.0168823        
P   7
  1    370.5000000             -0.0010213        
  2     87.3300000             -0.0072319        
  3     27.5900000             -0.0328950        
  4     10.0000000             -0.0796019        
  5      3.8250000             -0.1348259        
  6      1.4940000             -0.0086235        
  7      0.3921000              0.5375353        
P   1
  1      0.1186000              1.0000000        
P   1
  1      2.5240000              1.0000000        
P   1
  1      0.0343000              1.0000000        
D   1
  1      0.3730000              1.0000000        
D   1
  1      7.0200000              1.0000000        
D   1
  1      0.1130000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: S
data:
SULFUR
S   11
  1 110800.0000000              0.0007215        
  2  16610.0000000              0.0028720        
  3   3781.0000000              0.0115194        
  4   1071.0000000              0.0424617        
  5    349.8000000              0.1311104        
  6    126.3000000              0.3046040        
  7     49.2600000              0.4193121        
  8     20.1600000              0.2282718        
  9      5.7200000              0.0176436        
 10      2.1820000             -0.0029299        
 11      0.4327000              0.0008367        
S   11
  1 110800.0000000             -0.0002010        
  2  16610.0000000             -0.0007969        
  3   3781.0000000             -0.0032599        
  4   1071.0000000             -0.0119806        
  5    349.8000000             -0.0400080        
  6    126.3000000             -0.1005679        
  7     49.2600000             -0.2001709        
  8     20.1600000             -0.1188477        
  9      5.7200000              0.5185418        
 10      2.1820000              0.6009686        
 11      0.4327000              0.0386850        
S   11
  1 110800.0000000              0.0000583        
  2  16610.0000000              0.0002317        
  3   3781.0000000              0.0009442        
  4   1071.0000000              0.0035003        
  5    349.8000000              0.0116247        
  6    126.3000000              0.0299867        
  7     49.2600000              0.0600636        
  8     20.1600000              0.0399813        
  9      5.7200000             -0.2109019        
 10      2.1820000             -0.3885008        
 11      0.4327000              0.6389962        
S   1
  1      0.1570000              1.0000000        
S   1
  1      7.0830000              1.0000000        
S   1
  1      0.0507000              1.0000000        
P   7
  1    399.7000000              0.0047937        
  2     94.1900000              0.0347928        
  3     29.7500000              0.1451669        
  4     10.7700000              0.3542203        
  5      4.1190000              0.4584235        
  6      1.6250000              0.2058117        
  7      0.4726000              0.0102234        
P   7
  1    399.7000000             -0.0012442        
  2     94.1900000             -0.0088187        
  3     29.7500000             -0.0393306        
  4     10.7700000             -0.0934934        
  5      4.1190000             -0.1477061        
  6      1.6250000              0.0308319        
  7      0.4726000              0.5613096        
P   1
  1      0.1407000              1.0000000        
P   1
  1      3.0890000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   1
  1      0.4790000              1.0000000        
D   1
  1      8.3630000              1.0000000        
D   1
  1      0.1520000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   11
  1 127900.0000000              0.0007497        
  2  19170.0000000              0.0029170        
  3   4363.0000000              0.0114534        
  4   1236.0000000              0.0417491        
  5    403.6000000              0.1287741        
  6    145.7000000              0.3006785        
  7     56.8100000              0.4195476        
  8     23.2300000              0.2342971        
  9      6.6440000              0.0188435        
 10      2.5750000             -0.0032902        
 11      0.5371000              0.0009137        
S   11
  1 127900.0000000             -0.0002120        
  2  19170.0000000             -0.0008223        
  3   4363.0000000             -0.0032917        
  4   1236.0000000             -0.0119686        
  5    403.6000000             -0.0398788        
  6    145.7000000             -0.1007232        
  7     56.8100000             -0.2019238        
  8     23.2300000             -0.1251436        
  9      6.6440000              0.5156793        
 10      2.5750000              0.6036405        
 11      0.5371000              0.0409998        
S   11
  1 127900.0000000              0.0000641        
  2  19170.0000000              0.0002493        
  3   4363.0000000              0.0009932        
  4   1236.0000000              0.0036490        
  5    403.6000000              0.0120657        
  6    145.7000000              0.0313839        
  7     56.8100000              0.0630662        
  8     23.2300000              0.0444061        
  9      6.6440000             -0.2234945        
 10      2.5750000             -0.4034348        
 11      0.5371000              0.6454547        
S   1
  1      0.1938000              1.0000000        
S   1
  1      8.2730000              1.0000000        
S   1
  1      0.0608000              1.0000000        
P   7
  1    417.6000000              0.0056562        
  2     98.3300000              0.0406072        
  3     31.0400000              0.1657433        
  4     11.1900000              0.3875622        
  5      4.2490000              0.4561525        
  6      1.6240000              0.1510753        
  7      0.5322000              0.0018524        
P   7
  1    417.6000000             -0.0015435        
  2     98.3300000             -0.0109957        
  3     31.0400000             -0.0473146        
  4     11.1900000             -0.1110564        
  5      4.2490000             -0.1527934        
  6      1.6240000              0.0902488        
  7      0.5322000              0.5790746        
P   1
  1      0.1620000              1.0000000        
P   1
  1      3.6970000              1.0000000        
P   1
  1      0.0466000              1.0000000        
D   1
  1      0.6000000              1.0000000        
D   1
  1      9.8440000              1.0000000        
D   1
  1      0.1960000              1.0000000


