# all_value

name: maug-cc-pV(T+d)Z
description: Minimally augmented cc-pV(T+d)Z
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      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      0.0419000              1.0000000        
D   1
  1      4.6100000              1.0000000        
D   1
  1      1.0110000              1.0000000        
D   1
  1      0.3390000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: maug-cc-pV(T+d)Z
description: Minimally augmented cc-pV(T+d)Z
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      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      0.0487000              1.0000000        
D   1
  1      5.5510000              1.0000000        
D   1
  1      1.2350000              1.0000000        
D   1
  1      0.4120000              1.0000000        
F   1
  1      0.8900000              1.0000000


name: maug-cc-pVDZ
elt: H
description:
maug-cc-pVDZ basis set is the cc-pVDZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVDZ, which we abbreviate maug-cc-pVDZ.


name: maug-cc-pVDZ
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      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      0.0153000              1.0000000        
D   1
  1      0.1890000              1.0000000


name: maug-cc-pVDZ
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      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      0.0250000              1.0000000        
D   1
  1      0.2750000              1.0000000


name: maug-cc-pVDZ
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      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      0.0343000              1.0000000        
D   1
  1      0.3730000              1.0000000


name: maug-cc-pVDZ
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      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      0.0399000              1.0000000        
D   1
  1      0.4790000              1.0000000


name: maug-cc-pVDZ
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      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      0.0466000              1.0000000        
D   1
  1      0.6000000              1.0000000


name: maug-cc-pVDZ
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      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      0.0533000              1.0000000        
D   1
  1      0.7380000              1.0000000


name: maug-cc-pVQZ
elt: H
description:
maug-cc-pVQZ basis set is the cc-pVQZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVQZ, which we abbreviate maug-cc-pVQZ


name: maug-cc-pVQZ
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      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      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        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
G   1
  1      0.3570000              1.0000000


name: maug-cc-pVQZ
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      0.1200000              1.0000000        
D   1
  1      0.3020000              1.0000000        
D   1
  1      0.7600000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
G   1
  1      0.4610000              1.0000000


name: maug-cc-pVQZ
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      0.1650000              1.0000000        
D   1
  1      0.4130000              1.0000000        
D   1
  1      1.0360000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
G   1
  1      0.5970000              1.0000000


name: maug-cc-pVQZ
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      0.2030000              1.0000000        
D   1
  1      0.5040000              1.0000000        
D   1
  1      1.2500000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
G   1
  1      0.6830000              1.0000000


name: maug-cc-pVQZ
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      0.2540000              1.0000000        
D   1
  1      0.6280000              1.0000000        
D   1
  1      1.5510000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
G   1
  1      0.8270000              1.0000000


name: maug-cc-pVQZ
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      0.3110000              1.0000000        
D   1
  1      0.7630000              1.0000000        
D   1
  1      1.8730000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
G   1
  1      1.0070000              1.0000000


name: maug-cc-pVTZ
elt: H
description:
maug-cc-pVTZ basis set is the cc-pVTZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVTZ, which we abbreviate maug-cc-pVTZ.


name: maug-cc-pVTZ
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      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      0.0146000              1.0000000        
D   1
  1      0.1090000              1.0000000        
D   1
  1      0.3330000              1.0000000        
F   1
  1      0.2440000              1.0000000


name: maug-cc-pVTZ
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      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      0.0237000              1.0000000        
D   1
  1      0.1590000              1.0000000        
D   1
  1      0.4810000              1.0000000        
F   1
  1      0.3360000              1.0000000


name: maug-cc-pVTZ
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      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      0.0307000              1.0000000        
D   1
  1      0.2160000              1.0000000        
D   1
  1      0.6520000              1.0000000        
F   1
  1      0.4520000              1.0000000


name: maug-cc-pVTZ
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      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      0.0351000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
F   1
  1      0.5570000              1.0000000


name: maug-cc-pVTZ
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      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      0.0419000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: maug-cc-pVTZ
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      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      0.0487000              1.0000000        
D   1
  1      0.4100000              1.0000000        
D   1
  1      1.2540000              1.0000000        
F   1
  1      0.8900000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
elt: Li
data:
LITHIUM
S   9
  1   6601.0000000              0.0001170        
  2    989.7000000              0.0009110        
  3    225.7000000              0.0047280        
  4     64.2900000              0.0191970        
  5     21.1800000              0.0630470        
  6      7.7240000              0.1632080        
  7      3.0030000              0.3148270        
  8      1.2120000              0.3939360        
  9      0.4930000              0.1969180        
S   9
  1   6601.0000000             -0.0000180        
  2    989.7000000             -0.0001420        
  3    225.7000000             -0.0007410        
  4     64.2900000             -0.0030200        
  5     21.1800000             -0.0101230        
  6      7.7240000             -0.0270940        
  7      3.0030000             -0.0573590        
  8      1.2120000             -0.0938950        
  9      0.4930000             -0.1210910        
S   1
  1      0.0951500              1.0000000        
S   1
  1      0.0479100              1.0000000        
S   1
  1      0.0222000              1.0000000        
S   1
  1      0.0063600              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      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      0.0266000              1.0000000        
F   1
  1      0.2460000              1.0000000        
F   1
  1      0.1292000              1.0000000        
G   1
  1      0.2380000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
elt: Be
data:
BERYLLIUM
S   9
  1  14630.0000000              0.0000920        
  2   2191.0000000              0.0007130        
  3    498.2000000              0.0037350        
  4    140.9000000              0.0154680        
  5     45.8600000              0.0528740        
  6     16.4700000              0.1456940        
  7      6.3190000              0.3026810        
  8      2.5350000              0.4049360        
  9      1.0350000              0.2223870        
S   9
  1  14630.0000000             -0.0000170        
  2   2191.0000000             -0.0001300        
  3    498.2000000             -0.0006790        
  4    140.9000000             -0.0028570        
  5     45.8600000             -0.0098130        
  6     16.4700000             -0.0286090        
  7      6.3190000             -0.0637600        
  8      2.5350000             -0.1172310        
  9      1.0350000             -0.1212020        
S   1
  1      0.2528000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0426100              1.0000000        
S   1
  1      0.0143900              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      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      0.0554000              1.0000000        
F   1
  1      0.4810000              1.0000000        
F   1
  1      0.2550000              1.0000000        
G   1
  1      0.4150000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.0466000              1.0000000        
F   1
  1      0.8820000              1.0000000        
F   1
  1      0.3110000              1.0000000        
G   1
  1      0.6730000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.0766000              1.0000000        
F   1
  1      1.4190000              1.0000000        
F   1
  1      0.4850000              1.0000000        
G   1
  1      1.0110000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.1110000              1.0000000        
F   1
  1      2.0270000              1.0000000        
F   1
  1      0.6850000              1.0000000        
G   1
  1      1.4270000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.1540000              1.0000000        
F   1
  1      2.6660000              1.0000000        
F   1
  1      0.8590000              1.0000000        
G   1
  1      1.8460000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.2070000              1.0000000        
F   1
  1      3.5620000              1.0000000        
F   1
  1      1.1480000              1.0000000        
G   1
  1      2.3760000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.2730000              1.0000000        
F   1
  1      4.6570000              1.0000000        
F   1
  1      1.5240000              1.0000000        
G   1
  1      2.9830000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.0210000              1.0000000        
F   1
  1      0.1912000              1.0000000        
F   1
  1      0.1036000              1.0000000        
G   1
  1      0.1722000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      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      0.0382000              1.0000000        
F   1
  1      0.1810000              1.0000000        
F   1
  1      0.3590000              1.0000000        
G   1
  1      0.3070000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
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      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      0.0121000              1.0000000        
D   1
  1      1.9700000              1.0000000        
D   1
  1      0.4370000              1.0000000        
D   1
  1      0.1950000              1.0000000        
D   1
  1      0.0800000              1.0000000        
D   1
  1      0.0274000              1.0000000        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
G   1
  1      0.3570000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-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        
D   1
  1      0.0414000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
G   1
  1      0.4610000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-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        
D   1
  1      0.0570000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
G   1
  1      0.5970000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-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        
D   1
  1      0.0722000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
G   1
  1      0.6830000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-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        
D   1
  1      0.0912000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
G   1
  1      0.8270000              1.0000000


name: may-cc-pV(Q+d)Z
description: may-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        
D   1
  1      0.1080000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
G   1
  1      1.0070000              1.0000000


name: pV6Z
description: V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
elt: H
data:
HYDROGEN
S   5
  1   1776.7755600              0.0000440        
  2    254.0177120              0.0003720        
  3     54.6980390              0.0020940        
  4     15.0183440              0.0088630        
  5      4.91507800             0.0305400        
S   1
  1      1.79492400             1.0000000        
S   1
  1      0.71071600             1.0000000        
S   1
  1      0.30480200             1.0000000        
S   1
  1      0.13804600             1.0000000        
S   1
  1      0.06215700             1.0000000        
P   1
  1      4.3950000              1.0000000        
P   1
  1      1.9950000              1.0000000        
P   1
  1      0.9060000              1.0000000        
P   1
  1      0.4110000              1.0000000        
P   1
  1      0.1866000              1.0000000        
D   1
  1      4.9740000              1.0000000        
D   1
  1      2.2150000              1.0000000        
D   1
  1      0.9860000              1.0000000        
D   1
  1      0.4390000              1.0000000        
F   1
  1      3.6650000              1.0000000        
F   1
  1      1.6190000              1.0000000        
F   1
  1      0.7150000              1.0000000        
G   1
  1      3.4480000              1.0000000        
G   1
  1      1.3120000              1.0000000        
H   1
  1      2.7580000              1.0000000


name: pV6Z
description: V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
elt: C
data:
CARBON
S   11
  1 312229.0000000              0.0000060        
  2  46749.6900000              0.0000440        
  3  10638.5500000              0.0002320        
  4   3013.2870000              0.0009790        
  5    983.0464000              0.0035500        
  6    354.8877000              0.0114390        
  7    138.4034000              0.0330020        
  8     57.3618400              0.0839960        
  9     24.9283800              0.1806840        
 10     11.2296400              0.3049890        
 11      5.2015490              0.3412880        
S   11
  1 312229.0000000              0.0000010        
  2  46749.6900000              0.0000090        
  3  10638.5500000              0.0000490        
  4   3013.2870000              0.0002090        
  5    983.0464000              0.0007600        
  6    354.8877000              0.0024540        
  7    138.4034000              0.0072020        
  8     57.3618400              0.0187950        
  9     24.9283800              0.0432490        
 10     11.2296400              0.0826210        
 11      5.2015490              0.1285180        
S   1
  1      2.4265640              1.0000000        
S   1
  1      0.9673440              1.0000000        
S   1
  1      0.4455990              1.0000000        
S   1
  1      0.1971220              1.0000000        
S   1
  1      0.0863470              1.0000000        
P   6
  1    478.6415000              0.0000620        
  2    113.4184000              0.0005370        
  3     36.8162300              0.0029260        
  4     13.9649200              0.0115030        
  5      5.7807870              0.0357210        
  6      2.5435940              0.0931200        
P   1
  1      1.1737790              1.0000000        
P   1
  1      0.5536750              1.0000000        
P   1
  1      0.2621730              1.0000000        
P   1
  1      0.1236170              1.0000000        
P   1
  1      0.0566710              1.0000000        
D   1
  1      5.5584000              1.0000000        
D   1
  1      2.3160000              1.0000000        
D   1
  1      0.9650000              1.0000000        
D   1
  1      0.4020830              1.0000000        
D   1
  1      0.1675350              1.0000000        
F   1
  1      2.8629090              1.0000000        
F   1
  1      1.1928790              1.0000000        
F   1
  1      0.4970330              1.0000000        
F   1
  1      0.2070970              1.0000000        
G   1
  1      3.1260000              1.0000000        
G   1
  1      1.3400000              1.0000000        
G   1
  1      0.5583330              1.0000000        
H   1
  1      1.9055100              1.0000000        
H   1
  1      0.7939620              1.0000000        
I   1
  1      1.5090000              1.0000000