name: aug-cc-pCVDZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ar
data:
ARGON
S   11
  1 145700.0000000              0.0007819        
  2  21840.0000000              0.0029793        
  3   4972.0000000              0.0114728        
  4   1408.0000000              0.0413528        
  5    459.7000000              0.1272786        
  6    165.9000000              0.2980274        
  7     64.6900000              0.4194869        
  8     26.4400000              0.2383968        
  9      7.6280000              0.0196834        
 10      2.9960000             -0.0035396        
 11      0.6504000              0.0009560        
S   11
  1 145700.0000000             -0.0002242        
  2  21840.0000000             -0.0008517        
  3   4972.0000000             -0.0033425        
  4   1408.0000000             -0.0120238        
  5    459.7000000             -0.0399435        
  6    165.9000000             -0.1011846        
  7     64.6900000             -0.2037182        
  8     26.4400000             -0.1297272        
  9      7.6280000              0.5143673        
 10      2.9960000              0.6048173        
 11      0.6504000              0.0429665        
S   11
  1 145700.0000000              0.0000700        
  2  21840.0000000              0.0002668        
  3   4972.0000000              0.0010416        
  4   1408.0000000              0.0037904        
  5    459.7000000              0.0124761        
  6    165.9000000              0.0326374        
  7     64.6900000              0.0656755        
  8     26.4400000              0.0480165        
  9      7.6280000             -0.2347575        
 10      2.9960000             -0.4146406        
 11      0.6504000              0.6501973        
S   1
  1      0.2337000              1.0000000        
S   1
  1      9.5480000              1.0000000        
S   1
  1      0.0709000              1.0000000        
P   7
  1    453.7000000              0.0061759        
  2    106.8000000              0.0439690        
  3     33.7300000              0.1778638        
  4     12.1300000              0.4070852        
  5      4.5940000              0.4513756        
  6      1.6780000              0.1222191        
  7      0.5909000             -0.0043985        
P   7
  1    453.7000000             -0.0017393        
  2    106.8000000             -0.0124412        
  3     33.7300000             -0.0524542        
  4     12.1300000             -0.1237693        
  5      4.5940000             -0.1509115        
  6      1.6780000              0.1433727        
  7      0.5909000              0.5839918        
P   1
  1      0.1852000              1.0000000        
P   1
  1      4.3610000              1.0000000        
P   1
  1      0.0533000              1.0000000        
D   1
  1      0.7380000              1.0000000        
D   1
  1     11.4590000              1.0000000        
D   1
  1      0.2400000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   6601.0000000              0.0001170        
  2    989.7000000              0.0009110        
  3    225.7000000              0.0047280        
  4     64.2900000              0.0191970        
  5     21.1800000              0.0630470        
  6      7.7240000              0.1632080        
  7      3.0030000              0.3148270        
  8      1.2120000              0.3939360        
  9      0.4930000              0.1969180        
S   9
  1   6601.0000000             -0.0000180        
  2    989.7000000             -0.0001420        
  3    225.7000000             -0.0007410        
  4     64.2900000             -0.0030200        
  5     21.1800000             -0.0101230        
  6      7.7240000             -0.0270940        
  7      3.0030000             -0.0573590        
  8      1.2120000             -0.0938950        
  9      0.4930000             -0.1210910        
S   1
  1      0.0951500              1.0000000        
S   1
  1      0.0479100              1.0000000        
S   1
  1      0.0222000              1.0000000        
S   1
  1      5.6140000              1.0000000        
S   1
  1      1.8600000              1.0000000        
S   1
  1      0.6160000              1.0000000        
S   1
  1      0.0063600              1.0000000        
P   3
  1      6.2500000              0.0033880        
  2      1.3700000              0.0193160        
  3      0.3672000              0.0791040        
P   1
  1      0.1192000              1.0000000        
P   1
  1      0.0447400              1.0000000        
P   1
  1      0.0179500              1.0000000        
P   1
  1      9.7850000              1.0000000        
P   1
  1      2.5930000              1.0000000        
P   1
  1      0.6870000              1.0000000        
P   1
  1      0.0075600              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1      0.1530000              1.0000000        
D   1
  1      0.0680000              1.0000000        
D   1
  1     10.6020000              1.0000000        
D   1
  1      3.0660000              1.0000000        
D   1
  1      0.0266000              1.0000000        
F   1
  1      0.2460000              1.0000000        
F   1
  1      0.1292000              1.0000000        
F   1
  1      6.6830000              1.0000000        
F   1
  1      0.0552000              1.0000000        
G   1
  1      0.2380000              1.0000000        
G   1
  1      0.1050000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1  14630.0000000              0.0000920        
  2   2191.0000000              0.0007130        
  3    498.2000000              0.0037350        
  4    140.9000000              0.0154680        
  5     45.8600000              0.0528740        
  6     16.4700000              0.1456940        
  7      6.3190000              0.3026810        
  8      2.5350000              0.4049360        
  9      1.0350000              0.2223870        
S   9
  1  14630.0000000             -0.0000170        
  2   2191.0000000             -0.0001300        
  3    498.2000000             -0.0006790        
  4    140.9000000             -0.0028570        
  5     45.8600000             -0.0098130        
  6     16.4700000             -0.0286090        
  7      6.3190000             -0.0637600        
  8      2.5350000             -0.1172310        
  9      1.0350000             -0.1212020        
S   1
  1      0.2528000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0426100              1.0000000        
S   1
  1     21.7260000              1.0000000        
S   1
  1      7.8660000              1.0000000        
S   1
  1      2.8480000              1.0000000        
S   1
  1      0.0143900              1.0000000        
P   3
  1     14.0300000              0.0040990        
  2      3.1680000              0.0256260        
  3      0.9024000              0.1037680        
P   1
  1      0.3036000              1.0000000        
P   1
  1      0.1130000              1.0000000        
P   1
  1      0.0428600              1.0000000        
P   1
  1     30.8980000              1.0000000        
P   1
  1     10.3650000              1.0000000        
P   1
  1      3.4770000              1.0000000        
P   1
  1      0.0065000              1.0000000        
D   1
  1      1.0720000              1.0000000        
D   1
  1      0.4410000              1.0000000        
D   1
  1      0.1811000              1.0000000        
D   1
  1     30.3900000              1.0000000        
D   1
  1      6.0920000              1.0000000        
D   1
  1      0.0554000              1.0000000        
F   1
  1      0.4810000              1.0000000        
F   1
  1      0.2550000              1.0000000        
F   1
  1     12.4820000              1.0000000        
F   1
  1      0.0930000              1.0000000        
G   1
  1      0.4150000              1.0000000        
G   1
  1      0.1834000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: B
data:
BORON
S   9
  1  23870.0000000              0.0000880        
  2   3575.0000000              0.0006870        
  3    812.8000000              0.0036000        
  4    229.7000000              0.0149490        
  5     74.6900000              0.0514350        
  6     26.8100000              0.1433020        
  7     10.3200000              0.3009350        
  8      4.1780000              0.4035260        
  9      1.7270000              0.2253400        
S   9
  1  23870.0000000             -0.0000180        
  2   3575.0000000             -0.0001390        
  3    812.8000000             -0.0007250        
  4    229.7000000             -0.0030630        
  5     74.6900000             -0.0105810        
  6     26.8100000             -0.0313650        
  7     10.3200000             -0.0710120        
  8      4.1780000             -0.1321030        
  9      1.7270000             -0.1230720        
S   1
  1      0.4704000              1.0000000        
S   1
  1      0.1896000              1.0000000        
S   1
  1      0.0739400              1.0000000        
S   1
  1      4.8640000              1.0000000        
S   1
  1     13.2880000              1.0000000        
S   1
  1     36.3040000              1.0000000        
S   1
  1      0.0272100              1.0000000        
P   3
  1     22.2600000              0.0050950        
  2      5.0580000              0.0332060        
  3      1.4870000              0.1323140        
P   1
  1      0.5071000              1.0000000        
P   1
  1      0.1812000              1.0000000        
P   1
  1      0.0646300              1.0000000        
P   1
  1      5.4890000              1.0000000        
P   1
  1     16.3020000              1.0000000        
P   1
  1     48.4180000              1.0000000        
P   1
  1      0.0187800              1.0000000        
D   1
  1      1.1100000              1.0000000        
D   1
  1      0.4020000              1.0000000        
D   1
  1      0.1450000              1.0000000        
D   1
  1      6.6400000              1.0000000        
D   1
  1     24.4620000              1.0000000        
D   1
  1      0.0466000              1.0000000        
F   1
  1      0.8820000              1.0000000        
F   1
  1      0.3110000              1.0000000        
F   1
  1     18.7940000              1.0000000        
F   1
  1      0.1130000              1.0000000        
G   1
  1      0.6730000              1.0000000        
G   1
  1      0.2730000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: C
data:
CARBON
S   9
  1  33980.0000000              0.0000910        
  2   5089.0000000              0.0007040        
  3   1157.0000000              0.0036930        
  4    326.6000000              0.0153600        
  5    106.1000000              0.0529290        
  6     38.1100000              0.1470430        
  7     14.7500000              0.3056310        
  8      6.0350000              0.3993450        
  9      2.5300000              0.2170510        
S   9
  1  33980.0000000             -0.0000190        
  2   5089.0000000             -0.0001510        
  3   1157.0000000             -0.0007850        
  4    326.6000000             -0.0033240        
  5    106.1000000             -0.0115120        
  6     38.1100000             -0.0341600        
  7     14.7500000             -0.0771730        
  8      6.0350000             -0.1414930        
  9      2.5300000             -0.1180190        
S   1
  1      0.7355000              1.0000000        
S   1
  1      0.2905000              1.0000000        
S   1
  1      0.1111000              1.0000000        
S   1
  1      7.2160000              1.0000000        
S   1
  1     19.5700000              1.0000000        
S   1
  1     53.0730000              1.0000000        
S   1
  1      0.0414500              1.0000000        
P   3
  1     34.5100000              0.0053780        
  2      7.9150000              0.0361320        
  3      2.3680000              0.1424930        
P   1
  1      0.8132000              1.0000000        
P   1
  1      0.2890000              1.0000000        
P   1
  1      0.1007000              1.0000000        
P   1
  1      8.1820000              1.0000000        
P   1
  1     24.1860000              1.0000000        
P   1
  1     71.4940000              1.0000000        
P   1
  1      0.0321800              1.0000000        
D   1
  1      1.8480000              1.0000000        
D   1
  1      0.6490000              1.0000000        
D   1
  1      0.2280000              1.0000000        
D   1
  1      8.6560000              1.0000000        
D   1
  1     33.2130000              1.0000000        
D   1
  1      0.0766000              1.0000000        
F   1
  1      1.4190000              1.0000000        
F   1
  1      0.4850000              1.0000000        
F   1
  1     24.6940000              1.0000000        
F   1
  1      0.1870000              1.0000000        
G   1
  1      1.0110000              1.0000000        
G   1
  1      0.4240000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: N
data:
NITROGEN
S   9
  1  45840.0000000              0.0000920        
  2   6868.0000000              0.0007170        
  3   1563.0000000              0.0037490        
  4    442.4000000              0.0155320        
  5    144.3000000              0.0531460        
  6     52.1800000              0.1467870        
  7     20.3400000              0.3046630        
  8      8.3810000              0.3976840        
  9      3.5290000              0.2176410        
S   9
  1  45840.0000000             -0.0000200        
  2   6868.0000000             -0.0001590        
  3   1563.0000000             -0.0008240        
  4    442.4000000             -0.0034780        
  5    144.3000000             -0.0119660        
  6     52.1800000             -0.0353880        
  7     20.3400000             -0.0800770        
  8      8.3810000             -0.1467220        
  9      3.5290000             -0.1163600        
S   1
  1      1.0540000              1.0000000        
S   1
  1      0.4118000              1.0000000        
S   1
  1      0.1552000              1.0000000        
S   1
  1      9.8620000              1.0000000        
S   1
  1     26.6270000              1.0000000        
S   1
  1     71.8940000              1.0000000        
S   1
  1      0.0546400              1.0000000        
P   3
  1     49.3300000              0.0055330        
  2     11.3700000              0.0379620        
  3      3.4350000              0.1490280        
P   1
  1      1.1820000              1.0000000        
P   1
  1      0.4173000              1.0000000        
P   1
  1      0.1428000              1.0000000        
P   1
  1     11.3200000              1.0000000        
P   1
  1     33.3490000              1.0000000        
P   1
  1     98.2450000              1.0000000        
P   1
  1      0.0440200              1.0000000        
D   1
  1      2.8370000              1.0000000        
D   1
  1      0.9680000              1.0000000        
D   1
  1      0.3350000              1.0000000        
D   1
  1     11.8280000              1.0000000        
D   1
  1     45.2180000              1.0000000        
D   1
  1      0.1110000              1.0000000        
F   1
  1      2.0270000              1.0000000        
F   1
  1      0.6850000              1.0000000        
F   1
  1     28.3640000              1.0000000        
F   1
  1      0.2450000              1.0000000        
G   1
  1      1.4270000              1.0000000        
G   1
  1      0.5590000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: O
data:
OXYGEN
S   9
  1  61420.0000000              0.0000900        
  2   9199.0000000              0.0006980        
  3   2091.0000000              0.0036640        
  4    590.9000000              0.0152180        
  5    192.3000000              0.0524230        
  6     69.3200000              0.1459210        
  7     26.9700000              0.3052580        
  8     11.1000000              0.3985080        
  9      4.6820000              0.2169800        
S   9
  1  61420.0000000             -0.0000200        
  2   9199.0000000             -0.0001590        
  3   2091.0000000             -0.0008290        
  4    590.9000000             -0.0035080        
  5    192.3000000             -0.0121560        
  6     69.3200000             -0.0362610        
  7     26.9700000             -0.0829920        
  8     11.1000000             -0.1520900        
  9      4.6820000             -0.1153310        
S   1
  1      1.4280000              1.0000000        
S   1
  1      0.5547000              1.0000000        
S   1
  1      0.2067000              1.0000000        
S   1
  1     12.9740000              1.0000000        
S   1
  1     34.9000000              1.0000000        
S   1
  1     93.8810000              1.0000000        
S   1
  1      0.0695900              1.0000000        
P   3
  1     63.4200000              0.0060440        
  2     14.6600000              0.0417990        
  3      4.4590000              0.1611430        
P   1
  1      1.5310000              1.0000000        
P   1
  1      0.5302000              1.0000000        
P   1
  1      0.1750000              1.0000000        
P   1
  1     14.4750000              1.0000000        
P   1
  1     42.7300000              1.0000000        
P   1
  1    126.1400000              1.0000000        
P   1
  1      0.0534800              1.0000000        
D   1
  1      3.7750000              1.0000000        
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.4440000              1.0000000        
D   1
  1     14.9270000              1.0000000        
D   1
  1     57.5440000              1.0000000        
D   1
  1      0.1540000              1.0000000        
F   1
  1      2.6660000              1.0000000        
F   1
  1      0.8590000              1.0000000        
F   1
  1     26.4830000              1.0000000        
F   1
  1      0.3240000              1.0000000        
G   1
  1      1.8460000              1.0000000        
G   1
  1      0.7140000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: F
data:
FLUORINE
S   9
  1  74530.0000000              0.0000950        
  2  11170.0000000              0.0007380        
  3   2543.0000000              0.0038580        
  4    721.0000000              0.0159260        
  5    235.9000000              0.0542890        
  6     85.6000000              0.1495130        
  7     33.5500000              0.3082520        
  8     13.9300000              0.3948530        
  9      5.9150000              0.2110310        
S   9
  1  74530.0000000             -0.0000220        
  2  11170.0000000             -0.0001720        
  3   2543.0000000             -0.0008910        
  4    721.0000000             -0.0037480        
  5    235.9000000             -0.0128620        
  6     85.6000000             -0.0380610        
  7     33.5500000             -0.0862390        
  8     13.9300000             -0.1558650        
  9      5.9150000             -0.1109140        
S   1
  1      1.8430000              1.0000000        
S   1
  1      0.7124000              1.0000000        
S   1
  1      0.2637000              1.0000000        
S   1
  1     16.3190000              1.0000000        
S   1
  1     43.7840000              1.0000000        
S   1
  1    117.4720000              1.0000000        
S   1
  1      0.0859400              1.0000000        
P   3
  1     80.3900000              0.0063470        
  2     18.6300000              0.0442040        
  3      5.6940000              0.1685140        
P   1
  1      1.9530000              1.0000000        
P   1
  1      0.6702000              1.0000000        
P   1
  1      0.2166000              1.0000000        
P   1
  1     18.1190000              1.0000000        
P   1
  1     53.5050000              1.0000000        
P   1
  1    158.0010000              1.0000000        
P   1
  1      0.0656800              1.0000000        
D   1
  1      5.0140000              1.0000000        
D   1
  1      1.7250000              1.0000000        
D   1
  1      0.5860000              1.0000000        
D   1
  1     18.9430000              1.0000000        
D   1
  1     72.7980000              1.0000000        
D   1
  1      0.2070000              1.0000000        
F   1
  1      3.5620000              1.0000000        
F   1
  1      1.1480000              1.0000000        
F   1
  1     25.1610000              1.0000000        
F   1
  1      0.4600000              1.0000000        
G   1
  1      2.3760000              1.0000000        
G   1
  1      0.9240000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ne
data:
NEON
S   9
  1  99920.0000000              0.0000860        
  2  14960.0000000              0.0006690        
  3   3399.0000000              0.0035180        
  4    958.9000000              0.0146670        
  5    311.2000000              0.0509620        
  6    111.7000000              0.1437440        
  7     43.3200000              0.3045620        
  8     17.8000000              0.4001050        
  9      7.5030000              0.2186440        
S   9
  1  99920.0000000             -0.0000200        
  2  14960.0000000             -0.0001580        
  3   3399.0000000             -0.0008240        
  4    958.9000000             -0.0035000        
  5    311.2000000             -0.0122330        
  6    111.7000000             -0.0370170        
  7     43.3200000             -0.0861130        
  8     17.8000000             -0.1583810        
  9      7.5030000             -0.1142880        
S   1
  1      2.3370000              1.0000000        
S   1
  1      0.9001000              1.0000000        
S   1
  1      0.3301000              1.0000000        
S   1
  1     20.1800000              1.0000000        
S   1
  1     54.0420000              1.0000000        
S   1
  1    144.7250000              1.0000000        
S   1
  1      0.1054000              1.0000000        
P   3
  1     99.6800000              0.0065660        
  2     23.1500000              0.0459790        
  3      7.1080000              0.1734190        
P   1
  1      2.4410000              1.0000000        
P   1
  1      0.8339000              1.0000000        
P   1
  1      0.2662000              1.0000000        
P   1
  1     22.2220000              1.0000000        
P   1
  1     65.6220000              1.0000000        
P   1
  1    193.7800000              1.0000000        
P   1
  1      0.0817800              1.0000000        
D   1
  1      6.4710000              1.0000000        
D   1
  1      2.2130000              1.0000000        
D   1
  1      0.7470000              1.0000000        
D   1
  1     23.6130000              1.0000000        
D   1
  1     90.1070000              1.0000000        
D   1
  1      0.2730000              1.0000000        
F   1
  1      4.6570000              1.0000000        
F   1
  1      1.5240000              1.0000000        
F   1
  1     28.8300000              1.0000000        
F   1
  1      0.6890000              1.0000000        
G   1
  1      2.9830000              1.0000000        
G   1
  1      1.2240000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Na
data:
SODIUM
S   16
  1 1224000.0000000             0.478894E-05     
  2 183200.0000000              0.372395E-04     
  3  41700.0000000              0.195831E-03     
  4  11810.0000000              0.826698E-03     
  5   3853.0000000              0.300251E-02     
  6   1391.0000000              0.970310E-02     
  7    542.5000000              0.282337E-01     
  8    224.9000000              0.732058E-01     
  9     97.9300000              0.162897E+00     
 10     44.3100000              0.288708E+00     
 11     20.6500000              0.346829E+00     
 12      9.7290000              0.206865E+00     
 13      4.2280000              0.328009E-01     
 14      1.9690000             -0.647736E-03     
 15      0.8890000              0.145878E-02     
 16      0.3964000             -0.178346E-03     
S   16
  1 1224000.0000000            -0.116958E-05     
  2 183200.0000000             -0.909110E-05     
  3  41700.0000000             -0.478499E-04     
  4  11810.0000000             -0.201962E-03     
  5   3853.0000000             -0.735837E-03     
  6   1391.0000000             -0.238746E-02     
  7    542.5000000             -0.704969E-02     
  8    224.9000000             -0.187856E-01     
  9     97.9300000             -0.446153E-01     
 10     44.3100000             -0.897741E-01     
 11     20.6500000             -0.142940E+00     
 12      9.7290000             -0.124315E+00     
 13      4.2280000              0.999648E-01     
 14      1.9690000              0.417080E+00     
 15      0.8890000              0.475123E+00     
 16      0.3964000              0.163268E+00     
S   16
  1 1224000.0000000             0.175871E-06     
  2 183200.0000000              0.136594E-05     
  3  41700.0000000              0.719795E-05     
  4  11810.0000000              0.303349E-04     
  5   3853.0000000              0.110752E-03     
  6   1391.0000000              0.358596E-03     
  7    542.5000000              0.106272E-02     
  8    224.9000000              0.282687E-02     
  9     97.9300000              0.676742E-02     
 10     44.3100000              0.136480E-01     
 11     20.6500000              0.222814E-01     
 12      9.7290000              0.196011E-01     
 13      4.2280000             -0.167708E-01     
 14      1.9690000             -0.773734E-01     
 15      0.8890000             -0.113501E+00     
 16      0.3964000             -0.139130E+00     
S   1
  1      0.0699300              1.0000000        
S   1
  1      0.0328900              1.0000000        
S   1
  1      0.0161200              1.0000000        
S   1
  1     24.2820000              1.0000000        
S   1
  1      4.8740000              1.0000000        
S   1
  1      0.9780000              1.0000000        
S   1
  1      0.0050300              1.0000000        
P   9
  1    413.4000000              0.908196E-03     
  2     97.9800000              0.741773E-02     
  3     31.3700000              0.357464E-01     
  4     11.6200000              0.118520E+00     
  5      4.6710000              0.261403E+00     
  6      1.9180000              0.378395E+00     
  7      0.7775000              0.334632E+00     
  8      0.3013000              0.126844E+00     
  9      0.2275000             -0.147117E-01     
P   9
  1    413.4000000             -0.901741E-04     
  2     97.9800000             -0.739342E-03     
  3     31.3700000             -0.357309E-02     
  4     11.6200000             -0.120142E-01     
  5      4.6710000             -0.267178E-01     
  6      1.9180000             -0.392753E-01     
  7      0.7775000             -0.376083E-01     
  8      0.3013000             -0.433228E-01     
  9      0.2275000              0.518003E-01     
P   1
  1      0.0752700              1.0000000        
P   1
  1      0.0312600              1.0000000        
P   1
  1      0.0134200              1.0000000        
P   1
  1      4.4660000              1.0000000        
P   1
  1      1.6890000              1.0000000        
P   1
  1      0.6380000              1.0000000        
P   1
  1      0.0077200              1.0000000        
D   1
  1      0.1538000              1.0000000        
D   1
  1      0.0865000              1.0000000        
D   1
  1      0.0487000              1.0000000        
D   1
  1      8.6060000              1.0000000        
D   1
  1      3.1370000              1.0000000        
D   1
  1      1.1440000              1.0000000        
D   1
  1      0.0210000              1.0000000        
F   1
  1      0.1912000              1.0000000        
F   1
  1      0.1036000              1.0000000        
F   1
  1      6.2580000              1.0000000        
F   1
  1      2.1730000              1.0000000        
F   1
  1      0.0453000              1.0000000        
G   1
  1      0.1722000              1.0000000        
G   1
  1      4.0970000              1.0000000        
G   1
  1      0.0866000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   13
  1 327600.0000000              0.309608E-04     
  2  49050.0000000              0.240954E-03     
  3  11150.0000000              0.126660E-02     
  4   3152.0000000              0.533359E-02     
  5   1025.0000000              0.190770E-01     
  6    368.8000000              0.588058E-01     
  7    143.2000000              0.151454E+00     
  8     58.9600000              0.300716E+00     
  9     25.4000000              0.381149E+00     
 10     11.1500000              0.213584E+00     
 11      4.0040000              0.231210E-01     
 12      1.7010000             -0.230757E-02     
 13      0.7060000              0.128900E-02     
S   13
  1 327600.0000000             -0.783173E-05     
  2  49050.0000000             -0.607935E-04     
  3  11150.0000000             -0.321197E-03     
  4   3152.0000000             -0.134955E-02     
  5   1025.0000000             -0.490570E-02     
  6    368.8000000             -0.153561E-01     
  7    143.2000000             -0.423409E-01     
  8     58.9600000             -0.940603E-01     
  9     25.4000000             -0.163425E+00     
 10     11.1500000             -0.124754E+00     
 11      4.0040000              0.235623E+00     
 12      1.7010000              0.577563E+00     
 13      0.7060000              0.335232E+00     
S   13
  1 327600.0000000              0.150908E-05     
  2  49050.0000000              0.117134E-04     
  3  11150.0000000              0.618980E-04     
  4   3152.0000000              0.260088E-03     
  5   1025.0000000              0.946218E-03     
  6    368.8000000              0.296595E-02     
  7    143.2000000              0.821245E-02     
  8     58.9600000              0.183977E-01     
  9     25.4000000              0.326657E-01     
 10     11.1500000              0.257315E-01     
 11      4.0040000             -0.535351E-01     
 12      1.7010000             -0.156895E+00     
 13      0.7060000             -0.206659E+00     
S   1
  1      0.1410000              1.0000000        
S   1
  1      0.0680800              1.0000000        
S   1
  1      0.0306300              1.0000000        
S   1
  1     23.2430000              1.0000000        
S   1
  1      9.5610000              1.0000000        
S   1
  1      3.9330000              1.0000000        
S   1
  1      0.0123900              1.0000000        
P   9
  1    539.6000000              0.833969E-03     
  2    127.9000000              0.689215E-02     
  3     41.0200000              0.337874E-01     
  4     15.2500000              0.114401E+00     
  5      6.1660000              0.259514E+00     
  6      2.5610000              0.385095E+00     
  7      1.0600000              0.335373E+00     
  8      0.4176000              0.110641E+00     
  9      0.2690000             -0.121315E-01     
P   9
  1    539.6000000             -0.132076E-03     
  2    127.9000000             -0.109538E-02     
  3     41.0200000             -0.539495E-02     
  4     15.2500000             -0.185572E-01     
  5      6.1660000             -0.427375E-01     
  6      2.5610000             -0.647684E-01     
  7      1.0600000             -0.627818E-01     
  8      0.4176000             -0.244912E-01     
  9      0.2690000              0.104761E+00     
P   1
  1      0.1223000              1.0000000        
P   1
  1      0.0547600              1.0000000        
P   1
  1      0.0238800              1.0000000        
P   1
  1     39.5360000              1.0000000        
P   1
  1     12.7780000              1.0000000        
P   1
  1      4.1300000              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.1060000              1.0000000        
D   1
  1      0.1944000              1.0000000        
D   1
  1      0.3570000              1.0000000        
D   1
  1     12.5330000              1.0000000        
D   1
  1      4.6770000              1.0000000        
D   1
  1      1.7450000              1.0000000        
D   1
  1      0.0382000              1.0000000        
F   1
  1      0.1810000              1.0000000        
F   1
  1      0.3590000              1.0000000        
F   1
  1      7.8760000              1.0000000        
F   1
  1      2.8050000              1.0000000        
F   1
  1      0.0700000              1.0000000        
G   1
  1      0.3070000              1.0000000        
G   1
  1      5.3940000              1.0000000        
G   1
  1      0.1480000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   13
  1 419600.0000000              0.278219E-04     
  2  62830.0000000              0.216330E-03     
  3  14290.0000000              0.113754E-02     
  4   4038.0000000              0.479635E-02     
  5   1312.0000000              0.172389E-01     
  6    470.5000000              0.538066E-01     
  7    181.8000000              0.141326E+00     
  8     74.4600000              0.289268E+00     
  9     31.9000000              0.384825E+00     
 10     13.9600000              0.232852E+00     
 11      5.1800000              0.293330E-01     
 12      2.2650000             -0.300574E-02     
 13      0.9664000              0.166673E-02     
S   13
  1 419600.0000000             -0.723754E-05     
  2  62830.0000000             -0.561733E-04     
  3  14290.0000000             -0.296528E-03     
  4   4038.0000000             -0.124913E-02     
  5   1312.0000000             -0.455101E-02     
  6    470.5000000             -0.144393E-01     
  7    181.8000000             -0.403464E-01     
  8     74.4600000             -0.922618E-01     
  9     31.9000000             -0.164510E+00     
 10     13.9600000             -0.141296E+00     
 11      5.1800000              0.195365E+00     
 12      2.2650000              0.572475E+00     
 13      0.9664000              0.374041E+00     
S   13
  1 419600.0000000              0.167150E-05     
  2  62830.0000000              0.129641E-04     
  3  14290.0000000              0.685101E-04     
  4   4038.0000000              0.288274E-03     
  5   1312.0000000              0.105276E-02     
  6    470.5000000              0.333878E-02     
  7    181.8000000              0.939217E-02     
  8     74.4600000              0.216047E-01     
  9     31.9000000              0.395873E-01     
 10     13.9600000              0.349180E-01     
 11      5.1800000             -0.528415E-01     
 12      2.2650000             -0.191878E+00     
 13      0.9664000             -0.254115E+00     
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1184000              1.0000000        
S   1
  1      0.0502100              1.0000000        
S   1
  1      9.7290000              1.0000000        
S   1
  1      4.8700000              1.0000000        
S   1
  1      2.4370000              1.0000000        
S   1
  1      0.0183000              1.0000000        
P   8
  1    891.3000000              0.491755E-03     
  2    211.3000000              0.415843E-02     
  3     68.2800000              0.212538E-01     
  4     25.7000000              0.764058E-01     
  5     10.6300000              0.194277E+00     
  6      4.6020000              0.334428E+00     
  7      2.0150000              0.375026E+00     
  8      0.8706000              0.204041E+00     
P   8
  1    891.3000000             -0.888695E-04     
  2    211.3000000             -0.745823E-03     
  3     68.2800000             -0.387025E-02     
  4     25.7000000             -0.139350E-01     
  5     10.6300000             -0.366860E-01     
  6      4.6020000             -0.627797E-01     
  7      2.0150000             -0.789602E-01     
  8      0.8706000             -0.288589E-01     
P   1
  1      0.2972000              1.0000000        
P   1
  1      0.1100000              1.0000000        
P   1
  1      0.0398900              1.0000000        
P   1
  1     10.0000000              1.0000000        
P   1
  1      4.5140000              1.0000000        
P   1
  1      2.0380000              1.0000000        
P   1