name: pV6Z
description: V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
elt: N
data:
NITROGEN
S   11
  1 432381.1000000              0.0000060        
  2  64743.4200000              0.0000430        
  3  14733.7000000              0.0002290        
  4   4173.2540000              0.0009650        
  5   1361.4770000              0.0035000        
  6    491.5049000              0.0112840        
  7    191.6857000              0.0325990        
  8     79.4549900              0.0832300        
  9     34.5496800              0.1799300        
 10     15.5867300              0.3049550        
 11      7.2354440              0.3411590        
S   11
  1 432381.1000000              0.0000010        
  2  64743.4200000              0.0000100        
  3  14733.7000000              0.0000500        
  4   4173.2540000              0.0002130        
  5   1361.4770000              0.0007750        
  6    491.5049000              0.0025040        
  7    191.6857000              0.0073620        
  8     79.4549900              0.0192860        
  9     34.5496800              0.0446990        
 10     15.5867300              0.0860480        
 11      7.2354440              0.1332490        
S   1
  1      3.3837390              1.0000000        
S   1
  1      1.3697280              1.0000000        
S   1
  1      0.6250890              1.0000000        
S   1
  1      0.2748190              1.0000000        
S   1
  1      0.1192090              1.0000000        
P   6
  1    673.5556000              0.0000640        
  2    159.5845000              0.0005620        
  3     51.8017000              0.0030850        
  4     19.6734300              0.0122980        
  5      8.1753450              0.0386250        
  6      3.6161310              0.0998150        
P   1
  1      1.6734140              1.0000000        
P   1
  1      0.7892460              1.0000000        
P   1
  1      0.3723390              1.0000000        
P   1
  1      0.1740380              1.0000000        
P   1
  1      0.0786810              1.0000000        
D   1
  1      7.6780800              1.0000000        
D   1
  1      3.1992000              1.0000000        
D   1
  1      1.3330000              1.0000000        
D   1
  1      0.5554170              1.0000000        
D   1
  1      0.2314240              1.0000000        
F   1
  1      4.0080730              1.0000000        
F   1
  1      1.6700300              1.0000000        
F   1
  1      0.6958460              1.0000000        
F   1
  1      0.2899360              1.0000000        
G   1
  1      4.0632000              1.0000000        
G   1
  1      1.6930000              1.0000000        
G   1
  1      0.7054170              1.0000000        
H   1
  1      2.7792530              1.0000000        
H   1
  1      1.1580220              1.0000000        
I   1
  1      2.2220000              1.0000000


name: pV6Z
description: V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
elt: O
data:
OXYGEN
S   11
  1 570979.8000000              0.0000060        
  2  85496.9000000              0.0000430        
  3  19456.6500000              0.0002270        
  4   5511.0300000              0.0009570        
  5   1797.9190000              0.0034720        
  6    649.0677000              0.0111960        
  7    253.1386000              0.0323750        
  8    104.9379000              0.0828350        
  9     45.6503600              0.1796680        
 10     20.6176200              0.3052010        
 11      9.5867590              0.3408890        
S   11
  1 570979.8000000             -0.0000010        
  2  85496.9000000             -0.0000100        
  3  19456.6500000             -0.0000510        
  4   5511.0300000             -0.0002170        
  5   1797.9190000             -0.0007910        
  6    649.0677000             -0.0025590        
  7    253.1386000             -0.0075300        
  8    104.9379000             -0.0197820        
  9     45.6503600             -0.0460860        
 10     20.6176200             -0.0891890        
 11      9.5867590             -0.1375500        
S   1
  1      4.4925100              1.0000000        
S   1
  1      1.8369430              1.0000000        
S   1
  1      0.8348030              1.0000000        
S   1
  1      0.3657220              1.0000000        
S   1
  1      0.1570340              1.0000000        
P   5
  1    525.7638000              0.0001670        
  2    124.6306000              0.0014330        
  3     40.3430000              0.0075480        
  4     15.1783100              0.0286010        
  5      6.2450390              0.0843610        
P   1
  1      2.7326240              1.0000000        
P   1
  1      1.2272000              1.0000000        
P   1
  1      0.5491900              1.0000000        
P   1
  1      0.2417760              1.0000000        
P   1
  1      0.1025050              1.0000000        
D   1
  1      7.7002000              1.0000000        
D   1
  1      3.3625000              1.0000000        
D   1
  1      1.4684000              1.0000000        
D   1
  1      0.6412000              1.0000000        
D   1
  1      0.2800000              1.0000000        
F   1
  1      6.2537000              1.0000000        
F   1
  1      2.7084000              1.0000000        
F   1
  1      1.1729000              1.0000000        
F   1
  1      0.5080000              1.0000000        
G   1
  1      5.0017000              1.0000000        
G   1
  1      2.1158000              1.0000000        
G   1
  1      0.8950000              1.0000000        
H   1
  1      4.0207000              1.0000000        
H   1
  1      1.5530000              1.0000000        
I   1
  1      2.6000000              1.0000000


name: pSBKJC
elt: C
description:
Electrically polarized valence basis sets for the SBKJC effective core potential developed for calculations of dynamic polarizabilities and Raman intensities

data:
CARBON
S   3
  1      4.2860000             -0.14722000       
  2      1.0460000              0.08125000       
  3      0.3447000              0.71360000       
S   1
  1      0.1128000              1.0000000        
S   1
  1      0.0369128              1.0000000        
P   3
  1      4.2860000              0.10257000       
  2      1.0460000              0.32987000       
  3      0.3447000              0.48212000       
P   1
  1      0.1128000              1.0000000        
P   1
  1      0.0369128              1.0000000        
D   2
  1      1.0460000              0.39731820       
  2      0.3447000              0.91768090       
D   2
  1      0.1128000              0.90957470       
  2      0.0369128              0.41554040


name: pSBKJC
elt: N
description:
Electrically polarized valence basis sets for the SBKJC effective core potential developed for calculations of dynamic polarizabilities and Raman intensities

data:
NITROGEN
S   3
  1      6.4030000             -0.13955000       
  2      1.5800000              0.05492000       
  3      0.5094000              0.71678000       
S   1
  1      0.1623000              1.0000000        
S   1
  1      0.0517104              1.0000000        
P   3
  1      6.4030000              0.10336000       
  2      1.5800000              0.33205000       
  3      0.5094000              0.48708000       
P   1
  1      0.1623000              1.0000000        
P   1
  1      0.0517104              1.0000000        
D   2
  1      1.5800000             -0.64738610       
  2      0.5094000             -0.76216220       
D   2
  1      0.1623000             -0.27152820       
  2      0.0517104              0.96243050


name: pSBKJC
elt: O
description:
Electrically polarized valence basis sets for the SBKJC effective core potential developed for calculations of dynamic polarizabilities and Raman intensities

data:
OXYGEN
S   3
  1      8.5190000             -0.14551000       
  2      2.0730000              0.08286000       
  3      0.6471000              0.74325000       
S   1
  1      0.2000000              1.0000000        
S   1
  1      0.0618142              1.0000000        
P   3
  1      8.5190000              0.11007000       
  2      2.0730000              0.34969000       
  3      0.6471000              0.48093000       
P   1
  1      0.2000000              1.0000000        
P   1
  1      0.0618142              1.0000000        
D   2
  1      2.0730000              0.21488390       
  2      0.6471000              0.53088590       
D   2
  1      0.2000000              0.77539910       
  2      0.0618142              0.54009540


name: pSBKJC
elt: F
data:
FLUORINE
S   3
  1     11.1200000             -0.14451000       
  2      2.6870000              0.08971000       
  3      0.8210000              0.75659000       
S   1
  1      0.2475000              1.0000000        
S   1
  1      0.0746118              1.0000000        
P   3
  1     11.1200000              0.11300000       
  2      2.6870000              0.35841000       
  3      0.8210000              0.48002000       
P   1
  1      0.2475000              1.0000000        
P   1
  1      0.0746118              1.0000000        
D   2
  1      2.6870000              0.19833000       
  2      0.8210000              0.48352900       
D   2
  1      0.2475000              0.67911210       
  2      0.0746118              0.40777350


name: pSBKJC
elt: Si
data:
SILICON
S   3
  1      1.1670000             -0.32403000       
  2      0.5268000              0.18438000       
  3      0.1807000              0.77737000       
S   1
  1      0.0648000              1.0000000        
S   1
  1      0.0232376              1.0000000        
P   3
  1      1.1670000             -0.08450000       
  2      0.5268000              0.23786000       
  3      0.1807000              0.56532000       
P   1
  1      0.0648000              1.0000000        
P   1
  1      0.0232376              1.0000000        
D   2
  1      0.5268000              0.39731820       
  2      0.1807000              0.91768090       
D   2
  1      0.0648000              0.90957470       
  2      0.0232376              0.41554040


name: pSBKJC
elt: P
data:
PHOSPHORUS
S   3
  1      1.4590000             -0.34091000       
  2      0.6549000              0.21535000       
  3      0.2256000              0.79578000       
S   1
  1      0.0811500              1.0000000        
S   1
  1      0.0291902              1.0000000        
P   3
  1      1.4590000             -0.09378000       
  2      0.6549000              0.29205000       
  3      0.2256000              0.58688000       
P   1
  1      0.0811500              1.0000000        
P   1
  1      0.0291902              1.0000000        
D   2
  1      0.6549000             -0.94593020       
  2      0.2256000             -0.32437020       
D   2
  1      0.0811500             -0.34931910       
  2      0.0291902              0.93700380


name: pSBKJC
elt: S
data:
SULFUR
S   3
  1      1.8170000             -0.34015000       
  2      0.8379000              0.19601000       
  3      0.2854000              0.82666000       
S   1
  1      0.0993900              1.0000000        
S   1
  1      0.0346124              1.0000000        
P   3
  1      1.8170000             -0.10096000       
  2      0.8379000              0.31244000       
  3      0.2854000              0.57906000       
P   1
  1      0.0993900              1.0000000        
P   1
  1      0.0346124              1.0000000        
D   2
  1      0.8379000              0.30671360       
  2      0.2854000              0.95180180       
D   2
  1      0.0993900              0.88783880       
  2      0.0346124              0.46015460


name: pSBKJC
elt: Cl
data:
CHLORINE
S   3
  1      2.2250000             -0.33098000       
  2      1.1730000              0.11528000       
  3      0.3851000              0.84717000       
S   1
  1      0.1301000              1.0000000        
S   1
  1      0.0439522              1.0000000        
P   3
  1      2.2250000             -0.12604000       
  2      1.1730000              0.29952000       
  3      0.3851000              0.58357000       
P   1
  1      0.1301000              1.0000000        
P   1
  1      0.0439522              1.0000000        
D   2
  1      1.1730000              0.28500530       
  2      0.3851000              0.95852590       
D   2
  1      0.1301000              0.90983430       
  2      0.0439522              0.41497180


name: pSBKJC
elt: Ge
data:
GERMANIUM
S   4
  1      1.8340000              0.49386000       
  2      1.5290000             -0.85735400       
  3      0.3594000              0.41083000       
  4      0.1470000              0.80037800       
S   2
  1      0.1470000              1.00000000       
  2      0.0559800              1.00000000       
S   2
  1      0.0559800              1.00000000       
  2      0.0213181              1.00000000       
P   4
  1      1.8340000              0.00641400       
  2      1.5290000             -0.08605200       
  3      0.3594000              0.38323200       
  4      0.1470000              0.69818500       
P   2
  1      0.1470000              1.00000000       
  2      0.0559800              1.00000000       
P   2
  1      0.0559800              1.00000000       
  2      0.0213181              1.00000000       
D   2
  1      0.3594000              0.39731820       
  2      0.1470000              0.91768090       
D   2
  1      0.0559800              0.90957470       
  2      0.0213181              0.41554040


name: pSBKJC
elt: As
data:
ARSENIC
S   4
  1      2.7090000              0.12147900       
  2      1.5780000             -0.51891800       
  3      0.4358000              0.42879100       
  4      0.1776000              0.80807800       
S   2
  1      0.1776000              1.00000000       
  2      0.0698400              1.00000000       
S   2
  1      0.0698400              1.00000000       
  2      0.0274641              1.00000000       
P   4
  1      2.7090000             -0.00292000       
  2      1.5780000             -0.09505400       
  3      0.4358000              0.42468200       
  4      0.1776000              0.67129000       
P   2
  1      0.1776000              1.00000000       
  2      0.0698400              1.00000000       
P   2
  1      0.0698400              1.00000000       
  2      0.0274641              1.00000000       
D   2
  1      0.4358000             -0.84279500       
  2      0.1776000              0.53823470       
D   2
  1      0.0698400             -0.40147090       
  2      0.0274641              0.91587180


name: pSBKJC
elt: Se
data:
SELENIUM
S   4
  1      3.7110000              0.05574400       
  2      1.5860000             -0.51052000       
  3      0.5339000              0.48075500       
  4      0.2085000              0.81029200       
S   2
  1      0.2085000              1.00000000       
  2      0.0782100              1.00000000       
S   2
  1      0.0782100              1.00000000       
  2      0.0293372              1.00000000       
P   4
  1      3.7110000             -0.00601400       
  2      1.5860000             -0.12144700       
  3      0.5339000              0.45260700       
  4      0.2085000              0.66975100       
P   2
  1      0.2085000              1.00000000       
  2      0.0782100              1.00000000       
P   2
  1      0.0782100              1.00000000       
  2      0.0293372              1.00000000       
D   2
  1      0.5339000              0.39731820       
  2      0.2085000              0.91768090       
D   2
  1      0.0782100              0.90957470       
  2      0.0293372              0.41554040