  1      0.0121000              1.0000000        
D   1
  1      0.0804000              1.0000000        
D   1
  1      0.1990000              1.0000000        
D   1
  1      0.4940000              1.0000000        
D   1
  1     14.8350000              1.0000000        
D   1
  1      5.6370000              1.0000000        
D   1
  1      2.1420000              1.0000000        
D   1
  1      0.0282000              1.0000000        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
F   1
  1      9.8530000              1.0000000        
F   1
  1      3.5250000              1.0000000        
F   1
  1      0.0582000              1.0000000        
G   1
  1      0.3570000              1.0000000        
G   1
  1      6.8940000              1.0000000        
G   1
  1      0.1530000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Si
data:
SILICON
S   13
  1 513000.0000000              0.260920E-04     
  2  76820.0000000              0.202905E-03     
  3  17470.0000000              0.106715E-02     
  4   4935.0000000              0.450597E-02     
  5   1602.0000000              0.162359E-01     
  6    574.1000000              0.508913E-01     
  7    221.5000000              0.135155E+00     
  8     90.5400000              0.281292E+00     
  9     38.7400000              0.385336E+00     
 10     16.9500000              0.245651E+00     
 11      6.4520000              0.343145E-01     
 12      2.8740000             -0.334884E-02     
 13      1.2500000              0.187625E-02     
S   13
  1 513000.0000000             -0.694880E-05     
  2  76820.0000000             -0.539641E-04     
  3  17470.0000000             -0.284716E-03     
  4   4935.0000000             -0.120203E-02     
  5   1602.0000000             -0.438397E-02     
  6    574.1000000             -0.139776E-01     
  7    221.5000000             -0.393516E-01     
  8     90.5400000             -0.914283E-01     
  9     38.7400000             -0.165609E+00     
 10     16.9500000             -0.152505E+00     
 11      6.4520000              0.168524E+00     
 12      2.8740000              0.569284E+00     
 13      1.2500000              0.398056E+00     
S   13
  1 513000.0000000              0.178068E-05     
  2  76820.0000000              0.138148E-04     
  3  17470.0000000              0.730005E-04     
  4   4935.0000000              0.307666E-03     
  5   1602.0000000              0.112563E-02     
  6    574.1000000              0.358435E-02     
  7    221.5000000              0.101728E-01     
  8     90.5400000              0.237520E-01     
  9     38.7400000              0.443483E-01     
 10     16.9500000              0.419041E-01     
 11      6.4520000             -0.502504E-01     
 12      2.8740000             -0.216578E+00     
 13      1.2500000             -0.286448E+00     
S   1
  1      0.3599000              1.0000000        
S   1
  1      0.1699000              1.0000000        
S   1
  1      0.0706600              1.0000000        
S   1
  1     12.1640000              1.0000000        
S   1
  1      6.1870000              1.0000000        
S   1
  1      3.1470000              1.0000000        
S   1
  1      0.0275000              1.0000000        
P   8
  1   1122.0000000              0.448143E-03     
  2    266.0000000              0.381639E-02     
  3     85.9200000              0.198105E-01     
  4     32.3300000              0.727017E-01     
  5     13.3700000              0.189839E+00     
  6      5.8000000              0.335672E+00     
  7      2.5590000              0.379365E+00     
  8      1.1240000              0.201193E+00     
P   8
  1   1122.0000000             -0.964883E-04     
  2    266.0000000             -0.811971E-03     
  3     85.9200000             -0.430087E-02     
  4     32.3300000             -0.157502E-01     
  5     13.3700000             -0.429541E-01     
  6      5.8000000             -0.752574E-01     
  7      2.5590000             -0.971446E-01     
  8      1.1240000             -0.227507E-01     
P   1
  1      0.3988000              1.0000000        
P   1
  1      0.1533000              1.0000000        
P   1
  1      0.0572800              1.0000000        
P   1
  1     12.6460000              1.0000000        
P   1
  1      5.7470000              1.0000000        
P   1
  1      2.6120000              1.0000000        
P   1
  1      0.0200000              1.0000000        
D   1
  1      0.1200000              1.0000000        
D   1
  1      0.3020000              1.0000000        
D   1
  1      0.7600000              1.0000000        
D   1
  1     19.0150000              1.0000000        
D   1
  1      7.4010000              1.0000000        
D   1
  1      2.8810000              1.0000000        
D   1
  1      0.0435000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
F   1
  1     11.9250000              1.0000000        
F   1
  1      4.3040000              1.0000000        
F   1
  1      0.0846000              1.0000000        
G   1
  1      0.4610000              1.0000000        
G   1
  1      8.5770000              1.0000000        
G   1
  1      0.2120000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   13
  1 615200.0000000              0.247450E-04     
  2  92120.0000000              0.192465E-03     
  3  20950.0000000              0.101202E-02     
  4   5920.0000000              0.427261E-02     
  5   1922.0000000              0.154161E-01     
  6    688.0000000              0.485976E-01     
  7    265.0000000              0.130060E+00     
  8    108.2000000              0.274514E+00     
  9     46.2200000              0.385402E+00     
 10     20.2300000              0.255934E+00     
 11      7.8590000              0.391237E-01     
 12      3.5470000             -0.368010E-02     
 13      1.5640000              0.208211E-02     
S   13
  1 615200.0000000             -0.672205E-05     
  2  92120.0000000             -0.522311E-04     
  3  20950.0000000             -0.275361E-03     
  4   5920.0000000             -0.116307E-02     
  5   1922.0000000             -0.424281E-02     
  6    688.0000000             -0.136114E-01     
  7    265.0000000             -0.385114E-01     
  8    108.2000000             -0.906643E-01     
  9     46.2200000             -0.166584E+00     
 10     20.2300000             -0.161447E+00     
 11      7.8590000              0.146781E+00     
 12      3.5470000              0.566682E+00     
 13      1.5640000              0.416433E+00     
S   13
  1 615200.0000000              0.184740E-05     
  2  92120.0000000              0.143380E-04     
  3  20950.0000000              0.757228E-04     
  4   5920.0000000              0.319205E-03     
  5   1922.0000000              0.116851E-02     
  6    688.0000000              0.374267E-02     
  7    265.0000000              0.106817E-01     
  8    108.2000000              0.252657E-01     
  9     46.2200000              0.479283E-01     
 10     20.2300000              0.477096E-01     
 11      7.8590000             -0.466525E-01     
 12      3.5470000             -0.234968E+00     
 13      1.5640000             -0.311337E+00     
S   1
  1      0.4888000              1.0000000        
S   1
  1      0.2266000              1.0000000        
S   1
  1      0.0933100              1.0000000        
S   1
  1     14.8310000              1.0000000        
S   1
  1      7.6400000              1.0000000        
S   1
  1      3.9350000              1.0000000        
S   1
  1      0.0354000              1.0000000        
P   8
  1   1367.0000000              0.421015E-03     
  2    324.0000000              0.360985E-02     
  3    104.6000000              0.189217E-01     
  4     39.3700000              0.705560E-01     
  5     16.2600000              0.188157E+00     
  6      7.0560000              0.338709E+00     
  7      3.1300000              0.381943E+00     
  8      1.3940000              0.195261E+00     
P   8
  1   1367.0000000             -0.100827E-03     
  2    324.0000000             -0.854499E-03     
  3    104.6000000             -0.457116E-02     
  4     39.3700000             -0.170327E-01     
  5     16.2600000             -0.475204E-01     
  6      7.0560000             -0.852786E-01     
  7      3.1300000             -0.109676E+00     
  8      1.3940000             -0.161181E-01     
P   1
  1      0.5179000              1.0000000        
P   1
  1      0.2032000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1     15.5230000              1.0000000        
P   1
  1      7.0730000              1.0000000        
P   1
  1      3.2230000              1.0000000        
P   1
  1      0.0272000              1.0000000        
D   1
  1      0.1650000              1.0000000        
D   1
  1      0.4130000              1.0000000        
D   1
  1      1.0360000              1.0000000        
D   1
  1     23.4170000              1.0000000        
D   1
  1      9.2500000              1.0000000        
D   1
  1      3.6540000              1.0000000        
D   1
  1      0.0594000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
F   1
  1     14.2070000              1.0000000        
F   1
  1      5.1610000              1.0000000        
F   1
  1      0.1090000              1.0000000        
G   1
  1      0.5970000              1.0000000        
G   1
  1     10.4480000              1.0000000        
G   1
  1      0.2500000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: S
data:
SULFUR
S   13
  1 727800.0000000              0.236025E-04     
  2 109000.0000000              0.183482E-03     
  3  24800.0000000              0.964278E-03     
  4   7014.0000000              0.406537E-02     
  5   2278.0000000              0.146973E-01     
  6    814.7000000              0.465081E-01     
  7    313.4000000              0.125508E+00     
  8    127.7000000              0.268433E+00     
  9     54.4800000              0.384809E+00     
 10     23.8500000              0.265372E+00     
 11      9.4280000              0.437326E-01     
 12      4.2900000             -0.378807E-02     
 13      1.9090000              0.218083E-02     
S   13
  1 727800.0000000             -0.652179E-05     
  2 109000.0000000             -0.506631E-04     
  3  24800.0000000             -0.266833E-03     
  4   7014.0000000             -0.112601E-02     
  5   2278.0000000             -0.411186E-02     
  6    814.7000000             -0.132454E-01     
  7    313.4000000             -0.377004E-01     
  8    127.7000000             -0.898554E-01     
  9     54.4800000             -0.167098E+00     
 10     23.8500000             -0.169354E+00     
 11      9.4280000              0.127824E+00     
 12      4.2900000              0.564862E+00     
 13      1.9090000              0.431767E+00     
S   13
  1 727800.0000000              0.189406E-05     
  2 109000.0000000              0.146948E-04     
  3  24800.0000000              0.775460E-04     
  4   7014.0000000              0.326509E-03     
  5   2278.0000000              0.119686E-02     
  6    814.7000000              0.384799E-02     
  7    313.4000000              0.110539E-01     
  8    127.7000000              0.264645E-01     
  9     54.4800000              0.508771E-01     
 10     23.8500000              0.530030E-01     
 11      9.4280000             -0.425518E-01     
 12      4.2900000             -0.250853E+00     
 13      1.9090000             -0.333152E+00     
S   1
  1      0.6270000              1.0000000        
S   1
  1      0.2873000              1.0000000        
S   1
  1      0.1172000              1.0000000        
S   1
  1     17.5990000              1.0000000        
S   1
  1      9.1860000              1.0000000        
S   1
  1      4.7950000              1.0000000        
S   1
  1      0.0428000              1.0000000        
P   8
  1   1546.0000000              0.441183E-03     
  2    366.4000000              0.377571E-02     
  3    118.4000000              0.198360E-01     
  4     44.5300000              0.742063E-01     
  5     18.3800000              0.197327E+00     
  6      7.9650000              0.351851E+00     
  7      3.5410000              0.378687E+00     
  8      1.5910000              0.170931E+00     
P   8
  1   1546.0000000             -0.113110E-03     
  2    366.4000000             -0.958581E-03     
  3    118.4000000             -0.513471E-02     
  4     44.5300000             -0.192641E-01     
  5     18.3800000             -0.535980E-01     
  6      7.9650000             -0.960333E-01     
  7      3.5410000             -0.118183E+00     
  8      1.5910000              0.923194E-02     
P   1
  1      0.6205000              1.0000000        
P   1
  1      0.2420000              1.0000000        
P   1
  1      0.0901400              1.0000000        
P   1
  1     18.1270000              1.0000000        
P   1
  1      8.2190000              1.0000000        
P   1
  1      3.7260000              1.0000000        
P   1
  1      0.0317000              1.0000000        
D   1
  1      0.2030000              1.0000000        
D   1
  1      0.5040000              1.0000000        
D   1
  1      1.2500000              1.0000000        
D   1
  1     27.4170000              1.0000000        
D   1
  1     10.8930000              1.0000000        
D   1
  1      4.3190000              1.0000000        
D   1
  1      0.0748000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
F   1
  1     16.5350000              1.0000000        
F   1
  1      6.0080000              1.0000000        
F   1
  1      0.1400000              1.0000000        
G   1
  1      0.6830000              1.0000000        
G   1
  1     12.5180000              1.0000000        
G   1
  1      0.2970000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   13
  1 834900.0000000              0.231688E-04     
  2 125000.0000000              0.180154E-03     
  3  28430.0000000              0.947782E-03     
  4   8033.0000000              0.400139E-02     
  5   2608.0000000              0.144629E-01     
  6    933.9000000              0.456586E-01     
  7    360.0000000              0.123248E+00     
  8    147.0000000              0.264369E+00     
  9     62.8800000              0.382989E+00     
 10     27.6000000              0.270934E+00     
 11     11.0800000              0.471404E-01     
 12      5.0750000             -0.371766E-02     
 13      2.2780000              0.219158E-02     
S   13
  1 834900.0000000             -0.649649E-05     
  2 125000.0000000             -0.504895E-04     
  3  28430.0000000             -0.266113E-03     
  4   8033.0000000             -0.112499E-02     
  5   2608.0000000             -0.410497E-02     
  6    933.9000000             -0.131987E-01     
  7    360.0000000             -0.375342E-01     
  8    147.0000000             -0.897233E-01     
  9     62.8800000             -0.167671E+00     
 10     27.6000000             -0.174763E+00     
 11     11.0800000              0.114909E+00     
 12      5.0750000              0.563618E+00     
 13      2.2780000              0.441606E+00     
S   13
  1 834900.0000000              0.196645E-05     
  2 125000.0000000              0.152620E-04     
  3  28430.0000000              0.806086E-04     
  4   8033.0000000              0.339960E-03     
  5   2608.0000000              0.124551E-02     
  6    933.9000000              0.399612E-02     
  7    360.0000000              0.114751E-01     
  8    147.0000000              0.275504E-01     
  9     62.8800000              0.532917E-01     
 10     27.6000000              0.571246E-01     
 11     11.0800000             -0.395201E-01     
 12      5.0750000             -0.264343E+00     
 13      2.2780000             -0.349291E+00     
S   1
  1      0.7775000              1.0000000        
S   1
  1      0.3527000              1.0000000        
S   1
  1      0.1431000              1.0000000        
S   1
  1     20.6890000              1.0000000        
S   1
  1     10.8800000              1.0000000        
S   1
  1      5.7220000              1.0000000        
S   1
  1      0.0519000              1.0000000        
P   8
  1   1703.0000000              0.474039E-03     
  2    403.6000000              0.406412E-02     
  3    130.3000000              0.213355E-01     
  4     49.0500000              0.794611E-01     
  5     20.2600000              0.208927E+00     
  6      8.7870000              0.364945E+00     
  7      3.9190000              0.371725E+00     
  8      1.7650000              0.146292E+00     
P   8
  1   1703.0000000             -0.128266E-03     
  2    403.6000000             -0.109356E-02     
  3    130.3000000             -0.583429E-02     
  4     49.0500000             -0.219258E-01     
  5     20.2600000             -0.601385E-01     
  6      8.7870000             -0.106929E+00     
  7      3.9190000             -0.122454E+00     
  8      1.7650000              0.383619E-01     
P   1
  1      0.7207000              1.0000000        
P   1
  1      0.2839000              1.0000000        
P   1
  1      0.1060000              1.0000000        
P   1
  1     20.7840000              1.0000000        
P   1
  1      9.3790000              1.0000000        
P   1
  1      4.2320000              1.0000000        
P   1
  1      0.0376000              1.0000000        
D   1
  1      0.2540000              1.0000000        
D   1
  1      0.6280000              1.0000000        
D   1
  1      1.5510000              1.0000000        
D   1
  1     32.2550000              1.0000000        
D   1
  1     12.8880000              1.0000000        
D   1
  1      5.1490000              1.0000000        
D   1
  1      0.0952000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
F   1
  1     19.1070000              1.0000000        
F   1
  1      6.9500000              1.0000000        
F   1
  1      0.2170000              1.0000000        
G   1
  1      0.8270000              1.0000000        
G   1
  1     14.7820000              1.0000000        
G   1
  1      0.3780000              1.0000000