name: pSBKJC
elt: Br
data:
BROMINE
S   4
  1      3.2760000              0.20057000       
  2      2.0440000             -0.64929600       
  3      0.6398000              0.40540100       
  4      0.2561000              0.87260700       
S   2
  1      0.2561000              1.00000000       
  2      0.0956700              1.00000000       
S   2
  1      0.0956700              1.00000000       
  2      0.0357390              1.00000000       
P   4
  1      3.2760000              0.00541100       
  2      2.0440000             -0.13239100       
  3      0.6398000              0.43002700       
  4      0.2561000              0.68600900       
P   2
  1      0.2561000              1.00000000       
  2      0.0956700              1.00000000       
P   2
  1      0.0956700              1.00000000       
  2      0.0357390              1.00000000       
D   2
  1      0.6398000              0.37165350       
  2      0.2561000              0.92837150       
D   2
  1      0.0956700              0.92708170       
  2      0.0357390              0.37485940


name: pSBKJC
elt: Sn
data:
TIN
S   4
  1      2.6040000              0.03104200       
  2      0.7532000             -0.61185900       
  3      0.3191000              0.54816300       
  4      0.1239000              0.84915000       
S   2
  1      0.1239000              1.00000000       
  2      0.0479800              1.00000000       
S   2
  1      0.0479800              1.00000000       
  2      0.0185801              1.00000000       
P   4
  1      2.6040000             -0.00505300       
  2      0.7532000             -0.18010000       
  3      0.3191000              0.37006800       
  4      0.1239000              0.78133400       
P   2
  1      0.1239000              1.00000000       
  2      0.0479800              1.00000000       
P   2
  1      0.0479800              1.00000000       
  2      0.0185801              1.00000000       
D   2
  1      0.3191000              0.39731820       
  2      0.1239000              0.91768090       
D   2
  1      0.0479800              0.90957470       
  2      0.0185801              0.41554040


name: pSBKJC
elt: Sb
data:
ANTIMONY
S   4
  1      0.9922000              0.69007600       
  2      0.8089000             -1.58049500       
  3      0.4312000              0.81524800       
  4      0.1498000              0.89499400       
S   2
  1      0.1498000              1.00000000       
  2      0.0580300              1.00000000       
S   2
  1      0.0580300              1.00000000       
  2      0.0224798              1.00000000       
P   4
  1      0.9922000              0.18022900       
  2      0.8089000             -0.48709300       
  3      0.4312000              0.47393600       
  4      0.1498000              0.80441400       
P   2
  1      0.1498000              1.00000000       
  2      0.0580300              1.00000000       
P   2
  1      0.0580300              1.00000000       
  2      0.0224798              1.00000000       
D   2
  1      0.4312000             -0.89904440       
  2      0.1498000              0.43785760       
D   2
  1      0.0580300             -0.40445320       
  2      0.0224798              0.91455870


name: pSBKJC
elt: Te
data:
TELLURIUM
S   4
  1      2.3640000              0.08717900       
  2      0.9769000             -0.77682600       
  3      0.4647000              0.56325000       
  4      0.1771000              0.92605300       
S   2
  1      0.1771000              1.00000000       
  2      0.0673700              1.00000000       
S   2
  1      0.0673700              1.00000000       
  2      0.0256280              1.00000000       
P   4
  1      2.3640000             -0.00398200       
  2      0.9769000             -0.23690000       
  3      0.4647000              0.40146700       
  4      0.1771000              0.79317900       
P   2
  1      0.1771000              1.00000000       
  2      0.0673700              1.00000000       
P   2
  1      0.0673700              1.00000000       
  2      0.0256280              1.00000000       
D   2
  1      0.4647000              0.39731820       
  2      0.1771000              0.91768090       
D   2
  1      0.0673700              0.90957470       
  2      0.0256280              0.41554040


name: pSBKJC
elt: I
data:
IODINE
S   4
  1      2.6250000              0.07366000       
  2      1.0140000             -0.83687000       
  3      0.5009000              0.65624700       
  4      0.2023000              0.90074400       
S   2
  1      0.2023000              1.00000000       
  2      0.0780000              1.00000000       
S   2
  1      0.0780000              1.00000000       
  2      0.0300741              1.00000000       
P   4
  1      2.6250000             -0.00888000       
  2      1.0140000             -0.25735100       
  3      0.5009000              0.45536800       
  4      0.2023000              0.76010700       
P   2
  1      0.2023000              1.00000000       
  2      0.0780000              1.00000000       
P   2
  1      0.0780000              1.00000000       
  2      0.0300741              1.00000000       
D   2
  1      0.5009000              0.36111300       
  2      0.2023000              0.93252210       
D   2
  1      0.0780000              0.93733150       
  2      0.0300741              0.34843880


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Sc
data:
SCANDIUM
S   3
  1      0.3717000000E+01      -0.3926292000E+00 
  2      0.1097000000E+01       0.7147339000E+00 
  3      0.4164000000E+00       0.5509400000E+00 
S   4
  1      0.3717000000E+01       0.2197446000E+00 
  2      0.1097000000E+01      -0.4546067000E+00 
  3      0.4164000000E+00      -0.6938181000E+00 
  4      0.7610000000E-01       0.1126017000E+01 
S   1
  1      0.2840000000E-01       1.0000000        
P   3
  1      0.1040000000E+02      -0.4926150000E-01 
  2      0.1311000000E+01       0.6071965000E+00 
  3      0.4266000000E+00       0.4917582000E+00 
P   4
  1      0.1040000000E+02       0.1108427000E-01 
  2      0.1311000000E+01      -0.1659071800E+00 
  3      0.4266000000E+00      -0.5004602000E-01 
  4      0.4700000000E-01       0.9630524400E+00 
P   1
  1      0.1400000000E-01       1.0000000        
D   4
  1      0.1513000000E+02       0.3792910000E-01 
  2      0.4205000000E+01       0.1738360000E+00 
  3      0.1303000000E+01       0.4268057000E+00 
  4      0.3680000000E+00       0.6238539000E+00 
D   1
  1      0.8120000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ti
data:
TITANIUM
S   3
  1      0.4372000000E+01      -0.3637098000E+00 
  2      0.1098000000E+01       0.8184533000E+00 
  3      0.4178000000E+00       0.4184526000E+00 
S   4
  1      0.4372000000E+01       0.2049027000E+00 
  2      0.1098000000E+01      -0.5575413000E+00 
  3      0.4178000000E+00      -0.5893652000E+00 
  4      0.8720000000E-01       0.1145166000E+01 
S   1
  1      0.3140000000E-01       1.0000000        
P   3
  1      0.1252000000E+02      -0.4569080000E-01 
  2      0.1491000000E+01       0.6203313000E+00 
  3      0.4859000000E+00       0.4765329000E+00 
P   4
  1      0.1252000000E+02       0.1011601000E-01 
  2      0.1491000000E+01      -0.1679839800E+00 
  3      0.4859000000E+00      -0.3888326000E-01 
  4      0.5300000000E-01       0.9502233100E+00 
P   1
  1      0.1600000000E-01       1.0000000        
D   4
  1      0.2021000000E+02       0.3416820000E-01 
  2      0.5495000000E+01       0.1710006000E+00 
  3      0.1699000000E+01       0.4405849000E+00 
  4      0.4840000000E+00       0.6114246000E+00 
D   1
  1      0.1157000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: V
data:
VANADIUM
S   3
  1      0.4590000000E+01      -0.4277302000E+00 
  2      0.1493000000E+01       0.7069691000E+00 
  3      0.5570000000E+00       0.5895813000E+00 
S   4
  1      0.4590000000E+01       0.2501081000E+00 
  2      0.1493000000E+01      -0.4697777000E+00 
  3      0.5570000000E+00      -0.7129415000E+00 
  4      0.9750000000E-01       0.1100657000E+01 
S   1
  1      0.3420000000E-01       1.0000000        
P   3
  1      0.1376000000E+02      -0.4823120000E-01 
  2      0.1712000000E+01       0.6141161000E+00 
  3      0.5587000000E+00       0.4838342000E+00 
P   4
  1      0.1376000000E+02       0.9934190000E-02 
  2      0.1712000000E+01      -0.1551097000E+00 
  3      0.5587000000E+00      -0.3760528000E-01 
  4      0.5900000000E-01       0.9345457200E+00 
P   1
  1      0.1800000000E-01       1.0000000        
D   4
  1      0.2570000000E+02       0.3310330000E-01 
  2      0.6530000000E+01       0.1795753000E+00 
  3      0.2078000000E+01       0.4373062000E+00 
  4      0.6243000000E+00       0.5984860000E+00 
D   1
  1      0.1542000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Cr
data:
CHROMIUM
S   3
  1      0.5361000000E+01      -0.3805689000E+00 
  2      0.1449000000E+01       0.7795625000E+00 
  3      0.5496000000E+00       0.4730777000E+00 
S   4
  1      0.5361000000E+01       0.2203111000E+00 
  2      0.1449000000E+01      -0.5423391000E+00 
  3      0.5496000000E+00      -0.6047716000E+00 
  4      0.1052000000E+00       0.1113666000E+01 
S   1
  1      0.3640000000E-01       1.0000000        
P   3
  1      0.1642000000E+02      -0.4613970000E-01 
  2      0.1914000000E+01       0.6109965000E+00 
  3      0.6241000000E+00       0.4859635000E+00 
P   4
  1      0.1642000000E+02       0.9460730000E-02 
  2      0.1914000000E+01      -0.1530863800E+00 
  3      0.6241000000E+00      -0.3827185000E-01 
  4      0.6300000000E-01       0.9225467300E+00 
P   1
  1      0.1900000000E-01       1.0000000        
D   4
  1      0.2895000000E+02       0.3377870000E-01 
  2      0.7708000000E+01       0.1780345000E+00 
  3      0.2495000000E+01       0.4370008000E+00 
  4      0.7655000000E+00       0.5941795000E+00 
D   1
  1      0.1889000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Mn
data:
MANGANESE
S   3
  1      0.5914000000E+01      -0.3764508000E+00 
  2      0.1605000000E+01       0.7724789000E+00 
  3      0.6260000000E+00       0.4769346000E+00 
S   4
  1      0.5914000000E+01       0.2119966000E+00 
  2      0.1605000000E+01      -0.5199472000E+00 
  3      0.6260000000E+00      -0.5857681000E+00 
  4      0.1115000000E+00       0.1100396000E+01 
S   1
  1      0.3800000000E-01       1.0000000        
P   3
  1      0.1820000000E+02      -0.4479010000E-01 
  2      0.2141000000E+01       0.6260311000E+00 
  3      0.7009000000E+00       0.4696329000E+00 
P   4
  1      0.1820000000E+02       0.8251600000E-02 
  2      0.2141000000E+01      -0.1409427500E+00 
  3      0.7009000000E+00      -0.3167127000E-01 
  4      0.6900000000E-01       0.8990942500E+00 
P   1
  1      0.2100000000E-01       1.0000000        
D   4
  1      0.3227000000E+02       0.3415800000E-01 
  2      0.8875000000E+01       0.1761105000E+00 
  3      0.2890000000E+01       0.4394298000E+00 
  4      0.8761000000E+00       0.5943271000E+00 
D   1
  1      0.2120000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Fe
data:
IRON
S   3
  1      0.6422000000E+01      -0.3927882000E+00 
  2      0.1826000000E+01       0.7712643000E+00 
  3      0.7135000000E+00       0.4920228000E+00 
S   4
  1      0.6422000000E+01       0.1786877000E+00 
  2      0.1826000000E+01      -0.4194032000E+00 
  3      0.7135000000E+00      -0.4568185000E+00 
  4      0.1021000000E+00       0.1103505000E+01 
S   1
  1      0.3630000000E-01       1.0000000        
P   3
  1      0.1948000000E+02      -0.4702820000E-01 
  2      0.2389000000E+01       0.6248841000E+00 
  3      0.7795000000E+00       0.4722542000E+00 
P   4
  1      0.1948000000E+02       0.8954160000E-02 
  2      0.2389000000E+01      -0.1449986400E+00 
  3      0.7795000000E+00      -0.2959800000E-01 
  4      0.7400000000E-01       0.9118691300E+00 
P   1
  1      0.2200000000E-01       1.0000000        
D   4
  1      0.3708000000E+02       0.3290000000E-01 
  2      0.1010000000E+02       0.1787418000E+00 
  3      0.3220000000E+01       0.4487657000E+00 
  4      0.9628000000E+00       0.5876361000E+00 
D   1
  1      0.2262000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Co
data:
COBALT
S   3
  1      0.7176000000E+01      -0.3856734000E+00 
  2      0.2009000000E+01       0.7453116000E+00 
  3      0.8055000000E+00       0.5091819000E+00 
S   4
  1      0.7176000000E+01       0.1736161000E+00 
  2      0.2009000000E+01      -0.3970442000E+00 
  3      0.8055000000E+00      -0.4630622000E+00 
  4      0.1070000000E+00       0.1089965000E+01 
S   1
  1      0.3750000000E-01       1.0000000        
P   3
  1      0.2139000000E+02      -0.4804130000E-01 
  2      0.2650000000E+01       0.6222337000E+00 
  3      0.8619000000E+00       0.4758042000E+00 
P   4
  1      0.2139000000E+02       0.8130530000E-02 
  2      0.2650000000E+01      -0.1274884900E+00 
  3      0.8619000000E+00      -0.3399214000E-01 
  4      0.8000000000E-01       0.8735707500E+00 
P   1
  1      0.2300000000E-01       1.0000000        
D   4
  1      0.3925000000E+02       0.3615410000E-01 
  2      0.1078000000E+02       0.1896744000E+00 
  3      0.3496000000E+01       0.4524981000E+00 
  4      0.1066000000E+01       0.5710427000E+00 
D   1
  1      0.2606000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ni
data:
NICKEL
S   3
  1      0.7620000000E+01      -0.4082550000E+00 
  2      0.2294000000E+01       0.7455308000E+00 
  3      0.8760000000E+00       0.5325721000E+00 
S   4
  1      0.7620000000E+01       0.1872591000E+00 
  2      0.2294000000E+01      -0.3966964000E+00 
  3      0.8760000000E+00      -0.4954003000E+00 
  4      0.1153000000E+00       0.1084434000E+01 
S   1
  1      0.3960000000E-01       1.0000000        
P   3
  1      0.2366000000E+02      -0.4815580000E-01 
  2      0.2893000000E+01       0.6258473000E+00 
  3      0.9435000000E+00       0.4715158000E+00 
P   4
  1      0.2366000000E+02       0.7131470000E-02 
  2      0.2893000000E+01      -0.1089909500E+00 
  3      0.9435000000E+00      -0.4615260000E-01 
  4      0.8400000000E-01       0.8025519700E+00 
P   1
  1      0.2400000000E-01       1.0000000        
D   4
  1      0.4272000000E+02       0.3726990000E-01 
  2      0.1176000000E+02       0.1956103000E+00 
  3      0.3817000000E+01       0.4561273000E+00 
  4      0.1169000000E+01       0.5621587000E+00 
D   1
  1      0.2836000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Cu
data:
COPPER
S   3
  1      0.8176000000E+01      -0.4210260000E+00 
  2      0.2568000000E+01       0.7385924000E+00 
  3      0.9587000000E+00       0.5525692000E+00 
S   4
  1      0.8176000000E+01       0.1787665000E+00 
  2      0.2568000000E+01      -0.3592273000E+00 
  3      0.9587000000E+00      -0.4704825000E+00 
  4      0.1153000000E+00       0.1080741000E+01 
S   1
  1      0.3960000000E-01       1.0000000        
P   3
  1      0.2563000000E+02      -0.4891730000E-01 
  2      0.3166000000E+01       0.6272854000E+00 
  3      0.1023000000E+01       0.4716188000E+00 
P   4
  1      0.2563000000E+02       0.7662860000E-02 
  2      0.3166000000E+01      -0.1180690800E+00 
  3      0.1023000000E+01      -0.3073332000E-01 
  4      0.8600000000E-01       0.8698353200E+00 
P   1
  1      0.2400000000E-01       1.0000000        
D   4
  1      0.4134000000E+02       0.4654240000E-01 
  2      0.1142000000E+02       0.2227824000E+00 
  3      0.3839000000E+01       0.4539059000E+00 
  4      0.1230000000E+01       0.5314769000E+00 
D   1
  1      0.3102000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Y
data:
YTTRIUM
S   3
  1      0.1751000000E+01      -0.1161790000E+01 
  2      0.1143000000E+01       0.1295888000E+01 
  3      0.3581000000E+00       0.7115125000E+00 
S   4
  1      0.1751000000E+01       0.9683123000E+00 
  2      0.1143000000E+01      -0.1134637000E+01 
  3      0.3581000000E+00      -0.1191405000E+01 
  4      0.1058000000E+00       0.9281063000E+00 
S   1
  1      0.3180000000E-01       1.0000000        
P   3
  1      0.3884000000E+01      -0.8206010000E-01 
  2      0.7660000000E+00       0.6756413000E+00 
  3      0.2890000000E+00       0.4195482000E+00 
P   4
  1      0.3884000000E+01       0.2507810000E-01 
  2      0.7660000000E+00      -0.2548121700E+00 
  3      0.2890000000E+00      -0.1018642900E+00 
  4      0.6290000000E-01       0.7523223700E+00 
P   1
  1      0.2230000000E-01       1.0000000        
D   3
  1      0.1523000000E+01       0.1074843000E+00 
  2      0.5634000000E+00       0.4563954000E+00 
  3      0.1834000000E+00       0.6039855000E+00 
D   1
  1      0.5690000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Zr
data:
ZIRCONIUM
S   3
  1      0.1976000000E+01      -0.9206745000E+00 
  2      0.1154000000E+01       0.1092903000E+01 
  3      0.3910000000E+00       0.6795621000E+00 
S   4
  1      0.1976000000E+01       0.7506060000E+00 
  2      0.1154000000E+01      -0.9810826000E+00 
  3      0.3910000000E+00      -0.1022515000E+01 
  4      0.1001000000E+00       0.1086004000E+01 
S   1
  1      0.3340000000E-01       1.0000000        
P   3
  1      0.4192000000E+01      -0.9425540000E-01 
  2      0.8764000000E+00       0.6783675000E+00 
  3      0.3263000000E+00       0.4246618000E+00 
P   4
  1      0.4192000000E+01       0.2948950000E-01 
  2      0.8764000000E+00      -0.2630061500E+00 
  3      0.3263000000E+00      -0.9735154000E-01 
  4      0.7240000000E-01       0.7511517800E+00 
P   1
  1      0.2430000000E-01       1.0000000        
D   3
  1      0.2269000000E+01       0.5997410000E-01 
  2      0.7855000000E+00       0.4734158000E+00 
  3      0.2615000000E+00       0.6117178000E+00 
D   1
  1      0.8020000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Nb
data:
NIOBIUM
S   3
  1      0.2182000000E+01      -0.8846144000E+00 
  2      0.1209000000E+01       0.1103378000E+01 
  3      0.4165000000E+00       0.6298776000E+00 
S   4
  1      0.2182000000E+01       0.7790287000E+00 
  2      0.1209000000E+01      -0.1075279000E+01 
  3      0.4165000000E+00      -0.1150601000E+01 
  4      0.1454000000E+00       0.9969155000E+00 
S   1
  1      0.3920000000E-01       1.0000000        
P   3
  1      0.4519000000E+01      -0.8173030000E-01 
  2      0.9406000000E+00       0.6995115000E+00 
  3      0.3492000000E+00       0.3980996000E+00 
P   4
  1      0.4519000000E+01       0.2556282000E-01 
  2      0.9406000000E+00      -0.2776209400E+00 
  3      0.3492000000E+00      -0.6220852000E-01 
  4      0.7520000000E-01       0.7741450700E+00 
P   1
  1      0.2470000000E-01       1.0000000        
D   3
  1      0.3466000000E+01       0.3159830000E-01 
  2      0.9938000000E+00       0.4834306000E+00 
  3      0.3350000000E+00       0.6164893000E+00 
D   1
  1      0.1024000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Mo
data:
MOLYBDENUM
S   3
  1      0.2361000000E+01      -0.9121760000E+00 
  2      0.1309000000E+01       0.1147745000E+01 
  3      0.4500000000E+00       0.6097109000E+00 
S   4
  1      0.2361000000E+01       0.8139259000E+00 
  2      0.1309000000E+01      -0.1136008000E+01 
  3      0.4500000000E+00      -0.1161159000E+01 
  4      0.1681000000E+00       0.1006479000E+01 
S   1
  1      0.4230000000E-01       1.0000000        
P   3
  1      0.4895000000E+01      -0.9082580000E-01 
  2      0.1044000000E+01       0.7042899000E+00 
  3      0.3877000000E+00       0.3973179000E+00 
P   4
  1      0.4895000000E+01       0.2754991000E-01 
  2      0.1044000000E+01      -0.2707449600E+00 
  3      0.3877000000E+00      -0.4916928000E-01 
  4      0.7800000000E-01       0.7801960100E+00 
P   1
  1      0.2470000000E-01       1.0000000        
D   3
  1      0.2993000000E+01       0.5270630000E-01 
  2      0.1063000000E+01       0.5003907000E+00 
  3      0.3721000000E+00       0.5794024000E+00 
D   1
  1      0.1178000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Tc
data:
TECHNETIUM
S   3
  1      0.2342000000E+01      -0.1491178000E+01 
  2      0.1634000000E+01       0.1674904000E+01 
  3      0.5094000000E+00       0.6573006000E+00 
S   4
  1      0.2342000000E+01       0.1352400000E+01 
  2      0.1634000000E+01      -0.1621630000E+01 
  3      0.5094000000E+00      -0.1146377000E+01 
  4      0.1706000000E+00       0.9859190000E+00 
S   1
  1      0.4350000000E-01       1.0000000        
P   3
  1      0.5278000000E+01      -0.9954190000E-01 
  2      0.1156000000E+01       0.7081544000E+00 
  3      0.4302000000E+00       0.3973571000E+00 
P   4
  1      0.5278000000E+01       0.2857053000E-01 
  2      0.1156000000E+01      -0.2551873000E+00 
  3      0.4302000000E+00      -0.6471027000E-01 
  4      0.8950000000E-01       0.7458897000E+00 
P   1
  1      0.2460000000E-01       1.0000000        
D   3
  1      0.4632000000E+01       0.2687240000E-01 
  2      0.1279000000E+01       0.5073089000E+00 
  3      0.4425000000E+00       0.5911381000E+00 
D   1
  1      0.1364000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ru
data:
RUTHENIUM
S   3
  1      0.2565000000E+01      -0.1043106000E+01 
  2      0.1508000000E+01       0.1331479000E+01 
  3      0.5129000000E+00       0.5613065000E+00 
S   4
  1      0.2565000000E+01       0.8770128000E+00 
  2      0.1508000000E+01      -0.1263466000E+01 
  3      0.5129000000E+00      -0.8384987000E+00 
  4      0.1362000000E+00       0.1063777000E+01 
S   1
  1      0.4170000000E-01       1.0000000        
P   3
  1      0.4859000000E+01      -0.9457550000E-01 
  2      0.1219000000E+01       0.7434798000E+00 
  3      0.4413000000E+00       0.3668144000E+00 
P   4
  1      0.4859000000E+01       0.2740523000E-01 
  2      0.1219000000E+01      -0.2772674000E+00 
  3      0.4413000000E+00      -0.1280913000E-01 
  4      0.8300000000E-01       0.8156640000E+00 
P   1
  1      0.2500000000E-01       1.0000000        
D   3
  1      0.4195000000E+01       0.4857290000E-01 
  2      0.1377000000E+01       0.5105223000E+00 
  3      0.4828000000E+00       0.5730028000E+00 
D   1
  1      0.1501000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Rh
data:
RHODIUM
S   3
  1      0.2646000000E+01      -0.1355408000E+01 
  2      0.1751000000E+01       0.1611223000E+01 
  3      0.5713000000E+00       0.5893814000E+00 
S   4
  1      0.2646000000E+01       0.1147214000E+01 
  2      0.1751000000E+01      -0.1494352000E+01 
  3      0.5713000000E+00      -0.8589704000E+00 
  4      0.1438000000E+00       0.1029724000E+01 
S   1
  1      0.4280000000E-01       1.0000000        
P   3
  1      0.5440000000E+01      -0.9876990000E-01 
  2      0.1329000000E+01       0.7433595000E+00 
  3      0.4845000000E+00       0.3668462000E+00 
P   4
  1      0.5440000000E+01       0.2587041000E-01 
  2      0.1329000000E+01      -0.2494065600E+00 
  3      0.4845000000E+00      -0.2125155000E-01 
  4      0.8690000000E-01       0.7765097700E+00 
P   1
  1      0.2570000000E-01       1.0000000        
D   3
  1      0.3669000000E+01       0.7600590000E-01 
  2      0.1423000000E+01       0.5158852000E+00 
  3      0.5091000000E+00       0.5436585000E+00 
D   1
  1      0.1610000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Pd
data:
PALLADIUM
S   3
  1      0.2787000000E+01      -0.1610239000E+01 
  2      0.1965000000E+01       0.1848984000E+01 
  3      0.6243000000E+00       0.6037492000E+00 
S   4
  1      0.2787000000E+01       0.1354078000E+01 
  2      0.1965000000E+01      -0.1678085000E+01 
  3      0.6243000000E+00      -0.8559381000E+00 
  4      0.1496000000E+00       0.1020030000E+01 
S   1
  1      0.4360000000E-01       1.0000000        
P   3
  1      0.5999000000E+01      -0.1034910000E+00 
  2      0.1443000000E+01       0.7456952000E+00 
  3      0.5264000000E+00       0.3656494000E+00 
P   4
  1      0.5999000000E+01       0.2670153000E-01 
  2      0.1443000000E+01      -0.2457828800E+00 
  3      0.5264000000E+00      -0.1426049000E-01 
  4      0.8990000000E-01       0.7898110300E+00 
P   1
  1      0.2620000000E-01       1.0000000        
D   3
  1      0.6091000000E+01       0.3761460000E-01 
  2      0.1719000000E+01       0.5200479000E+00 
  3      0.6056000000E+00       0.5706071000E+00 
D   1
  1      0.1883000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ag
data:
SILVER
S   3
  1      0.2950000000E+01      -0.1791056000E+01 
  2      0.2149000000E+01       0.2024457000E+01 
  3      0.6684000000E+00       0.6072839000E+00 
S   4
  1      0.2950000000E+01       0.1014112000E+01 
  2      0.2149000000E+01      -0.1241397000E+01 
  3      0.6684000000E+00      -0.4901427000E+00 
  4      0.9970000000E-01       0.1112838000E+01 
S   1
  1      0.3470000000E-01       1.0000000        
P   3
  1      0.6553000000E+01      -0.1079117000E+00 
  2      0.1565000000E+01       0.7403645000E+00 
  3      0.5748000000E+00       0.3721008000E+00 
P   4
  1      0.6553000000E+01       0.2492651000E-01 
  2      0.1565000000E+01      -0.2176319600E+00 
  3      0.5748000000E+00      -0.9968790000E-02 
  4      0.8330000000E-01       0.8066358800E+00 
P   1
  1      0.2520000000E-01       1.0000000        
D   3
  1      0.3391000000E+01       0.1396938000E+00 
  2      0.1599000000E+01       0.4744421000E+00 
  3      0.6282000000E+00       0.5156311000E+00 
D   1
  1      0.2108000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: La
data:
LANTHANUM
S   3
  1      0.9167000000E+00      -0.3024075000E+01 
  2      0.7427000000E+00       0.3297148000E+01 
  3      0.2237000000E+00       0.5513542000E+00 
S   4
  1      0.9167000000E+00       0.2691024000E+01 
  2      0.7427000000E+00      -0.3047436000E+01 
  3      0.2237000000E+00      -0.1103021000E+01 
  4      0.7920000000E-01       0.1194186000E+01 
S   1
  1      0.2390000000E-01       1.0000000        
P   3
  1      0.1554000000E+01      -0.1817168000E+00 
  2      0.5622000000E+00       0.6632226000E+00 
  3      0.2239000000E+00       0.5029782000E+00 
P   4
  1      0.1554000000E+01       0.6520690000E-01 
  2      0.5622000000E+00      -0.2923982700E+00 
  3      0.2239000000E+00      -0.1489021900E+00 
  4      0.4830000000E-01       0.8027785600E+00 
P   1
  1      0.1790000000E-01       1.0000000        
D   2
  1      0.4524000000E+00       0.4468051000E+00 
  2      0.1602000000E+00       0.6543493000E+00 
D   1
  1      0.5310000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Hf
data:
HAFNIUM
S   3
  1      0.1950000000E+01      -0.1226085000E+01 
  2      0.1183000000E+01       0.1569507000E+01 
  3      0.3897000000E+00       0.4933412000E+00 
S   4
  1      0.1950000000E+01       0.1077838000E+01 
  2      0.1183000000E+01      -0.1501086000E+01 
  3      0.3897000000E+00      -0.1198218000E+01 
  4      0.1656000000E+00       0.1229030000E+01 
S   1
  1      0.4240000000E-01       1.0000000        
P   3
  1      0.1972000000E+01      -0.6323467000E+00 
  2      0.1354000000E+01       0.1046516000E+01 
  3      0.4134000000E+00       0.5801670000E+00 
P   4
  1      0.1972000000E+01       0.2057732600E+00 
  2      0.1354000000E+01      -0.3665068800E+00 
  3      0.4134000000E+00      -0.1772287200E+00 
  4      0.8040000000E-01       0.7408025000E+00 
P   1
  1      0.2740000000E-01       1.0000000        
D   2
  1      0.8226000000E+00       0.4490405000E+00 
  2      0.2585000000E+00       0.6723891000E+00 
D   1
  1      0.7620000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ta
data:
TANTALUM
S   3
  1      0.2044000000E+01      -0.1310478000E+01 
  2      0.1267000000E+01       0.1657992000E+01 
  3      0.4157000000E+00       0.4848337000E+00 
S   4
  1      0.2044000000E+01       0.1189732000E+01 
  2      0.1267000000E+01      -0.1665046000E+01 
  3      0.4157000000E+00      -0.1056334000E+01 
  4      0.1671000000E+00       0.1184065000E+01 
S   1
  1      0.4820000000E-01       1.0000000        
P   3
  1      0.2565000000E+01      -0.2917238000E+00 
  2      0.1229000000E+01       0.7570649000E+00 
  3      0.4244000000E+00       0.5240081000E+00 
P   4
  1      0.2565000000E+01       0.9520789000E-01 
  2      0.1229000000E+01      -0.2857388300E+00 
  3      0.4244000000E+00      -0.1387462400E+00 
  4      0.8400000000E-01       0.7660282800E+00 
P   1
  1      0.2800000000E-01       1.0000000        
D   2
  1      0.8948000000E+00       0.4731072000E+00 
  2      0.2989000000E+00       0.6399200000E+00 
D   1
  1      0.9350000000E-01       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: W
data:
TUNGSTEN
S   3
  1      0.2137000000E+01      -0.1391615000E+01 
  2      0.1347000000E+01       0.1751026000E+01 
  3      0.4366000000E+00       0.4694647000E+00 
S   4
  1      0.2137000000E+01       0.1298509000E+01 
  2      0.1347000000E+01      -0.1810243000E+01 
  3      0.4366000000E+00      -0.1084453000E+01 
  4      0.1883000000E+00       0.1258062000E+01 
S   1
  1      0.5180000000E-01       1.0000000        
P   3
  1      0.3005000000E+01      -0.2405563000E+00 
  2      0.1228000000E+01       0.7364092000E+00 
  3      0.4415000000E+00       0.4881487000E+00 
P   4
  1      0.3005000000E+01       0.7783880000E-01 
  2      0.1228000000E+01      -0.2840212900E+00 
  3      0.4415000000E+00      -0.1161480100E+00 
  4      0.9000000000E-01       0.7645931200E+00 
P   1
  1      0.2800000000E-01       1.0000000        
D   2
  1      0.9519000000E+00       0.4985265000E+00 
  2      0.3270000000E+00       0.6111110000E+00 
D   1
  1      0.1054000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Re
data:
RHENIUM
S   3
  1      0.2185000000E+01      -0.1622373000E+01 
  2      0.1451000000E+01       0.1993865000E+01 
  3      0.4585000000E+00       0.4531166000E+00 
S   4
  1      0.2185000000E+01       0.1545975000E+01 
  2      0.1451000000E+01      -0.2075893000E+01 
  3      0.4585000000E+00      -0.1192240000E+01 
  4      0.2314000000E+00       0.1227286000E+01 
S   1
  1      0.5660000000E-01       1.0000000        
P   3
  1      0.3358000000E+01      -0.2318667000E+00 
  2      0.1271000000E+01       0.7458683000E+00 
  3      0.4644000000E+00       0.4632686000E+00 
P   4
  1      0.3358000000E+01       0.7220640000E-01 
  2      0.1271000000E+01      -0.2811099500E+00 
  3      0.4644000000E+00      -0.8502109000E-01 
  4      0.8900000000E-01       0.7677496500E+00 
P   1
  1      0.2800000000E-01       1.0000000        
D   2
  1      0.1116000000E+01       0.4689888000E+00 
  2      0.4267000000E+00       0.6209591000E+00 
D   1
  1      0.1378000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Os
data:
OSMIUM
S   3
  1      0.2222000000E+01      -0.1653804000E+01 
  2      0.1496000000E+01       0.2067030000E+01 
  3      0.4774000000E+00       0.4232017000E+00 
S   4
  1      0.2222000000E+01       0.1604697000E+01 
  2      0.1496000000E+01      -0.2212039000E+01 
  3      0.4774000000E+00      -0.1130121000E+01 
  4      0.2437000000E+00       0.1265455000E+01 
S   1
  1      0.5830000000E-01       1.0000000        
P   3
  1      0.2518000000E+01      -0.4177345000E+00 
  2      0.1460000000E+01       0.9434947000E+00 
  3      0.4923000000E+00       0.4672976000E+00 
P   4
  1      0.2518000000E+01       0.1264627900E+00 
  2      0.1460000000E+01      -0.3298170900E+00 
  3      0.4923000000E+00      -0.9451131000E-01 
  4      0.9800000000E-01       0.7238295900E+00 
P   1
  1      0.2900000000E-01       1.0000000        
D   2
  1      0.1183000000E+01       0.4838470000E+00 
  2      0.4492000000E+00       0.6079573000E+00 
D   1
  1      0.1463000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Ir
data:
IRIDIUM
S   3
  1      0.2350000000E+01      -0.1678464000E+01 
  2      0.1582000000E+01       0.2095255000E+01 
  3      0.5018000000E+00       0.4162934000E+00 
S   4
  1      0.2350000000E+01       0.1646447000E+01 
  2      0.1582000000E+01      -0.2274815000E+01 
  3      0.5018000000E+00      -0.1049436000E+01 
  4      0.2500000000E+00       0.1216779000E+01 
S   1
  1      0.5980000000E-01       1.0000000        
P   3
  1      0.2792000000E+01      -0.3889212000E+00 
  2      0.1541000000E+01       0.9077516000E+00 
  3      0.5285000000E+00       0.4691443000E+00 
P   4
  1      0.2792000000E+01       0.1204123500E+00 
  2      0.1541000000E+01      -0.3272359500E+00 
  3      0.5285000000E+00      -0.7907718000E-01 
  4      0.9800000000E-01       0.7632532200E+00 
P   1
  1      0.2900000000E-01       1.0000000        
D   2
  1      0.1240000000E+01       0.5087022000E+00 
  2      0.4647000000E+00       0.5862102000E+00 
D   1
  1      0.1529000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Pt
data:
PLATINUM
S   3
  1      0.2547000000E+01      -0.1473918000E+01 
  2      0.1614000000E+01       0.1911572000E+01 
  3      0.5167000000E+00       0.3922319000E+00 
S   4
  1      0.2547000000E+01       0.1438817000E+01 
  2      0.1614000000E+01      -0.2091182000E+01 
  3      0.5167000000E+00      -0.1092132000E+01 
  4      0.2651000000E+00       0.1342660000E+01 
S   1
  1      0.5800000000E-01       1.0000000        
P   3
  1      0.2911000000E+01      -0.5247438000E+00 
  2      0.1836000000E+01       0.9671884000E+00 
  3      0.5982000000E+00       0.5438632000E+00 
P   4
  1      0.2911000000E+01       0.1702966400E+00 
  2      0.1836000000E+01      -0.3510369500E+00 
  3      0.5982000000E+00      -0.1010735800E+00 
  4      0.9960000000E-01       0.7803291700E+00 
P   1
  1      0.2900000000E-01       1.0000000        
D   2
  1      0.1243000000E+01       0.5598150000E+00 
  2      0.4271000000E+00       0.5511090000E+00 
D   1
  1      0.1370000000E+00       1.0000000