name: aug-cc-pCVQZ
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ar
data:
ARGON
S   13
  1 950600.0000000              0.227545E-04     
  2 142300.0000000              0.176945E-03     
  3  32360.0000000              0.931282E-03     
  4   9145.0000000              0.392860E-02     
  5   2970.0000000              0.142064E-01     
  6   1064.0000000              0.448114E-01     
  7    410.8000000              0.121001E+00     
  8    168.0000000              0.260579E+00     
  9     71.9900000              0.381364E+00     
 10     31.6700000              0.276058E+00     
 11     12.8900000              0.505179E-01     
 12      5.9290000             -0.359866E-02     
 13      2.6780000              0.218798E-02     
S   13
  1 950600.0000000             -0.646201E-05     
  2 142300.0000000             -0.502346E-04     
  3  32360.0000000             -0.264804E-03     
  4   9145.0000000             -0.111895E-02     
  5   2970.0000000             -0.408276E-02     
  6   1064.0000000             -0.131216E-01     
  7    410.8000000             -0.372855E-01     
  8    168.0000000             -0.894709E-01     
  9     71.9900000             -0.168054E+00     
 10     31.6700000             -0.179594E+00     
 11     12.8900000              0.102953E+00     
 12      5.9290000              0.562630E+00     
 13      2.6780000              0.450355E+00     
S   13
  1 950600.0000000              0.202056E-05     
  2 142300.0000000              0.156851E-04     
  3  32360.0000000              0.828617E-04     
  4   9145.0000000              0.349264E-03     
  5   2970.0000000              0.127976E-02     
  6   1064.0000000              0.410365E-02     
  7    410.8000000              0.117789E-01     
  8    168.0000000              0.283868E-01     
  9     71.9900000              0.552406E-01     
 10     31.6700000              0.607492E-01     
 11     12.8900000             -0.362012E-01     
 12      5.9290000             -0.275398E+00     
 13      2.6780000             -0.362845E+00     
S   1
  1      0.9416000              1.0000000        
S   1
  1      0.4239000              1.0000000        
S   1
  1      0.1714000              1.0000000        
S   1
  1     24.0240000              1.0000000        
S   1
  1     12.7060000              1.0000000        
S   1
  1      6.7200000              1.0000000        
S   1
  1      0.0610000              1.0000000        
P   8
  1   1890.0000000              0.495752E-03     
  2    447.8000000              0.425172E-02     
  3    144.6000000              0.223277E-01     
  4     54.4600000              0.830878E-01     
  5     22.5100000              0.217110E+00     
  6      9.7740000              0.374507E+00     
  7      4.3680000              0.366445E+00     
  8      1.9590000              0.129245E+00     
P   8
  1   1890.0000000             -0.138863E-03     
  2    447.8000000             -0.118870E-02     
  3    144.6000000             -0.632553E-02     
  4     54.4600000             -0.238813E-01     
  5     22.5100000             -0.649238E-01     
  6      9.7740000             -0.115444E+00     
  7      4.3680000             -0.123651E+00     
  8      1.9590000              0.649055E-01     
P   1
  1      0.8260000              1.0000000        
P   1
  1      0.3297000              1.0000000        
P   1
  1      0.1242000              1.0000000        
P   1
  1     23.6270000              1.0000000        
P   1
  1     10.6540000              1.0000000        
P   1
  1      4.8040000              1.0000000        
P   1
  1      0.0435000              1.0000000        
D   1
  1      0.3110000              1.0000000        
D   1
  1      0.7630000              1.0000000        
D   1
  1      1.8730000              1.0000000        
D   1
  1     37.3640000              1.0000000        
D   1
  1     15.0130000              1.0000000        
D   1
  1      6.0320000              1.0000000        
D   1
  1      0.1160000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
F   1
  1     21.8840000              1.0000000        
F   1
  1      7.9680000              1.0000000        
F   1
  1      0.2940000              1.0000000        
G   1
  1      1.0070000              1.0000000        
G   1
  1     17.2430000              1.0000000        
G   1
  1      0.4590000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   6601.0000000              0.0001428        
  2    989.7000000              0.0009372        
  3    225.7000000              0.0047683        
  4     64.2900000              0.0192504        
  5     21.1800000              0.0631135        
  6      7.7240000              0.1632570        
  7      3.0030000              0.3148261        
  8      1.2120000              0.3938785        
  9      0.4930000              0.1968621        
S   9
  1   6601.0000000             -0.0000223        
  2    989.7000000             -0.0001464        
  3    225.7000000             -0.0007479        
  4     64.2900000             -0.0030295        
  5     21.1800000             -0.0101354        
  6      7.7240000             -0.0271075        
  7      3.0030000             -0.0573626        
  8      1.2120000             -0.0939079        
  9      0.4930000             -0.1210364        
S   1
  1      0.0951500              1.0000000        
S   1
  1      0.0479100              1.0000000        
S   1
  1      0.0222000              1.0000000        
S   1
  1      5.6140000              1.0000000        
S   1
  1      1.8600000              1.0000000        
S   1
  1      0.6160000              1.0000000        
S   1
  1      0.0063600              1.0000000        
P   3
  1      6.2500000              0.0033908        
  2      1.3700000              0.0193161        
  3      0.3672000              0.0791011        
P   1
  1      0.1192000              1.0000000        
P   1
  1      0.0447400              1.0000000        
P   1
  1      0.0179500              1.0000000        
P   1
  1      9.7850000              1.0000000        
P   1
  1      2.5930000              1.0000000        
P   1
  1      0.6870000              1.0000000        
P   1
  1      0.0075600              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1      0.1530000              1.0000000        
D   1
  1      0.0680000              1.0000000        
D   1
  1     10.6020000              1.0000000        
D   1
  1      3.0660000              1.0000000        
D   1
  1      0.0266000              1.0000000        
F   1
  1      0.2460000              1.0000000        
F   1
  1      0.1292000              1.0000000        
F   1
  1      6.6830000              1.0000000        
F   1
  1      0.0552000              1.0000000        
G   1
  1      0.2380000              1.0000000        
G   1
  1      0.1050000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1  14630.0000000              0.0001304        
  2   2191.0000000              0.0007604        
  3    498.2000000              0.0038026        
  4    140.9000000              0.0155612        
  5     45.8600000              0.0529953        
  6     16.4700000              0.1458045        
  7      6.3190000              0.3027037        
  8      2.5350000              0.4048329        
  9      1.0350000              0.2222552        
S   9
  1  14630.0000000             -0.0000237        
  2   2191.0000000             -0.0001391        
  3    498.2000000             -0.0006922        
  4    140.9000000             -0.0028756        
  5     45.8600000             -0.0098388        
  6     16.4700000             -0.0286430        
  7      6.3190000             -0.0637779        
  8      2.5350000             -0.1172570        
  9      1.0350000             -0.1210701        
S   1
  1      0.2528000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0426100              1.0000000        
S   1
  1     21.7260000              1.0000000        
S   1
  1      7.8660000              1.0000000        
S   1
  1      2.8480000              1.0000000        
S   1
  1      0.0143900              1.0000000        
P   3
  1     14.0300000              0.0041084        
  2      3.1680000              0.0256337        
  3      0.9024000              0.1037812        
P   1
  1      0.3036000              1.0000000        
P   1
  1      0.1130000              1.0000000        
P   1
  1      0.0428600              1.0000000        
P   1
  1     30.8980000              1.0000000        
P   1
  1     10.3650000              1.0000000        
P   1
  1      3.4770000              1.0000000        
P   1
  1      0.0065000              1.0000000        
D   1
  1      1.0720000              1.0000000        
D   1
  1      0.4410000              1.0000000        
D   1
  1      0.1811000              1.0000000        
D   1
  1     30.3900000              1.0000000        
D   1
  1      6.0920000              1.0000000        
D   1
  1      0.0554000              1.0000000        
F   1
  1      0.4810000              1.0000000        
F   1
  1      0.2550000              1.0000000        
F   1
  1     12.4820000              1.0000000        
F   1
  1      0.0930000              1.0000000        
G   1
  1      0.4150000              1.0000000        
G   1
  1      0.1834000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: B
data:
BORON
S   9
  1  23870.0000000              0.0001428        
  2   3575.0000000              0.0007616        
  3    812.8000000              0.0037058        
  4    229.7000000              0.0150963        
  5     74.6900000              0.0516294        
  6     26.8100000              0.1434860        
  7     10.3200000              0.3009872        
  8      4.1780000              0.4033443        
  9      1.7270000              0.2251446        
S   9
  1  23870.0000000             -0.0000288        
  2   3575.0000000             -0.0001545        
  3    812.8000000             -0.0007473        
  4    229.7000000             -0.0030957        
  5     74.6900000             -0.0106287        
  6     26.8100000             -0.0314278        
  7     10.3200000             -0.0710579        
  8      4.1780000             -0.1321386        
  9      1.7270000             -0.1228547        
S   1
  1      0.4704000              1.0000000        
S   1
  1      0.1896000              1.0000000        
S   1
  1      0.0739400              1.0000000        
S   1
  1      4.8640000              1.0000000        
S   1
  1     13.2880000              1.0000000        
S   1
  1     36.3040000              1.0000000        
S   1
  1      0.0272100              1.0000000        
P   3
  1     22.2600000              0.0051124        
  2      5.0580000              0.0332200        
  3      1.4870000              0.1323136        
P   1
  1      0.5071000              1.0000000        
P   1
  1      0.1812000              1.0000000        
P   1
  1      0.0646300              1.0000000        
P   1
  1      5.4890000              1.0000000        
P   1
  1     16.3020000              1.0000000        
P   1
  1     48.4180000              1.0000000        
P   1
  1      0.0187800              1.0000000        
D   1
  1      1.1100000              1.0000000        
D   1
  1      0.4020000              1.0000000        
D   1
  1      0.1450000              1.0000000        
D   1
  1      6.6400000              1.0000000        
D   1
  1     24.4620000              1.0000000        
D   1
  1      0.0466000              1.0000000        
F   1
  1      0.8820000              1.0000000        
F   1
  1      0.3110000              1.0000000        
F   1
  1     18.7940000              1.0000000        
F   1
  1      0.1130000              1.0000000        
G   1
  1      0.6730000              1.0000000        
G   1
  1      0.2730000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: C
data:
CARBON
S   9
  1  33980.0000000              0.0001631        
  2   5089.0000000              0.0008131        
  3   1157.0000000              0.0038480        
  4    326.6000000              0.0155770        
  5    106.1000000              0.0532169        
  6     38.1100000              0.1473186        
  7     14.7500000              0.3057064        
  8      6.0350000              0.3990689        
  9      2.5300000              0.2167636        
S   9
  1  33980.0000000             -0.0000347        
  2   5089.0000000             -0.0001740        
  3   1157.0000000             -0.0008193        
  4    326.6000000             -0.0033743        
  5    106.1000000             -0.0115871        
  6     38.1100000             -0.0342621        
  7     14.7500000             -0.0772516        
  8      6.0350000             -0.1415421        
  9      2.5300000             -0.1176683        
S   1
  1      0.7355000              1.0000000        
S   1
  1      0.2905000              1.0000000        
S   1
  1      0.1111000              1.0000000        
S   1
  1      7.2160000              1.0000000        
S   1
  1     19.5700000              1.0000000        
S   1
  1     53.0730000              1.0000000        
S   1
  1      0.0414500              1.0000000        
P   3
  1     34.5100000              0.0054084        
  2      7.9150000              0.0361681        
  3      2.3680000              0.1425195        
P   1
  1      0.8132000              1.0000000        
P   1
  1      0.2890000              1.0000000        
P   1
  1      0.1007000              1.0000000        
P   1
  1      8.1820000              1.0000000        
P   1
  1     24.1860000              1.0000000        
P   1
  1     71.4940000              1.0000000        
P   1
  1      0.0321800              1.0000000        
D   1
  1      1.8480000              1.0000000        
D   1
  1      0.6490000              1.0000000        
D   1
  1      0.2280000              1.0000000        
D   1
  1      8.6560000              1.0000000        
D   1
  1     33.2130000              1.0000000        
D   1
  1      0.0766000              1.0000000        
F   1
  1      1.4190000              1.0000000        
F   1
  1      0.4850000              1.0000000        
F   1
  1     24.6940000              1.0000000        
F   1
  1      0.1870000              1.0000000        
G   1
  1      1.0110000              1.0000000        
G   1
  1      0.4240000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: N
data:
NITROGEN
S   9
  1  45840.0000000              0.0001837        
  2   6868.0000000              0.0008652        
  3   1563.0000000              0.0039619        
  4    442.4000000              0.0158295        
  5    144.3000000              0.0535430        
  6     52.1800000              0.1471714        
  7     20.3400000              0.3047729        
  8      8.3810000              0.3973010        
  9      3.5290000              0.2172331        
S   9
  1  45840.0000000             -0.0000405        
  2   6868.0000000             -0.0001916        
  3   1563.0000000             -0.0008729        
  4    442.4000000             -0.0035503        
  5    144.3000000             -0.0120742        
  6     52.1800000             -0.0355377        
  7     20.3400000             -0.0801985        
  8      8.3810000             -0.1467880        
  9      3.5290000             -0.1158517        
S   1
  1      1.0540000              1.0000000        
S   1
  1      0.4118000              1.0000000        
S   1
  1      0.1552000              1.0000000        
S   1
  1      9.8620000              1.0000000        
S   1
  1     26.6270000              1.0000000        
S   1
  1     71.8940000              1.0000000        
S   1
  1      0.0546400              1.0000000        
P   3
  1     49.3300000              0.0055788        
  2     11.3700000              0.0380245        
  3      3.4350000              0.1490854        
P   1
  1      1.1820000              1.0000000        
P   1
  1      0.4173000              1.0000000        
P   1
  1      0.1428000              1.0000000        
P   1
  1     11.3200000              1.0000000        
P   1
  1     33.3490000              1.0000000        
P   1
  1     98.2450000              1.0000000        
P   1
  1      0.0440200              1.0000000        
D   1
  1      2.8370000              1.0000000        
D   1
  1      0.9680000              1.0000000        
D   1
  1      0.3350000              1.0000000        
D   1
  1     11.8280000              1.0000000        
D   1
  1     45.2180000              1.0000000        
D   1
  1      0.1110000              1.0000000        
F   1
  1      2.0270000              1.0000000        
F   1
  1      0.6850000              1.0000000        
F   1
  1     28.3640000              1.0000000        
F   1
  1      0.2450000              1.0000000        
G   1
  1      1.4270000              1.0000000        
G   1
  1      0.5590000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: O
data:
OXYGEN
S   9
  1  61420.0000000              0.0001989        
  2   9199.0000000              0.0008884        
  3   2091.0000000              0.0039425        
  4    590.9000000              0.0156072        
  5    192.3000000              0.0529461        
  6     69.3200000              0.1464382        
  7     26.9700000              0.3054148        
  8     11.1000000              0.3979979        
  9      4.6820000              0.2164354        
S   9
  1  61420.0000000             -0.0000452        
  2   9199.0000000             -0.0002026        
  3   2091.0000000             -0.0008948        
  4    590.9000000             -0.0036058        
  5    192.3000000             -0.0123033        
  6     69.3200000             -0.0364684        
  7     26.9700000             -0.0831671        
  8     11.1000000             -0.1521740        
  9      4.6820000             -0.1146271        
S   1
  1      1.4280000              1.0000000        
S   1
  1      0.5547000              1.0000000        
S   1
  1      0.2067000              1.0000000        
S   1
  1     12.9740000              1.0000000        
S   1
  1     34.9000000              1.0000000        
S   1
  1     93.8810000              1.0000000        
S   1
  1      0.0695900              1.0000000        
P   3
  1     63.4200000              0.0061107        
  2     14.6600000              0.0418957        
  3      4.4590000              0.1612329        
P   1
  1      1.5310000              1.0000000        
P   1
  1      0.5302000              1.0000000        
P   1
  1      0.1750000              1.0000000        
P   1
  1     14.4750000              1.0000000        
P   1
  1     42.7300000              1.0000000        
P   1
  1    126.1400000              1.0000000        
P   1
  1      0.0534800              1.0000000        
D   1
  1      3.7750000              1.0000000        
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.4440000              1.0000000        
D   1
  1     14.9270000              1.0000000        
D   1
  1     57.5440000              1.0000000        
D   1
  1      0.1540000              1.0000000        
F   1
  1      2.6660000              1.0000000        
F   1
  1      0.8590000              1.0000000        
F   1
  1     26.4830000              1.0000000        
F   1
  1      0.3240000              1.0000000        
G   1
  1      1.8460000              1.0000000        
G   1
  1      0.7140000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: F
data:
FLUORINE
S   9
  1  74530.0000000              0.0002270        
  2  11170.0000000              0.0009782        
  3   2543.0000000              0.0042187        
  4    721.0000000              0.0164262        
  5    235.9000000              0.0549597        
  6     85.6000000              0.1501715        
  7     33.5500000              0.3084373        
  8     13.9300000              0.3941862        
  9      5.9150000              0.2103451        
S   9
  1  74530.0000000             -0.0000526        
  2  11170.0000000             -0.0002277        
  3   2543.0000000             -0.0009777        
  4    721.0000000             -0.0038762        
  5    235.9000000             -0.0130575        
  6     85.6000000             -0.0383358        
  7     33.5500000             -0.0864713        
  8     13.9300000             -0.1559566        
  9      5.9150000             -0.1099779        
S   1
  1      1.8430000              1.0000000        
S   1
  1      0.7124000              1.0000000        
S   1
  1      0.2637000              1.0000000        
S   1
  1     16.3190000              1.0000000        
S   1
  1     43.7840000              1.0000000        
S   1
  1    117.4720000              1.0000000        
S   1
  1      0.0859400              1.0000000        
P   3
  1     80.3900000              0.0064367        
  2     18.6300000              0.0443407        
  3      5.6940000              0.1686436        
P   1
  1      1.9530000              1.0000000        
P   1
  1      0.6702000              1.0000000        
P   1
  1      0.2166000              1.0000000        
P   1
  1     18.1190000              1.0000000        
P   1
  1     53.5050000              1.0000000        
P   1
  1    158.0010000              1.0000000        
P   1
  1      0.0656800              1.0000000        
D   1
  1      5.0140000              1.0000000        
D   1
  1      1.7250000              1.0000000        
D   1
  1      0.5860000              1.0000000        
D   1
  1     18.9430000              1.0000000        
D   1
  1     72.7980000              1.0000000        
D   1
  1      0.2070000              1.0000000        
F   1
  1      3.5620000              1.0000000        
F   1
  1      1.1480000              1.0000000        
F   1
  1     25.1610000              1.0000000        
F   1
  1      0.4600000              1.0000000        
G   1
  1      2.3760000              1.0000000        
G   1
  1      0.9240000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Ne
data:
NEON
S   9
  1  99920.0000000              0.0002309        
  2  14960.0000000              0.0009487        
  3   3399.0000000              0.0039528        
  4    958.9000000              0.0152737        
  5    311.2000000              0.0517892        
  6    111.7000000              0.1445869        
  7     43.3200000              0.3048408        
  8     17.8000000              0.3992901        
  9      7.5030000              0.2177599        
S   9
  1  99920.0000000             -0.0000543        
  2  14960.0000000             -0.0002242        
  3   3399.0000000             -0.0009299        
  4    958.9000000             -0.0036578        
  5    311.2000000             -0.0124756        
  6    111.7000000             -0.0373656        
  7     43.3200000             -0.0864225        
  8     17.8000000             -0.1585073        
  9      7.5030000             -0.1131074        
S   1
  1      2.3370000              1.0000000        
S   1
  1      0.9001000              1.0000000        
S   1
  1      0.3301000              1.0000000        
S   1
  1     20.1800000              1.0000000        
S   1
  1     54.0420000              1.0000000        
S   1
  1    144.7250000              1.0000000        
S   1
  1      0.1054000              1.0000000        
P   3
  1     99.6800000              0.0066835        
  2     23.1500000              0.0461632        
  3      7.1080000              0.1735949        
P   1
  1      2.4410000              1.0000000        
P   1
  1      0.8339000              1.0000000        
P   1
  1      0.2662000              1.0000000        
P   1
  1     22.2220000              1.0000000        
P   1
  1     65.6220000              1.0000000        
P   1
  1    193.7800000              1.0000000        
P   1
  1      0.0817800              1.0000000        
D   1
  1      6.4710000              1.0000000        
D   1
  1      2.2130000              1.0000000        
D   1
  1      0.7470000              1.0000000        
D   1
  1     23.6130000              1.0000000        
D   1
  1     90.1070000              1.0000000        
D   1
  1      0.2730000              1.0000000        
F   1
  1      4.6570000              1.0000000        
F   1
  1      1.5240000              1.0000000        
F   1
  1     28.8300000              1.0000000        
F   1
  1      0.6890000              1.0000000        
G   1
  1      2.9830000              1.0000000        
G   1
  1      1.2240000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Na
data:
SODIUM
S   16
  1 1224000.0000000             0.0000384        
  2 183200.0000000              0.0001214        
  3  41700.0000000              0.0003735        
  4  11810.0000000              0.0011226        
  5   3853.0000000              0.0034243        
  6   1391.0000000              0.0102715        
  7    542.5000000              0.0289918        
  8    224.9000000              0.0741036        
  9     97.9300000              0.1636649        
 10     44.3100000              0.2887998        
 11     20.6500000              0.3459070        
 12      9.7290000              0.2058713        
 13      4.2280000              0.0325950        
 14      1.9690000             -0.0006392        
 15      0.8890000              0.0014474        
 16      0.3964000             -0.0001751        
S   16
  1 1224000.0000000            -0.0000094        
  2 183200.0000000             -0.0000297        
  3  41700.0000000             -0.0000916        
  4  11810.0000000             -0.0002753        
  5   3853.0000000             -0.0008427        
  6   1391.0000000             -0.0025382        
  7    542.5000000             -0.0072706        
  8    224.9000000             -0.0190949        
  9     97.9300000             -0.0450056        
 10     44.3100000             -0.0901063        
 11     20.6500000             -0.1429400        
 12      9.7290000             -0.1232733        
 13      4.2280000              0.1016495        
 14      1.9690000              0.4178921        
 15      0.8890000              0.4740231        
 16      0.3964000              0.1619561        
S   16
  1 1224000.0000000             0.0000014        
  2 183200.0000000              0.0000045        
  3  41700.0000000              0.0000138        
  4  11810.0000000              0.0000414        
  5   3853.0000000              0.0001269        
  6   1391.0000000              0.0003813        
  7    542.5000000              0.0010962        
  8    224.9000000              0.0028743        
  9     97.9300000              0.0068266        
 10     44.3100000              0.0137060        
 11     20.6500000              0.0222733        
 12      9.7290000              0.0194615        
 13      4.2280000             -0.0171479        
 14      1.9690000             -0.0774282        
 15      0.8890000             -0.1139147        
 16      0.3964000             -0.1380056        
S   1
  1      0.0699300              1.0000000        
S   1
  1      0.0328900              1.0000000        
S   1
  1      0.0161200              1.0000000        
S   1
  1     24.2820000              1.0000000        
S   1
  1      4.8740000              1.0000000        
S   1
  1      0.9780000              1.0000000        
S   1
  1      0.0050300              1.0000000        
P   9
  1    413.4000000              0.0009678        
  2     97.9800000              0.0075358        
  3     31.3700000              0.0359650        
  4     11.6200000              0.1187550        
  5      4.6710000              0.2614638        
  6      1.9180000              0.3782233        
  7      0.7775000              0.3344927        
  8      0.3013000              0.1267953        
  9      0.2275000             -0.0146216        
P   9
  1    413.4000000             -0.0000961        
  2     97.9800000             -0.0007513        
  3     31.3700000             -0.0035957        
  4     11.6200000             -0.0120397        
  5      4.6710000             -0.0267252        
  6      1.9180000             -0.0392593        
  7      0.7775000             -0.0375978        
  8      0.3013000             -0.0433062        
  9      0.2275000              0.0518049        
P   1
  1      0.0752700              1.0000000        
P   1
  1      0.0312600              1.0000000        
P   1
  1      0.0134200              1.0000000        
P   1
  1      4.4660000              1.0000000        
P   1
  1      1.6890000              1.0000000        
P   1
  1      0.6380000              1.0000000        
P   1
  1      0.0077200              1.0000000        
D   1
  1      0.1538000              1.0000000        
D   1
  1      0.0865000              1.0000000        
D   1
  1      0.0487000              1.0000000        
D   1
  1      8.6060000              1.0000000        
D   1
  1      3.1370000              1.0000000        
D   1
  1      1.1440000              1.0000000        
D   1
  1      0.0210000              1.0000000        
F   1
  1      0.1912000              1.0000000        
F   1
  1      0.1036000              1.0000000        
F   1
  1      6.2580000              1.0000000        
F   1
  1      2.1730000              1.0000000        
F   1
  1      0.0453000              1.0000000        
G   1
  1      0.1722000              1.0000000        
G   1
  1      4.0970000              1.0000000        
G   1
  1      0.0866000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   13
  1 327600.0000000              0.0001374        
  2  49050.0000000              0.0004833        
  3  11150.0000000              0.0017106        
  4   3152.0000000              0.0059767        
  5   1025.0000000              0.0199746        
  6    368.8000000              0.0599650        
  7    143.2000000              0.1525833        
  8     58.9600000              0.3010112        
  9     25.4000000              0.3799765        
 10     11.1500000              0.2123223        
 11      4.0040000              0.0229431        
 12      1.7010000             -0.0022859        
 13      0.7060000              0.0012788        
S   13
  1 327600.0000000             -0.0000349        
  2  49050.0000000             -0.0001225        
  3  11150.0000000             -0.0004355        
  4   3152.0000000             -0.0015201        
  5   1025.0000000             -0.0051629        
  6    368.8000000             -0.0157370        
  7    143.2000000             -0.0428686        
  8     58.9600000             -0.0945231        
  9     25.4000000             -0.1634933        
 10     11.1500000             -0.1230493        
 11      4.0040000              0.2381350        
 12      1.7010000              0.5772301        
 13      0.7060000              0.3329505        
S   13
  1 327600.0000000              0.0000067        
  2  49050.0000000              0.0000236        
  3  11150.0000000              0.0000839        
  4   3152.0000000              0.0002930        
  5   1025.0000000              0.0009960        
  6    368.8000000              0.0030394        
  7    143.2000000              0.0083179        
  8     58.9600000              0.0184823        
  9     25.4000000              0.0327037        
 10     11.1500000              0.0253174        
 11      4.0040000             -0.0540287        
 12      1.7010000             -0.1574594        
 13      0.7060000             -0.2052544        
S   1
  1      0.1410000              1.0000000        
S   1
  1      0.0680800              1.0000000        
S   1
  1      0.0306300              1.0000000        
S   1
  1     23.2430000              1.0000000        
S   1
  1      9.5610000              1.0000000        
S   1
  1      3.9330000              1.0000000        
S   1
  1      0.0123900              1.0000000        
P   9
  1    539.6000000              0.0009048        
  2    127.9000000              0.0070359        
  3     41.0200000              0.0340630        
  4     15.2500000              0.1147194        
  5      6.1660000              0.2596377        
  6      2.5610000              0.3849025        
  7      1.0600000              0.3351348        
  8      0.4176000              0.1105931        
  9      0.2690000             -0.0120673        
P   9
  1    539.6000000             -0.0001429        
  2    127.9000000             -0.0011146        
  3     41.0200000             -0.0054224        
  4     15.2500000             -0.0185437        
  5      6.1660000             -0.0426194        
  6      2.5610000             -0.0644771        
  7      1.0600000             -0.0626349        
  8      0.4176000             -0.0244757        
  9      0.2690000              0.1040184        
P   1
  1      0.1223000              1.0000000        
P   1
  1      0.0547600              1.0000000        
P   1
  1      0.0238800              1.0000000        
P   1
  1     39.5360000              1.0000000        
P   1
  1     12.7780000              1.0000000        
P   1
  1      4.1300000              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.1060000              1.0000000        
D   1
  1      0.1944000              1.0000000        
D   1
  1      0.3570000              1.0000000        
D   1
  1     12.5330000              1.0000000        
D   1
  1      4.6770000              1.0000000        
D   1
  1      1.7450000              1.0000000        
D   1
  1      0.0382000              1.0000000        
F   1
  1      0.1810000              1.0000000        
F   1
  1      0.3590000              1.0000000        
F   1
  1      7.8760000              1.0000000        
F   1
  1      2.8050000              1.0000000        
F   1
  1      0.0700000              1.0000000        
G   1
  1      0.3070000              1.0000000        
G   1
  1      5.3940000              1.0000000        
G   1
  1      0.1480000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   13
  1 419600.0000000              0.0001389        
  2  62830.0000000              0.0004753        
  3  14290.0000000              0.0016292        
  4   4038.0000000              0.0055290        
  5   1312.0000000              0.0182635        
  6    470.5000000              0.0551514        
  7    181.8000000              0.1426944        
  8     74.4600000              0.2897463        
  9     31.9000000              0.3835431        
 10     13.9600000              0.2312693        
 11      5.1800000              0.0290679        
 12      2.2650000             -0.0029729        
 13      0.9664000              0.0016503        
S   13
  1 419600.0000000             -0.0000362        
  2  62830.0000000             -0.0001241        
  3  14290.0000000             -0.0004267        
  4   4038.0000000             -0.0014484        
  5   1312.0000000             -0.0048507        
  6    470.5000000             -0.0148872        
  7    181.8000000             -0.0409761        
  8     74.4600000             -0.0928521        
  9     31.9000000             -0.1646399        
 10     13.9600000             -0.1393633        
 11      5.1800000              0.1984186        
 12      2.2650000              0.5723849        
 13      0.9664000              0.3712390        
S   13
  1 419600.0000000              0.0000084        
  2  62830.0000000              0.0000286        
  3  14290.0000000              0.0000986        
  4   4038.0000000              0.0003344        
  5   1312.0000000              0.0011225        
  6    470.5000000              0.0034429        
  7    181.8000000              0.0095440        
  8     74.4600000              0.0217412        
  9     31.9000000              0.0396522        
 10     13.9600000              0.0343707        
 11      5.1800000             -0.0536225        
 12      2.2650000             -0.1927024        
 13      0.9664000             -0.2522909        
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1184000              1.0000000        
S   1
  1      0.0502100              1.0000000        
S   1
  1      9.7290000              1.0000000        
S   1
  1      4.8700000              1.0000000        
S   1
  1      2.4370000              1.0000000        
S   1
  1      0.0183000              1.0000000        
P   8
  1    891.3000000              0.0005579        
  2    211.3000000              0.0042974        
  3     68.2800000              0.0215372        
  4     25.7000000              0.0767988        
  5     10.6300000              0.1945799        
  6      4.6020000              0.3343660        
  7      2.0150000              0.3746890        
  8      0.8706000              0.2038459        
P   8
  1    891.3000000             -0.0001007        
  2    211.3000000             -0.0007704        
  3     68.2800000             -0.0039192        
  4     25.7000000             -0.0139974        
  5     10.6300000             -0.0367111        
  6      4.6020000             -0.0627027        
  7      2.0150000             -0.0788205        
  8      0.8706000             -0.0286871        
P   1
  1      0.2972000              1.0000000        
P   1
  1      0.1100000              1.0000000        
P   1
  1      0.0398900              1.0000000        
P   1
  1     10.0000000              1.0000000        
P   1
  1      4.5140000              1.0000000        
P   1
  1      2.0380000              1.0000000        
P   1
  1      0.0121000              1.0000000        
D   1
  1      0.0804000              1.0000000        
D   1
  1      0.1990000              1.0000000        
D   1
  1      0.4940000              1.0000000        
D   1
  1     14.8350000              1.0000000        
D   1
  1      5.6370000              1.0000000        
D   1
  1      2.1420000              1.0000000        
D   1
  1      0.0282000              1.0000000        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
F   1
  1      9.8530000              1.0000000        
F   1
  1      3.5250000              1.0000000        
F   1
  1      0.0582000              1.0000000        
G   1
  1      0.3570000              1.0000000        
G   1
  1      6.8940000              1.0000000        
G   1
  1      0.1530000              1.0000000