name: modified LANL2DZ
description: transition-metal LANL2DZ basis sets including optimized outer p functions
elt: Au
data:
GOLD
S   3
  1      0.2809000000E+01      -0.1202156000E+01 
  2      0.1595000000E+01       0.1674158000E+01 
  3      0.5327000000E+00       0.3526593000E+00 
S   4
  1      0.2809000000E+01       0.1160848000E+01 
  2      0.1595000000E+01      -0.1864285000E+01 
  3      0.5327000000E+00      -0.1035623000E+01 
  4      0.2826000000E+00       0.1306440000E+01 
S   1
  1      0.5980000000E-01       1.0000000        
P   3
  1      0.3684000000E+01      -0.2802681000E+00 
  2      0.1666000000E+01       0.7818398000E+00 
  3      0.5989000000E+00       0.4804776000E+00 
P   4
  1      0.3684000000E+01       0.7934225000E-01 
  2      0.1666000000E+01      -0.2663019700E+00 
  3      0.5989000000E+00      -0.6487433000E-01 
  4      0.9770000000E-01       0.7537341400E+00 
P   1
  1      0.2790000000E-01       1.0000000        
D   2
  1      0.1287000000E+01       0.5844273000E+00 
  2      0.4335000000E+00       0.5298161000E+00 
D   1
  1      0.1396000000E+00       1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: H
data:
HYDROGEN
S   8
  1   2762.5161400              0.0000220        
  2   1211.8584400              0.0000060        
  3    531.6171200              0.0000944        
  4    233.2093860              0.0001794        
  5    102.3041130              0.0005845        
  6     44.8786889              0.0015591        
  7     19.6873484              0.0043883        
  8      8.63643073             0.0120863        
S   1
  1      3.78862274             1.0000000        
S   1
  1      1.66199008             1.0000000        
S   1
  1      0.72908052             1.0000000        
S   1
  1      0.31983248             1.0000000        
S   1
  1      0.14030386             1.0000000        
S   1
  1      0.06154839             1.0000000        
P   1
  1      8.1536480              1.0000000        
P   1
  1      3.8622750              1.0000000        
P   1
  1      1.8295080              1.0000000        
P   1
  1      0.8666140              1.0000000        
P   1
  1      0.4105030              1.0000000        
P   1
  1      0.1944500              1.0000000        
D   1
  1      6.0348330              1.0000000        
D   1
  1      3.0569580              1.0000000        
D   1
  1      1.5485090              1.0000000        
D   1
  1      0.7844010              1.0000000        
D   1
  1      0.3973400              1.0000000        
F   1
  1      5.8947400              1.0000000        
F   1
  1      2.9029400              1.0000000        
F   1
  1      1.4295900              1.0000000        
F   1
  1      0.7040200              1.0000000        
G   1
  1      4.6226740              1.0000000        
G   1
  1      2.1711260              1.0000000        
G   1
  1      1.0197100              1.0000000        
H   1
  1      4.2237060              1.0000000        
H   1
  1      1.7050600              1.0000000        
I   1
  1      3.4140000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: C
data:
CARBON
S   12
  1 949028.8000000              0.0000014        
  2 142083.0000000              0.0000110        
  3  32332.4700000              0.0000578        
  4   9158.1170000              0.0002444        
  5   2987.9090000              0.0008910        
  6   1078.7880000              0.0029040        
  7    420.8308000              0.0086310        
  8    174.6003000              0.0235290        
  9     76.1829200              0.0581610        
 10     34.6358800              0.1266240        
 11     16.2707600              0.2304650        
 12      7.8554790              0.3192970        
S   12
  1 949028.8000000             -0.0000003        
  2 142083.0000000             -0.0000023        
  3  32332.4700000             -0.0000123        
  4   9158.1170000             -0.0000520        
  5   2987.9090000             -0.0001900        
  6   1078.7880000             -0.0006200        
  7    420.8308000             -0.0018550        
  8    174.6003000             -0.0050920        
  9     76.1829200             -0.0129160        
 10     34.6358800             -0.0292300        
 11     16.2707600             -0.0584140        
 12      7.8554790             -0.0966550        
S   1
  1      3.8821720              1.0000000        
S   1
  1      1.9283340              1.0000000        
S   1
  1      0.8358060              1.0000000        
S   1
  1      0.3862910              1.0000000        
S   1
  1      0.1768600              1.0000000        
S   1
  1      0.0802520              1.0000000        
P   6
  1    765.4553000              0.0000272        
  2    180.8628000              0.0002410        
  3     58.7144100              0.0013570        
  4     22.4162500              0.0056200        
  5      9.4062140              0.0182670        
  6      4.1871980              0.0500190        
P   1
  1      1.9558760              1.0000000        
P   1
  1      0.9453360              1.0000000        
P   1
  1      0.4627630              1.0000000        
P   1
  1      0.2267960              1.0000000        
P   1
  1      0.1105920              1.0000000        
P   1
  1      0.0524000              1.0000000        
D   1
  1      8.0028000              1.0000000        
D   1
  1      3.6663000              1.0000000        
D   1
  1      1.6796000              1.0000000        
D   1
  1      0.7695000              1.0000000        
D   1
  1      0.3525000              1.0000000        
D   1
  1      0.1615000              1.0000000        
F   1
  1      3.5134000              1.0000000        
F   1
  1      1.8214000              1.0000000        
F   1
  1      0.9443000              1.0000000        
F   1
  1      0.4896000              1.0000000        
F   1
  1      0.2538000              1.0000000        
G   1
  1      3.0363000              1.0000000        
G   1
  1      1.6713000              1.0000000        
G   1
  1      0.9200000              1.0000000        
G   1
  1      0.5064000              1.0000000        
H   1
  1      1.8273000              1.0000000        
H   1
  1      0.8999000              1.0000000        
H   1
  1      0.4432000              1.0000000        
I   1
  1      3.2802000              1.0000000        
I   1
  1      0.6777000              1.0000000        
K   1
  1      1.9560000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: N
data:
NITROGEN
S   12
  1 1296296.0000000             0.0000014        
  2 194068.6000000              0.0000110        
  3  44160.5700000              0.0000580        
  4  12507.7200000              0.0002450        
  5   4080.4760000              0.0008930        
  6   1473.1400000              0.0029130        
  7    574.6066000              0.0086640        
  8    238.3700000              0.0236350        
  9    103.9936000              0.0585180        
 10     47.2794400              0.1277287        
 11     22.2187100              0.2328737        
 12     10.7356900              0.3211170        
S   12
  1 1296296.0000000            -0.00000031       
  2 194068.6000000             -0.00000243       
  3  44160.5700000             -0.00001279       
  4  12507.7200000             -0.00005399       
  5   4080.4760000             -0.00019730       
  6   1473.1400000             -0.00064320       
  7    574.6066000             -0.00192640       
  8    238.3700000             -0.00529480       
  9    103.9936000             -0.01345880       
 10     47.2794400             -0.03061290       
 11     22.2187100             -0.06151130       
 12     10.7356900             -0.10200550       
S   1
  1      5.3088560              1.0000000        
S   1
  1      2.6391770              1.0000000        
S   1
  1      1.1657640              1.0000000        
S   1
  1      0.5370910              1.0000000        
S   1
  1      0.2449040              1.0000000        
S   1
  1      0.1102710              1.0000000        
P   6
  1   1094.9600000              0.0000276        
  2    258.6611000              0.0002450        
  3     83.8525500              0.0013920        
  4     31.9622500              0.0058590        
  5     13.4112100              0.0194130        
  6      5.9854710              0.0535998        
P   1
  1      2.8036300              1.0000000        
P   1
  1      1.3557360              1.0000000        
P   1
  1      0.6623960              1.0000000        
P   1
  1      0.3229120              1.0000000        
P   1
  1      0.1559210              1.0000000        
P   1
  1      0.0728200              1.0000000        
D   1
  1      8.5914298              1.0000000        
D   1
  1      4.0335351              1.0000000        
D   1
  1      1.8936785              1.0000000        
D   1
  1      0.8890509              1.0000000        
D   1
  1      0.4173948              1.0000000        
D   1
  1      0.1959600              1.0000000        
F   1
  1      5.7389002              1.0000000        
F   1
  1      2.7724156              1.0000000        
F   1
  1      1.3393312              1.0000000        
F   1
  1      0.6470199              1.0000000        
F   1
  1      0.3125700              1.0000000        
G   1
  1      5.5368024              1.0000000        
G   1
  1      2.5872908              1.0000000        
G   1
  1      1.2090144              1.0000000        
G   1
  1      0.5649600              1.0000000        
H   1
  1      4.2181288              1.0000000        
H   1
  1      2.0871494              1.0000000        
H   1
  1      1.0327300              1.0000000        
I   1
  1      3.4500000              1.0000000        
I   1
  1      1.5800000              1.0000000        
K   1
  1      2.3790000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: O
data:
OXYGEN
S   12
  1 1678789.0000000             0.0000014        
  2 251388.2000000              0.0000112        
  3  57213.7300000              0.0000589        
  4  16207.4400000              0.0002490        
  5   5288.2760000              0.0009070        
  6   1909.4780000              0.0029570        
  7    744.9231000              0.0087910        
  8    309.0755000              0.0239800        
  9    134.8645000              0.0593810        
 10     61.3312900              0.1296500        
 11     28.8379600              0.2360640        
 12     13.9450400              0.3229210        
S   12
  1 1678789.0000000            -0.0000003        
  2 251388.2000000             -0.0000025        
  3  57213.7300000             -0.0000134        
  4  16207.4400000             -0.0000560        
  5   5288.2760000             -0.0002060        
  6   1909.4780000             -0.0006720        
  7    744.9231000             -0.0020130        
  8    309.0755000             -0.0055350        
  9    134.8645000             -0.0140790        
 10     61.3312900             -0.0321130        
 11     28.8379600             -0.0646760        
 12     13.9450400             -0.1071540        
S   1
  1      6.8990770              1.0000000        
S   1
  1      3.4315770              1.0000000        
S   1
  1      1.5398400              1.0000000        
S   1
  1      0.7097510              1.0000000        
S   1
  1      0.3230470              1.0000000        
S   1
  1      0.1442220              1.0000000        
P   6
  1   1349.0590000              0.0000323        
  2    319.4569000              0.0002860        
  3    103.7804000              0.0016160        
  4     39.6282100              0.0067850        
  5     16.6613700              0.0224990        
  6      7.4641660              0.0616740        
P   1
  1      3.5093250              1.0000000        
P   1
  1      1.6956800              1.0000000        
P   1
  1      0.8227420              1.0000000        
P   1
  1      0.3957330              1.0000000        
P   1
  1      0.1876440              1.0000000        
P   1
  1      0.0858410              1.0000000        
D   1
  1     10.0642930              1.0000000        
D   1
  1      4.8432594              1.0000000        
D   1
  1      2.3307312              1.0000000        
D   1
  1      1.1216223              1.0000000        
D   1
  1      0.5397605              1.0000000        
D   1
  1      0.2597500              1.0000000        
F   1
  1      6.9117087              1.0000000        
F   1
  1      3.4199449              1.0000000        
F   1
  1      1.6922043              1.0000000        
F   1
  1      0.8373104              1.0000000        
F   1
  1      0.4143050              1.0000000        
G   1
  1      7.2379949              1.0000000        
G   1
  1      3.4157598              1.0000000        
G   1
  1      1.6119678              1.0000000        
G   1
  1      0.7607210              1.0000000        
H   1
  1      5.7331092              1.0000000        
H   1
  1      2.5824816              1.0000000        
H   1
  1      1.1632800              1.0000000        
I   1
  1      4.8130000              1.0000000        
I   1
  1      2.0780000              1.0000000        
K   1
  1      3.1230000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: F
data:
FLUORINE
S   12
  1 2115112.0000000             0.0000015        
  2 316699.7000000              0.0000113        
  3  72075.7100000              0.0000595        
  4  20416.8300000              0.0002514        
  5   6661.4580000              0.0009160        
  6   2405.1880000              0.0029860        
  7    938.2595000              0.0088819        
  8    389.2710000              0.0242321        
  9    169.8499000              0.0600301        
 10     77.2436700              0.1311355        
 11     36.3287400              0.2385632        
 12     17.5738700              0.3243075        
S   12
  1 2115112.0000000            -0.00000034       
  2 316699.7000000             -0.00000262       
  3  72075.7100000             -0.00001378       
  4  20416.8300000             -0.00005817       
  5   6661.4580000             -0.00021242       
  6   2405.1880000             -0.00069281       
  7    938.2595000             -0.00207460       
  8    389.2710000             -0.00570974       
  9    169.8499000             -0.01453560       
 10     77.2436700             -0.03323500       
 11     36.3287400             -0.06706620       
 12     17.5738700             -0.11098400       
S   1
  1      8.6935300              1.0000000        
S   1
  1      4.3217690              1.0000000        
S   1
  1      1.9595200              1.0000000        
S   1
  1      0.9031850              1.0000000        
S   1
  1      0.4104050              1.0000000        
S   1
  1      0.1820240              1.0000000        
P   6
  1   1687.7180000              0.0000346        
  2    399.6517000              0.0003058        
  3    129.8267000              0.0017313        
  4     49.5782600              0.0072975        
  5     20.8619300              0.0243126        
  6      9.3655640              0.0664341        
P   1
  1      4.4099770              1.0000000        
P   1
  1      2.1283760              1.0000000        
P   1
  1      1.0282880              1.0000000        
P   1
  1      0.4907570              1.0000000        
P   1
  1      0.2300730              1.0000000        
P   1
  1      0.1037660              1.0000000        
D   1
  1     12.6344950              1.0000000        
D   1
  1      6.1124792              1.0000000        
D   1
  1      2.9571743              1.0000000        
D   1
  1      1.4306600              1.0000000        
D   1
  1      0.6921432              1.0000000        
D   1
  1      0.3348540              1.0000000        
F   1
  1     11.6443240              1.0000000        
F   1
  1      5.5714469              1.0000000        
F   1
  1      2.6657641              1.0000000        
F   1
  1      1.2754852              1.0000000        
F   1
  1      0.6102800              1.0000000        
G   1
  1      8.2863953              1.0000000        
G   1
  1      3.9105216              1.0000000        
G   1
  1      1.8454562              1.0000000        
G   1
  1      0.8709090              1.0000000        
H   1
  1      7.7626969              1.0000000        
H   1
  1      3.4810300              1.0000000        
H   1
  1      1.5610000              1.0000000        
I   1
  1      5.5300000              1.0000000        
I   1
  1      2.1600000              1.0000000        
K   1
  1      4.2560000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: Ne
data:
NEON
S   12
  1 2636740.0000000             0.00000144       
  2 394695.0000000              0.00001122       
  3  89814.2000000              0.00005899       
  4  25439.5000000              0.00024948       
  5   8292.4800000              0.00091034       
  6   2991.7700000              0.00297099       
  7   1166.5800000              0.00883634       
  8    483.9270000              0.02412806       
  9    211.0490000              0.05988851       
 10     95.9684000              0.13097415       
 11     45.1784000              0.23835621       
 12     21.8859000              0.32418282       
S   12
  1 2636740.0000000            -0.00000034       
  2 394695.0000000             -0.00000263       
  3  89814.2000000             -0.00001386       
  4  25439.5000000             -0.00005857       
  5   8292.4800000             -0.00021420       
  6   2991.7700000             -0.00069920       
  7   1166.5800000             -0.00209449       
  8    483.9270000             -0.00576925       
  9    211.0490000             -0.01472218       
 10     95.9684000             -0.03372066       
 11     45.1784000             -0.06818732       
 12     21.8859000             -0.11289702       
S   1
  1     10.8323000              1.0000000        
S   1
  1      5.3801400              1.0000000        
S   1
  1      2.4363700              1.0000000        
S   1
  1      1.1192500              1.0000000        
S   1
  1      0.5066970              1.0000000        
S   1
  1      0.2234500              1.0000000        
P   6
  1   2081.8400000              0.00003590       
  2    494.1240000              0.00031653       
  3    160.7080000              0.00179215       
  4     61.4172000              0.00757934       
  5     25.8676000              0.02539568       
  6     11.6199000              0.06951943       
P   1
  1      5.4635300              1.0000000        
P   1
  1      2.6257400              1.0000000        
P   1
  1      1.2610600              1.0000000        
P   1
  1      0.5977780              1.0000000        
P   1
  1      0.2781360              1.0000000        
P   1
  1      0.1243620              1.0000000        
D   1
  1     16.2700000              1.0000000        
D   1
  1      7.8088200              1.0000000        
D   1
  1      3.7478600              1.0000000        
D   1
  1      1.7987900              1.0000000        
D   1
  1      0.8633360              1.0000000        
D   1
  1      0.4143600              1.0000000        
F   1
  1     17.0078000              1.0000000        
F   1
  1      7.9602800              1.0000000        
F   1
  1      3.7256900              1.0000000        
F   1
  1      1.7437600              1.0000000        
F   1
  1      0.8161400              1.0000000        
G   1
  1     10.1051000              1.0000000        
G   1
  1      4.8284800              1.0000000        
G   1
  1      2.3071800              1.0000000        
G   1
  1      1.1024300              1.0000000        
H   1
  1      9.8549000              1.0000000        
H   1
  1      4.4595900              1.0000000        
H   1
  1      2.0180800              1.0000000        
I   1
  1      7.2823700              1.0000000        
I   1
  1      2.9259400              1.0000000        
K   1
  1      5.2560000              1.0000000


name: pV7Z
description: V7Z6P Valence Septuple Zeta + Polarization on All Atoms
elt: S
data:
SULFUR
S   21
  1 7010036.0000000             0.14393981E-5    
  2 3489316.1000000            -0.84034208E-6    
  3 1736842.2000000             0.48692049E-5    
  4 864530.7300000              0.32375410E-5    
  5 430328.8900000              0.16768271E-4    
  6 214200.5400000              0.31007451E-4    
  7 106620.4800000              0.82993952E-4    
  8  53071.4180000              0.18998198E-3    
  9  26416.8330000              0.46151388E-3    
 10  13149.2450000              0.10945308E-2    
 11   6545.1692000              0.26089891E-2    
 12   3257.9239000              0.61757438E-2    
 13   1621.6645000              0.14458895E-1    
 14    807.1998400              0.33174850E-1    
 15    401.7918600              0.72811640E-1    
 16    199.9959500              0.147223973      
 17     99.54999800             0.254144316      
 18     49.55201500             0.324750529      
 19     24.66501500             0.230874675      
 20     12.27726000             0.059430194      
 21      6.111129800            0.38523020E-2    
S   21
  1 7010036.0000000             0.39743053E-6    
  2 3489316.1000000            -0.23137995E-6    
  3 1736842.2000000             0.13427142E-5    
  4 864530.7300000              0.89975164E-6    
  5 430328.8900000              0.46194157E-5    
  6 214200.5400000              0.85924467E-5    
  7 106620.4800000              0.22872063E-4    
  8  53071.4180000              0.52621485E-4    
  9  26416.8330000              0.12734765E-3    
 10  13149.2450000              0.30346017E-3    
 11   6545.1692000              0.72242155E-3    
 12   3257.9239000              0.17220247E-2    
 13   1621.6645000              0.40541165E-2    
 14    807.1998400              0.94756820E-2    
 15    401.7918600              0.21425437E-1    
 16    199.9959500              0.46194950E-1    
 17     99.54999800             0.89914022E-1    
 18     49.55201500             0.1463329579     
 19     24.66501500             0.1490147799     
 20     12.27726000            -0.0161861918     
 21      6.111129800           -0.3446816404     
S   21
  1 7010036.0000000            -0.11553338E-6    
  2 3489316.1000000             0.67978120E-7    
  3 1736842.2000000            -0.39224463E-6    
  4 864530.7300000             -0.25512491E-6    
  5 430328.8900000             -0.13547393E-5    
  6 214200.5400000             -0.24646622E-5    
  7 106620.4800000             -0.67031950E-5    
  8  53071.4180000             -0.15143074E-4    
  9  26416.8330000             -0.37253152E-4    
 10  13149.2450000             -0.87520661E-4    
 11   6545.1692000             -0.21103236E-3    
 12   3257.9239000             -0.49767312E-3    
 13   1621.6645000             -0.11840931E-2    
 14    807.1998400             -0.27474376E-2    
 15    401.7918600             -0.62804034E-2    
 16    199.9959500             -0.13515810E-1    
 17     99.54999800            -0.26818906E-1    
 18     49.55201500            -0.44279856E-1    
 19     24.66501500            -0.47655137E-1    
 20     12.27726000             0.69191566E-2    
 21      6.111129800            0.1275718473     
S   1
  1      3.041876500            1.0000000        
S   1
  1      1.514124700            1.0000000        
S   1
  1      0.753670820            1.0000000        
S   1
  1      0.375147250            1.0000000        
S   1
  1      0.186733320            1.0000000        
S   1
  1      0.092948394            1.0000000        
P   12
  1   9780.0262000              0.14400789E-4    
  2   4800.6372000              0.14765406E-4    
  3   2356.4475000              0.10011551E-3    
  4   1156.6891000              0.29000274E-3    
  5    567.7740000              0.10415811E-2    
  6    278.6983300              0.34037782E-2    
  7    136.8022500              0.10841169E-1    
  8     67.15094300             0.31942317E-1    
  9     32.96180500             0.84894757E-1    
 10     16.17967700             0.1856741163     
 11      7.941978900            0.3046790243     
 12      3.898410800            0.3454515448     
P   12
  1   9780.0262000              0.36505507E-5    
  2   4800.6372000              0.38364739E-5    
  3   2356.4475000              0.25279606E-4    
  4   1156.6891000              0.74471021E-4    
  5    567.7740000              0.26448086E-3    
  6    278.6983300              0.87332482E-3    
  7    136.8022500              0.27778292E-2    
  8     67.15094300             0.82927386E-2    
  9     32.96180500             0.22358523E-1    
 10     16.17967700             0.50261912E-1    
 11      7.941978900            0.84322121E-1    
 12      3.898410800            0.1027551345     
P   1
  1      1.913579300            1.0000000        
P   1
  1      0.939302210            1.0000000        
P   1
  1      0.461067190            1.0000000        
P   1
  1      0.226320080            1.0000000        
P   1
  1      0.111091790            1.0000000        
P   1
  1      0.054530669            1.0000000        
D   1
  1      8.1157469              1.0000000        
D   1
  1      3.6595333              1.0000000        
D   1
  1      1.6501480              1.0000000        
D   1
  1      0.7440808              1.0000000        
D   1
  1      0.3355191              1.0000000        
D   1
  1      0.1512915              1.0000000        
F   1
  1      1.7321483              1.0000000        
F   1
  1      0.7770966              1.0000000        
F   1
  1      0.3486301              1.0000000        
F   1
  1      0.1564065              1.0000000        
F   1
  1      0.0701689              1.0000000        
G   1
  1      1.5999868              1.0000000        
G   1
  1      0.9809852              1.0000000        
G   1
  1      0.6014624              1.0000000        
G   1
  1      0.3687691              1.0000000        
H   1
  1      1.5347571              1.0000000        
H   1
  1      0.9157262              1.0000000        
H   1
  1      0.5463760              1.0000000        
I   1
  1      1.5000000              1.0000000        
I   1
  1      0.7570000              1.0000000        
K   1
  1      1.2090000              1.0000000