name: aug-cc-pCVQZ-DK
description: QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
elt: Si
data:
SILICON
S   13
  1 513000.0000000              0.0001438        
  2  76820.0000000              0.0004823        
  3  17470.0000000              0.0016122        
  4   4935.0000000              0.0053396        
  5   1602.0000000              0.0174067        
  6    574.1000000              0.0524374        
  7    221.5000000              0.1367697        
  8     90.5400000              0.2819429        
  9     38.7400000              0.3839309        
 10     16.9500000              0.2437420        
 11      6.4520000              0.0339535        
 12      2.8740000             -0.0033064        
 13      1.2500000              0.0018550        
S   13
  1 513000.0000000             -0.0000384        
  2  76820.0000000             -0.0001290        
  3  17470.0000000             -0.0004325        
  4   4935.0000000             -0.0014340        
  5   1602.0000000             -0.0047331        
  6    574.1000000             -0.0145011        
  7    221.5000000             -0.0400944        
  8     90.5400000             -0.0921542        
  9     38.7400000             -0.1657971        
 10     16.9500000             -0.1503143        
 11      6.4520000              0.1721760        
 12      2.8740000              0.5693971        
 13      1.2500000              0.3947389        
S   13
  1 513000.0000000              0.0000099        
  2  76820.0000000              0.0000330        
  3  17470.0000000              0.0001109        
  4   4935.0000000              0.0003672        
  5   1602.0000000              0.0012158        
  6    574.1000000              0.0037197        
  7    221.5000000              0.0103715        
  8     90.5400000              0.0239422        
  9     38.7400000              0.0444389        
 10     16.9500000              0.0412255        
 11      6.4520000             -0.0513350        
 12      2.8740000             -0.2176605        
 13      1.2500000             -0.2841831        
S   1
  1      0.3599000              1.0000000        
S   1
  1      0.1699000              1.0000000        
S   1
  1      0.0706600              1.0000000        
S   1
  1     12.1640000              1.0000000        
S   1
  1      6.1870000              1.0000000        
S   1
  1      3.1470000              1.0000000        
S   1
  1      0.0275000              1.0000000        
P   8
  1   1122.0000000              0.0005232        
  2    266.0000000              0.0039764        
  3     85.9200000              0.0201449        
  4     32.3300000              0.0731848        
  5     13.3700000              0.1902497        
  6      5.8000000              0.3356425        
  7      2.5590000              0.3789449        
  8      1.1240000              0.2008937        
P   8
  1   1122.0000000             -0.0001125        
  2    266.0000000             -0.0008461        
  3     85.9200000             -0.0043718        
  4     32.3300000             -0.0158505        
  5     13.3700000             -0.0430226        
  6      5.8000000             -0.0751907        
  7      2.5590000             -0.0969744        
  8      1.1240000             -0.0224752        
P   1
  1      0.3988000              1.0000000        
P   1
  1      0.1533000              1.0000000        
P   1
  1      0.0572800              1.0000000        
P   1
  1     12.6460000              1.0000000        
P   1
  1      5.7470000              1.0000000        
P   1
  1      2.6120000              1.0000000        
P   1
  1      0.0200000              1.0000000        
D   1
  1      0.1200000              1.0000000        
D   1
  1      0.3020000              1.0000000        
D   1
  1      0.7600000              1.0000000        
D   1
  1     19.0150000              1.0000000        
D   1
  1      7.4010000              1.0000000        
D   1
  1      2.8810000              1.0000000        
D   1
  1      0.0435000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
F   1
  1     11.9250000              1.0000000        
F   1
  1      4.3040000              1.0000000        
F   1
  1      0.0846000              1.0000000        
G   1
  1      0.4610000              1.0000000        
G   1
  1      8.5770000              1.0000000        
G   1
  1      0.2120000              1.0000000