name: pc-0
description: N/A
elt: H
data:
HYDROGEN
S   2
  1      0.434480E+01           0.792990E-01     
  2      0.660490E+00           0.424220E+00     
S   1
  1      0.136690E+00           1.0000000


name: pc-0
description: N/A
elt: He
data:
HELIUM
S   2
  1      0.132100E+02           0.435060E-01     
  2      0.194340E+01           0.211660E+00     
S   1
  1      0.354430E+00           1.0000000


name: pc-0
description: N/A
elt: Li
data:
LITHIUM
S   3
  1      0.975850E+02           0.223580E-01     
  2      0.147550E+02           0.144990E+00     
  3      0.322330E+01           0.345940E+00     
S   3
  1      0.147550E+02           0.518750E-02     
  2      0.322330E+01           0.166980E+00     
  3      0.787890E+00           0.725660E+00     
S   1
  1      0.510090E-01           1.0000000


name: pc-0
description: N/A
elt: Be
data:
BERYLLIUM
S   3
  1      0.187540E+03           0.103730E-01     
  2      0.283450E+02           0.720070E-01     
  3      0.626140E+01           0.130850E+00     
S   3
  1      0.283450E+02          -0.205070E-02     
  2      0.626140E+01           0.113120E+00     
  3      0.158370E+01           0.308000E+00     
S   1
  1      0.108580E+00           1.0000000


name: pc-0
description: N/A
elt: B
data:
BORON
S   3
  1      0.303730E+03           0.201210E-01     
  2      0.458940E+02           0.144100E+00     
  3      0.102050E+02           0.219610E+00     
S   3
  1      0.458940E+02          -0.738180E-02     
  2      0.102050E+02           0.261530E+00     
  3      0.263480E+01           0.593630E+00     
S   1
  1      0.193800E+00           1.0000000        
P   2
  1      0.279040E+01           0.109860E+00     
  2      0.541950E+00           0.468460E+00     
P   1
  1      0.118760E+00           1.0000000


name: pc-0
description: N/A
elt: C
data:
CARBON
S   3
  1      0.446510E+03           0.197880E-01     
  2      0.674620E+02           0.145340E+00     
  3      0.150670E+02           0.185290E+00     
S   3
  1      0.674620E+02          -0.999100E-02     
  2      0.150670E+02           0.285190E+00     
  3      0.393880E+01           0.566870E+00     
S   1
  1      0.299910E+00           1.0000000        
P   2
  1      0.436770E+01           0.116710E+00     
  2      0.869820E+00           0.475580E+00     
P   1
  1      0.188930E+00           1.0000000


name: pc-0
description: N/A
elt: N
data:
NITROGEN
S   3
  1      0.615850E+03           0.195880E-01     
  2      0.930440E+02           0.146950E+00     
  3      0.208480E+02           0.155600E+00     
S   3
  1      0.930440E+02          -0.120590E-01     
  2      0.208480E+02           0.301990E+00     
  3      0.549590E+01           0.540900E+00     
S   1
  1      0.426240E+00           1.0000000        
P   2
  1      0.626800E+01           0.121340E+00     
  2      0.126900E+01           0.480130E+00     
P   1
  1      0.273900E+00           1.0000000


name: pc-0
description: N/A
elt: O
data:
OXYGEN
S   3
  1      0.812120E+03           0.194500E-01     
  2      0.122690E+03           0.147740E+00     
  3      0.275610E+02           0.135930E+00     
S   3
  1      0.122690E+03          -0.131890E-01     
  2      0.275610E+02           0.315100E+00     
  3      0.731730E+01           0.529640E+00     
S   1
  1      0.579240E+00           1.0000000        
P   2
  1      0.821780E+01           0.129020E+00     
  2      0.167540E+01           0.487060E+00     
P   1
  1      0.350670E+00           1.0000000


name: pc-0
description: N/A
elt: F
data:
FLUORINE
S   3
  1      0.103510E+04           0.193510E-01     
  2      0.156380E+03           0.148840E+00     
  3      0.351960E+02           0.117350E+00     
S   3
  1      0.156380E+03          -0.143370E-01     
  2      0.351960E+02           0.325510E+00     
  3      0.939210E+01           0.516810E+00     
S   1
  1      0.753420E+00           1.0000000        
P   2
  1      0.105990E+02           0.132730E+00     
  2      0.217330E+01           0.489380E+00     
P   1
  1      0.448710E+00           1.0000000