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


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


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


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


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   5988.0000000              0.0001330        
  2    898.9000000              0.0010250        
  3    205.9000000              0.0052720        
  4     59.2400000              0.0209290        
  5     19.8700000              0.0663400        
  6      7.4060000              0.1657750        
  7      2.9300000              0.3150380        
  8      1.1890000              0.3935230        
  9      0.4798000              0.1908700        
S   9
  1   5988.0000000             -0.0000210        
  2    898.9000000             -0.0001610        
  3    205.9000000             -0.0008200        
  4     59.2400000             -0.0033260        
  5     19.8700000             -0.0105190        
  6      7.4060000             -0.0280970        
  7      2.9300000             -0.0559360        
  8      1.1890000             -0.0992370        
  9      0.4798000             -0.1121890        
S   1
  1      0.0750900              1.0000000        
S   1
  1      0.0283200              1.0000000        
S   1
  1      1.9740000              1.0000000        
S   1
  1      0.6830000              1.0000000        
S   1
  1      0.0076000              1.0000000        
P   3
  1      3.2660000              0.0086300        
  2      0.6511000              0.0475380        
  3      0.1696000              0.2097720        
P   1
  1      0.0557800              1.0000000        
P   1
  1      0.0205000              1.0000000        
P   1
  1      7.3200000              1.0000000        
P   1
  1      1.8750000              1.0000000        
P   1
  1      0.0091000              1.0000000        
D   1
  1      0.1874000              1.0000000        
D   1
  1      0.0801000              1.0000000        
D   1
  1      4.9120000              1.0000000        
D   1
  1      0.0371000              1.0000000        
F   1
  1      0.1829000              1.0000000        
F   1
  1      0.0816000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1   6863.0000000              0.0002360        
  2   1030.0000000              0.0018260        
  3    234.7000000              0.0094520        
  4     66.5600000              0.0379570        
  5     21.6900000              0.1199650        
  6      7.7340000              0.2821620        
  7      2.9160000              0.4274040        
  8      1.1300000              0.2662780        
  9      0.1101000             -0.0072750        
S   9
  1   6863.0000000             -0.0000430        
  2   1030.0000000             -0.0003330        
  3    234.7000000             -0.0017360        
  4     66.5600000             -0.0070120        
  5     21.6900000             -0.0231260        
  6      7.7340000             -0.0581380        
  7      2.9160000             -0.1145560        
  8      1.1300000             -0.1359080        
  9      0.1101000              0.5774410        
S   1
  1      0.2577000              1.0000000        
S   1
  1      0.0440900              1.0000000        
S   1
  1      4.6040000              1.0000000        
S   1
  1      1.6170000              1.0000000        
S   1
  1      0.0150300              1.0000000        
P   3
  1      7.4360000              0.0107360        
  2      1.5770000              0.0628540        
  3      0.4352000              0.2481800        
P   1
  1      0.1438000              1.0000000        
P   1
  1      0.0499400              1.0000000        
P   1
  1     14.4970000              1.0000000        
P   1
  1      3.7870000              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.3480000              1.0000000        
D   1
  1      0.1803000              1.0000000        
D   1
  1      9.1830000              1.0000000        
D   1
  1      0.0654000              1.0000000        
F   1
  1      0.3250000              1.0000000        
F   1
  1      0.1533000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: B
data:
BORON
S   8
  1   5473.0000000              0.0005550        
  2    820.9000000              0.0042910        
  3    186.8000000              0.0219490        
  4     52.8300000              0.0844410        
  5     17.0800000              0.2385570        
  6      5.9990000              0.4350720        
  7      2.2080000              0.3419550        
  8      0.2415000             -0.0095450        
S   8
  1   5473.0000000             -0.0001120        
  2    820.9000000             -0.0008680        
  3    186.8000000             -0.0044840        
  4     52.8300000             -0.0176830        
  5     17.0800000             -0.0536390        
  6      5.9990000             -0.1190050        
  7      2.2080000             -0.1658240        
  8      0.2415000              0.5959810        
S   1
  1      0.5879000              1.0000000        
S   1
  1      0.0861000              1.0000000        
S   1
  1      2.9400000              1.0000000        
S   1
  1      8.3110000              1.0000000        
S   1
  1      0.0291400              1.0000000        
P   3
  1     12.0500000              0.0131180        
  2      2.6130000              0.0798960        
  3      0.7475000              0.2772750        
P   1
  1      0.2385000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1      6.0160000              1.0000000        
P   1
  1     22.8910000              1.0000000        
P   1
  1      0.0209600              1.0000000        
D   1
  1      0.6610000              1.0000000        
D   1
  1      0.1990000              1.0000000        
D   1
  1     13.0150000              1.0000000        
D   1
  1      0.0604000              1.0000000        
F   1
  1      0.4900000              1.0000000        
F   1
  1      0.1630000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: C
data:
CARBON
S   8
  1   8236.0000000              0.0005310        
  2   1235.0000000              0.0041080        
  3    280.8000000              0.0210870        
  4     79.2700000              0.0818530        
  5     25.5900000              0.2348170        
  6      8.9970000              0.4344010        
  7      3.3190000              0.3461290        
  8      0.3643000             -0.0089830        
S   8
  1   8236.0000000             -0.0001130        
  2   1235.0000000             -0.0008780        
  3    280.8000000             -0.0045400        
  4     79.2700000             -0.0181330        
  5     25.5900000             -0.0557600        
  6      8.9970000             -0.1268950        
  7      3.3190000             -0.1703520        
  8      0.3643000              0.5986840        
S   1
  1      0.9059000              1.0000000        
S   1
  1      0.1285000              1.0000000        
S   1
  1      4.2920000              1.0000000        
S   1
  1     11.8760000              1.0000000        
S   1
  1      0.0440200              1.0000000        
P   3
  1     18.7100000              0.0140310        
  2      4.1330000              0.0868660        
  3      1.2000000              0.2902160        
P   1
  1      0.3827000              1.0000000        
P   1
  1      0.1209000              1.0000000        
P   1
  1      8.7780000              1.0000000        
P   1
  1     33.1900000              1.0000000        
P   1
  1      0.0356900              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.3180000              1.0000000        
D   1
  1     14.8390000              1.0000000        
D   1
  1      0.1000000              1.0000000        
F   1
  1      0.7610000              1.0000000        
F   1
  1      0.2680000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   8
  1  11420.0000000              0.0005230        
  2   1712.0000000              0.0040450        
  3    389.3000000              0.0207750        
  4    110.0000000              0.0807270        
  5     35.5700000              0.2330740        
  6     12.5400000              0.4335010        
  7      4.6440000              0.3474720        
  8      0.5118000             -0.0085080        
S   8
  1  11420.0000000             -0.0001150        
  2   1712.0000000             -0.0008950        
  3    389.3000000             -0.0046240        
  4    110.0000000             -0.0185280        
  5     35.5700000             -0.0573390        
  6     12.5400000             -0.1320760        
  7      4.6440000             -0.1725100        
  8      0.5118000              0.5999440        
S   1
  1      1.2930000              1.0000000        
S   1
  1      0.1787000              1.0000000        
S   1
  1      5.9520000              1.0000000        
S   1
  1     16.2010000              1.0000000        
S   1
  1      0.0576000              1.0000000        
P   3
  1     26.6300000              0.0146700        
  2      5.9480000              0.0917640        
  3      1.7420000              0.2986830        
P   1
  1      0.5550000              1.0000000        
P   1
  1      0.1725000              1.0000000        
P   1
  1     11.8710000              1.0000000        
P   1
  1     44.8490000              1.0000000        
P   1
  1      0.0491000              1.0000000        
D   1
  1      1.6540000              1.0000000        
D   1
  1      0.4690000              1.0000000        
D   1
  1     14.2000000              1.0000000        
D   1
  1      0.1510000              1.0000000        
F   1
  1      1.0930000              1.0000000        
F   1
  1      0.3640000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   8
  1  15330.0000000              0.0005080        
  2   2299.0000000              0.0039290        
  3    522.4000000              0.0202430        
  4    147.3000000              0.0791810        
  5     47.5500000              0.2306870        
  6     16.7600000              0.4331180        
  7      6.2070000              0.3502600        
  8      0.6882000             -0.0081540        
S   8
  1  15330.0000000             -0.0001150        
  2   2299.0000000             -0.0008950        
  3    522.4000000             -0.0046360        
  4    147.3000000             -0.0187240        
  5     47.5500000             -0.0584630        
  6     16.7600000             -0.1364630        
  7      6.2070000             -0.1757400        
  8      0.6882000              0.6034180        
S   1
  1      1.7520000              1.0000000        
S   1
  1      0.2384000              1.0000000        
S   1
  1      7.8450000              1.0000000        
S   1
  1     21.0320000              1.0000000        
S   1
  1      0.0737600              1.0000000        
P   3
  1     34.4600000              0.0159280        
  2      7.7490000              0.0997400        
  3      2.2800000              0.3104920        
P   1
  1      0.7156000              1.0000000        
P   1
  1      0.2140000              1.0000000        
P   1
  1     15.1590000              1.0000000        
P   1
  1     57.4370000              1.0000000        
P   1
  1      0.0597400              1.0000000        
D   1
  1      2.3140000              1.0000000        
D   1
  1      0.6450000              1.0000000        
D   1
  1     15.8580000              1.0000000        
D   1
  1      0.2140000              1.0000000        
F   1
  1      1.4280000              1.0000000        
F   1
  1      0.5000000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   8
  1  19500.0000000              0.0005070        
  2   2923.0000000              0.0039230        
  3    664.5000000              0.0202000        
  4    187.5000000              0.0790100        
  5     60.6200000              0.2304390        
  6     21.4200000              0.4328720        
  7      7.9500000              0.3499640        
  8      0.8815000             -0.0078920        
S   8
  1  19500.0000000             -0.0001170        
  2   2923.0000000             -0.0009120        
  3    664.5000000             -0.0047170        
  4    187.5000000             -0.0190860        
  5     60.6200000             -0.0596550        
  6     21.4200000             -0.1400100        
  7      7.9500000             -0.1767820        
  8      0.8815000              0.6050430        
S   1
  1      2.2570000              1.0000000        
S   1
  1      0.3041000              1.0000000        
S   1
  1      9.8120000              1.0000000        
S   1
  1     25.9430000              1.0000000        
S   1
  1      0.0915800              1.0000000        
P   3
  1     43.8800000              0.0166650        
  2      9.9260000              0.1044720        
  3      2.9300000              0.3172600        
P   1
  1      0.9132000              1.0000000        
P   1
  1      0.2672000              1.0000000        
P   1
  1     18.7560000              1.0000000        
P   1
  1     71.3480000              1.0000000        
P   1
  1      0.0736100              1.0000000        
D   1
  1      3.1070000              1.0000000        
D   1
  1      0.8550000              1.0000000        
D   1
  1     19.1080000              1.0000000        
D   1
  1      0.2920000              1.0000000        
F   1
  1      1.9170000              1.0000000        
F   1
  1      0.7240000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ne
data:
NEON
S   8
  1  24350.0000000              0.0005020        
  2   3650.0000000              0.0038810        
  3    829.6000000              0.0199970        
  4    234.0000000              0.0784180        
  5     75.6100000              0.2296760        
  6     26.7300000              0.4327220        
  7      9.9270000              0.3506420        
  8      1.1020000             -0.0076450        
S   8
  1  24350.0000000             -0.0001180        
  2   3650.0000000             -0.0009150        
  3    829.6000000             -0.0047370        
  4    234.0000000             -0.0192330        
  5     75.6100000             -0.0603690        
  6     26.7300000             -0.1425080        
  7      9.9270000             -0.1777100        
  8      1.1020000              0.6058360        
S   1
  1      2.8360000              1.0000000        
S   1
  1      0.3782000              1.0000000        
S   1
  1     12.0830000              1.0000000        
S   1
  1     31.9470000              1.0000000        
S   1
  1      0.1133000              1.0000000        
P   3
  1     54.7000000              0.0171510        
  2     12.4300000              0.1076560        
  3      3.6790000              0.3216810        
P   1
  1      1.1430000              1.0000000        
P   1
  1      0.3300000              1.0000000        
P   1
  1     22.8270000              1.0000000        
P   1
  1     87.0170000              1.0000000        
P   1
  1      0.0917500              1.0000000        
D   1
  1      4.0140000              1.0000000        
D   1
  1      1.0960000              1.0000000        
D   1
  1     23.1680000              1.0000000        
D   1
  1      0.3860000              1.0000000        
F   1
  1      2.5440000              1.0000000        
F   1
  1      1.0840000              1.0000000


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


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


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


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


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


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: S
data:
SULFUR
S   13
  1 374100.0000000              0.542140E-04     
  2  56050.0000000              0.420855E-03     
  3  12760.0000000              0.220698E-02     
  4   3615.0000000              0.919258E-02     
  5   1183.0000000              0.321123E-01     
  6    428.8000000              0.946683E-01     
  7    167.8000000              0.223630E+00     
  8     69.4700000              0.374393E+00     
  9     29.8400000              0.329108E+00     
 10     12.7200000              0.847038E-01     
 11      5.2440000              0.440851E-03     
 12      2.2190000              0.164827E-02     
 13      0.3490000              0.301306E-03     
S   13
  1 374100.0000000             -0.149837E-04     
  2  56050.0000000             -0.116198E-03     
  3  12760.0000000             -0.611583E-03     
  4   3615.0000000             -0.255370E-02     
  5   1183.0000000             -0.908708E-02     
  6    428.8000000             -0.277045E-01     
  7    167.8000000             -0.720020E-01     
  8     69.4700000             -0.146439E+00     
  9     29.8400000             -0.195150E+00     
 10     12.7200000              0.819193E-02     
 11      5.2440000              0.516601E+00     
 12      2.2190000              0.542178E+00     
 13      0.3490000             -0.918072E-02     
S   13
  1 374100.0000000              0.435066E-05     
  2  56050.0000000              0.337140E-04     
  3  12760.0000000              0.177674E-03     
  4   3615.0000000              0.741116E-03     
  5   1183.0000000              0.264591E-02     
  6    428.8000000              0.807487E-02     
  7    167.8000000              0.212276E-01     
  8     69.4700000              0.438323E-01     
  9     29.8400000              0.612716E-01     
 10     12.7200000             -0.361510E-02     
 11      5.2440000             -0.204510E+00     
 12      2.2190000             -0.381871E+00     
 13      0.3490000              0.714147E+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
S   1
  1     12.9280000              1.0000000        
S   1
  1      2.4130000              1.0000000        
S   1
  1      0.0497000              1.0000000        
P   7
  1    574.4000000              0.242264E-02     
  2    135.8000000              0.192796E-01     
  3     43.1900000              0.885401E-01     
  4     15.8700000              0.254654E+00     
  5      6.2080000              0.433984E+00     
  6      2.4830000              0.354953E+00     
  7      0.3229000             -0.502977E-02     
P   7
  1    574.4000000             -0.620102E-03     
  2    135.8000000             -0.493882E-02     
  3     43.1900000             -0.232647E-01     
  4     15.8700000             -0.685195E-01     
  5      6.2080000             -0.123896E+00     
  6      2.4830000             -0.969499E-01     
  7      0.3229000              0.569394E+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
P   1
  1      8.1140000              1.0000000        
P   1
  1      3.1060000              1.0000000        
P   1
  1      0.0351000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
D   1
  1     15.2540000              1.0000000        
D   1
  1      4.8450000              1.0000000        
D   1
  1      0.1010000              1.0000000        
F   1
  1      0.5570000              1.0000000        
F   1
  1     10.0520000              1.0000000        
F   1
  1      0.2180000              1.0000000


name: aug-cc-pCVTZ
description: TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   13
  1 456100.0000000              0.492970E-04     
  2  68330.0000000              0.383029E-03     
  3  15550.0000000              0.200854E-02     
  4   4405.0000000              0.838558E-02     
  5   1439.0000000              0.294703E-01     
  6    520.4000000              0.878325E-01     
  7    203.1000000              0.211473E+00     
  8     83.9600000              0.365364E+00     
  9     36.2000000              0.340884E+00     
 10     15.8300000              0.102133E+00     
 11      6.3340000              0.311675E-02     
 12      2.6940000              0.105751E-02     
 13      0.4313000              0.156136E-03     
S   13
  1 456100.0000000             -0.138304E-04     
  2  68330.0000000             -0.107279E-03     
  3  15550.0000000             -0.565083E-03     
  4   4405.0000000             -0.236135E-02     
  5   1439.0000000             -0.845886E-02     
  6    520.4000000             -0.259638E-01     
  7    203.1000000             -0.686362E-01     
  8     83.9600000             -0.141874E+00     
  9     36.2000000             -0.199319E+00     
 10     15.8300000             -0.195662E-01     
 11      6.3340000              0.499741E+00     
 12      2.6940000              0.563736E+00     
 13      0.4313000             -0.835091E-02     
S   13
  1 456100.0000000              0.418546E-05     
  2  68330.0000000              0.324395E-04     
  3  15550.0000000              0.171105E-03     
  4   4405.0000000              0.714176E-03     
  5   1439.0000000              0.256705E-02     
  6    520.4000000              0.788552E-02     
  7    203.1000000              0.210867E-01     
  8     83.9600000              0.442264E-01     
  9     36.2000000              0.651670E-01     
 10     15.8300000              0.603012E-02     
 11      6.3340000             -0.206495E+00     
 12      2.6940000             -0.405871E+00     
 13      0.4313000              0.725661E+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
S   1
  1     15.0640000              1.0000000        
S   1
  1      2.8740000              1.0000000        
S   1
  1      0.0591000              1.0000000        
P   7
  1    663.3000000              0.240448E-02     
  2    156.8000000              0.192148E-01     
  3     49.9800000              0.885097E-01     
  4     18.4200000              0.256020E+00     
  5      7.2400000              0.436927E+00     
  6      2.9220000              0.350334E+00     
  7      0.3818000             -0.458423E-02     
P   7
  1    663.3000000             -0.652145E-03     
  2    156.8000000             -0.519445E-02     
  3     49.9800000             -0.246938E-01     
  4     18.4200000             -0.728167E-01     
  5      7.2400000             -0.134030E+00     
  6      2.9220000             -0.947742E-01     
  7      0.3818000              0.564667E+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
P   1
  1      9.4800000              1.0000000        
P   1
  1      3.6680000              1.0000000        
P   1
  1      0.0419000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1     17.9570000              1.0000000        
D   1
  1      5.7600000              1.0000000        
D   1
  1      0.1350000              1.0000000        
F   1
  1      0.7060000              1.0000000        
F   1
  1     11.7790000              1.0000000        
F   1
  1      0.3120000              1.0000000


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: Al
data:
ALUMINUM
S   1
  1      0.0177000              1.0000000        
P   1
  1      0.0115000              1.0000000        
D   1
  1      0.0254000              1.0000000        
F   1
  1      0.0509000              1.0000000        
G   1
  1      0.1069000              1.0000000        
H   1
  1      0.2270000              1.0000000


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: Si
data:
SILICON
S   1
  1      0.0260000              1.0000000        
P   1
  1      0.0192000              1.0000000        
D   1
  1      0.0390000              1.0000000        
F   1
  1      0.0735000              1.0000000        
G   1
  1      0.1510000              1.0000000        
H   1
  1      0.3230000              1.0000000


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: P
data:
PHOSPHORUS
S   1
  1      0.0335000              1.0000000        
P   1
  1      0.0253000              1.0000000        
D   1
  1      0.0537000              1.0000000        
F   1
  1      0.0950000              1.0000000        
G   1
  1      0.1840000              1.0000000        
H   1
  1      0.3720000              1.0000000


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: S
data:
SULFUR
S   1
  1      0.0420000              1.0000000        
P   1
  1      0.0294000              1.0000000        
D   1
  1      0.0664000              1.0000000        
F   1
  1      0.1188000              1.0000000        
G   1
  1      0.2200000              1.0000000        
H   1
  1      0.4720000              1.0000000


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: Cl
data:
CHLORINE
S   1
  1      0.0479000              1.0000000        
P   1
  1      0.0348000              1.0000000        
D   1
  1      0.0836000              1.0000000        
F   1
  1      0.1640000              1.0000000        
G   1
  1      0.2770000              1.0000000        
H   1
  1      0.6070000              1.0000000


name: aug-cc-pV(5+d)Z Diffuse
description: 1D Diffuse Functions
elt: Ar
data:
ARGON
S   1
  1      0.0538000              1.0000000        
P   1
  1      0.0402000              1.0000000        
D   1
  1      0.0978000              1.0000000        
F   1
  1      0.2090000              1.0000000        
G   1
  1      0.3340000              1.0000000        
H   1
  1      0.7420000              1.0000000


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


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