name: pc-0
description: N/A
elt: Ne
data:
NEON
S   3
  1      0.128450E+04           0.964190E-01     
  2      0.194050E+03           0.750190E+00     
  3      0.437460E+02           0.497650E+00     
S   3
  1      0.194050E+03          -0.767080E-02     
  2      0.437460E+02           0.166930E+00     
  3      0.117200E+02           0.251510E+00     
S   1
  1      0.947460E+00           1.0000000        
P   2
  1      0.133480E+02           0.674670E-01     
  2      0.275090E+01           0.245310E+00     
P   1
  1      0.564340E+00           1.0000000


name: pc-0
description: N/A
elt: Na
data:
SODIUM
S   5
  1      0.455350E+04           0.515830E-02     
  2      0.685090E+03           0.386000E-01     
  3      0.155730E+03           0.173850E+00     
  4      0.433710E+02           0.456460E+00     
  5      0.133390E+02           0.462910E+00     
S   5
  1      0.685090E+03          -0.318540E-03     
  2      0.155730E+03          -0.226480E-02     
  3      0.433710E+02          -0.339230E-01     
  4      0.133390E+02          -0.763090E-01     
  5      0.231060E+01           0.337270E+00     
S   5
  1      0.155730E+03          -0.791310E-04     
  2      0.433710E+02          -0.699060E-03     
  3      0.133390E+02          -0.320830E-02     
  4      0.231060E+01           0.300560E-01     
  5      0.706690E+00           0.112240E+00     
S   1
  1      0.459420E-01           1.0000000        
P   4
  1      0.377930E+02           0.464950E-01     
  2      0.841340E+01           0.243110E+00     
  3      0.232100E+01           0.517380E+00     
  4      0.606580E+00           0.425980E+00     
P   1
  1      0.950000E-01           1.0000000


name: pc-0
description: N/A
elt: Mg
data:
MAGNESIUM
S   5
  1      0.552080E+04           0.252540E-02     
  2      0.830560E+03           0.189320E-01     
  3      0.188810E+03           0.855650E-01     
  4      0.526380E+02           0.227760E+00     
  5      0.162330E+02           0.235650E+00     
S   5
  1      0.830560E+03          -0.151900E-03     
  2      0.188810E+03          -0.874840E-03     
  3      0.526380E+02          -0.146070E-01     
  4      0.162330E+02          -0.303490E-01     
  5      0.292750E+01           0.103600E+00     
S   5
  1      0.188810E+03          -0.116040E-02     
  2      0.526380E+02          -0.988450E-02     
  3      0.162330E+02          -0.434160E-01     
  4      0.292750E+01           0.311960E+00     
  5      0.947860E+00           0.726450E+00     
S   1
  1      0.763610E-01           1.0000000        
P   4
  1      0.494530E+02           0.217390E-01     
  2      0.111160E+02           0.116900E+00     
  3      0.312730E+01           0.259930E+00     
  4      0.859400E+00           0.211080E+00     
P   1
  1      0.160000E+00           1.0000000


name: pc-0
description: N/A
elt: Al
data:
ALUMINUM
S   5
  1      0.658710E+04           0.495700E-02     
  2      0.990920E+03           0.372230E-01     
  3      0.225290E+03           0.168750E+00     
  4      0.628660E+02           0.455050E+00     
  5      0.194320E+02           0.480100E+00     
S   5
  1      0.990920E+03          -0.295250E-03     
  2      0.225290E+03          -0.156740E-02     
  3      0.628660E+02          -0.274340E-01     
  4      0.194320E+02          -0.556000E-01     
  5      0.362070E+01           0.151880E+00     
S   5
  1      0.225290E+03          -0.343830E-03     
  2      0.628660E+02          -0.293810E-02     
  3      0.194320E+02          -0.130470E-01     
  4      0.362070E+01           0.856790E-01     
  5      0.122880E+01           0.180250E+00     
S   1
  1      0.120680E+00           1.0000000        
P   4
  1      0.723650E+02           0.329530E-01     
  2      0.165430E+02           0.189890E+00     
  3      0.482390E+01           0.474890E+00     
  4      0.143360E+01           0.480330E+00     
P   4
  1      0.165430E+02          -0.306070E-03     
  2      0.482390E+01          -0.812540E-02     
  3      0.143360E+01           0.582160E-02     
  4      0.276890E+00           0.378310E+00     
P   1
  1      0.698560E-01           1.0000000


name: pc-0
description: N/A
elt: Si
data:
SILICON
S   5
  1      0.774300E+04           0.488250E-02     
  2      0.116470E+04           0.367410E-01     
  3      0.264820E+03           0.166950E+00     
  4      0.739680E+02           0.456570E+00     
  5      0.229120E+02           0.490430E+00     
S   5
  1      0.116470E+04          -0.291110E-03     
  2      0.264820E+03          -0.141220E-02     
  3      0.739680E+02          -0.260460E-01     
  4      0.229120E+02          -0.509330E-01     
  5      0.437410E+01           0.108100E+00     
S   5
  1      0.264820E+03          -0.444370E-03     
  2      0.739680E+02          -0.380670E-02     
  3      0.229120E+02          -0.170780E-01     
  4      0.437410E+01           0.105690E+00     
  5      0.153910E+01           0.204290E+00     
S   1
  1      0.167750E+00           1.0000000        
P   4
  1      0.960800E+02           0.280350E-01     
  2      0.221500E+02           0.168190E+00     
  3      0.656300E+01           0.451970E+00     
  4      0.202500E+01           0.501320E+00     
P   4
  1      0.221500E+02          -0.727970E-03     
  2      0.656300E+01          -0.866440E-02     
  3      0.202500E+01          -0.353440E-02     
  4      0.477800E+00           0.310850E+00     
P   1
  1      0.128240E+00           1.0000000


name: pc-0
description: N/A
elt: P
data:
PHOSPHORUS
S   5
  1      0.899080E+04           0.482060E-02     
  2      0.135240E+04           0.363920E-01     
  3      0.307500E+03           0.165630E+00     
  4      0.859410E+02           0.462170E+00     
  5      0.266710E+02           0.505820E+00     
S   5
  1      0.135240E+04           0.289000E-02     
  2      0.307500E+03           0.126380E-01     
  3      0.859410E+02           0.247900E+00     
  4      0.266710E+02           0.461650E+00     
  5      0.518810E+01          -0.701800E+00     
S   5
  1      0.307500E+03          -0.545120E-03     
  2      0.859410E+02          -0.468380E-02     
  3      0.266710E+02          -0.211600E-01     
  4      0.518810E+01           0.125340E+00     
  5      0.187780E+01           0.224270E+00     
S   1
  1      0.220100E+00           1.0000000        
P   4
  1      0.111640E+03           0.286630E-01     
  2      0.257840E+02           0.172650E+00     
  3      0.767250E+01           0.461810E+00     
  4      0.239960E+01           0.491740E+00     
P   4
  1      0.257840E+02          -0.685450E-03     
  2      0.767250E+01          -0.112960E-01     
  3      0.239960E+01           0.329620E-02     
  4      0.549430E+00           0.416130E+00     
P   1
  1      0.147480E+00           1.0000000


name: pc-0
description: N/A
elt: S
data:
SULFUR
S   5
  1      0.103300E+05           0.476850E-02     
  2      0.155370E+04           0.362090E-01     
  3      0.353300E+03           0.164910E+00     
  4      0.988050E+02           0.475480E+00     
  5      0.307160E+02           0.533190E+00     
S   5
  1      0.155370E+04           0.289030E-02     
  2      0.353300E+03           0.115750E-01     
  3      0.988050E+02           0.239930E+00     
  4      0.307160E+02           0.428300E+00     
  5      0.606330E+01          -0.420630E+00     
S   5
  1      0.353300E+03          -0.625010E-03     
  2      0.988050E+02          -0.538810E-02     
  3      0.307160E+02          -0.245210E-01     
  4      0.606330E+01           0.141320E+00     
  5      0.224750E+01           0.239480E+00     
S   1
  1      0.278530E+00           1.0000000        
P   4
  1      0.129760E+03           0.287060E-01     
  2      0.300250E+02           0.174200E+00     
  3      0.897330E+01           0.467090E+00     
  4      0.284400E+01           0.485710E+00     
P   4
  1      0.300250E+02          -0.117850E-03     
  2      0.897330E+01          -0.144830E-01     
  3      0.284400E+01           0.159390E-01     
  4      0.633610E+00           0.482570E+00     
P   1
  1      0.169550E+00           1.0000000


name: pc-0
description: N/A
elt: Cl
data:
CHLORINE
S   5
  1      0.117590E+05           0.472480E-02     
  2      0.176860E+04           0.365460E-01     
  3      0.402190E+03           0.165970E+00     
  4      0.112540E+03           0.525300E+00     
  5      0.350390E+02           0.619550E+00     
S   5
  1      0.176860E+04           0.290530E-02     
  2      0.402190E+03           0.106640E-01     
  3      0.112540E+03           0.234060E+00     
  4      0.350390E+02           0.399150E+00     
  5      0.699560E+01          -0.179370E+00     
S   5
  1      0.402190E+03          -0.691970E-03     
  2      0.112540E+03          -0.597600E-02     
  3      0.350390E+02          -0.273940E-01     
  4      0.699560E+01           0.155160E+00     
  5      0.264550E+01           0.250280E+00     
S   1
  1      0.341570E+00           1.0000000        
P   4
  1      0.150660E+03           0.282990E-01     
  2      0.349330E+02           0.173360E+00     
  3      0.104920E+02           0.468120E+00     
  4      0.337260E+01           0.483210E+00     
P   4
  1      0.349330E+02           0.135980E-03     
  2      0.104920E+02          -0.166110E-01     
  3      0.337260E+01           0.223510E-01     
  4      0.759890E+00           0.511920E+00     
P   1
  1      0.202890E+00           1.0000000


name: pc-0
description: N/A
elt: Ar
data:
ARGON
S   5
  1      0.132770E+05           0.234400E-01     
  2      0.199690E+04           0.152250E+00     
  3      0.454120E+03           0.725360E+00     
  4      0.127140E+03           0.331800E+00     
  5      0.396370E+02          -0.637510E+00     
S   5
  1      0.199690E+04           0.146890E-02     
  2      0.454120E+03           0.492820E-02     
  3      0.127140E+03           0.114580E+00     
  4      0.396370E+02           0.185480E+00     
  5      0.798170E+01           0.218940E-01     
S   5
  1      0.454120E+03          -0.374690E-03     
  2      0.127140E+03          -0.324620E-02     
  3      0.396370E+02          -0.149680E-01     
  4      0.798170E+01           0.839360E-01     
  5      0.307060E+01           0.128910E+00     
S   1
  1      0.409080E+00           1.0000000        
P   4
  1      0.173230E+03           0.139550E-01     
  2      0.402390E+02           0.862260E-01     
  3      0.121390E+02           0.234230E+00     
  4      0.395270E+01           0.240620E+00     
P   4
  1      0.402390E+02           0.131310E-03     
  2      0.121390E+02          -0.914820E-02     
  3      0.395270E+01           0.132800E-01     
  4      0.906260E+00           0.265030E+00     
P   1
  1      0.242520E+00           1.0000000


name: pc-1
description: N/A
elt: Sc
data:
SCANDIUM
S   11
  1      0.46097E+05            0.16801E-02      
  2      0.69207E+04            0.12903E-01      
  3      0.15752E+04            0.64202E-01      
  4      0.44504E+03            0.22687E+00      
  5      0.14366E+03            0.50000E+00      
  6      0.49826E+02            0.46630E+00      
  7      0.12081E+02            0.60942E-01      
  8      0.48928E+01           -0.20424E-01      
  9      0.13008E+01            0.80989E-02      
 10      0.54357E+00           -0.41264E-02      
 11      0.96961E-01            0.12409E-02      
S   11
  1      0.46097E+05           -0.31045E-03      
  2      0.69207E+04           -0.23762E-02      
  3      0.15752E+04           -0.12270E-01      
  4      0.44504E+03           -0.45802E-01      
  5      0.14366E+03           -0.12824E+00      
  6      0.49826E+02           -0.17009E+00      
  7      0.12081E+02            0.28137E+00      
  8      0.48928E+01            0.50000E+00      
  9      0.13008E+01            0.68068E-01      
 10      0.54357E+00           -0.17790E-01      
 11      0.96961E-01            0.43168E-02      
S   11
  1      0.46097E+05            0.10427E-03      
  2      0.69207E+04            0.79883E-03      
  3      0.15752E+04            0.41331E-02      
  4      0.44504E+03            0.15565E-01      
  5      0.14366E+03            0.44537E-01      
  6      0.49826E+02            0.62956E-01      
  7      0.12081E+02           -0.13838E+00      
  8      0.48928E+01           -0.35501E+00      
  9      0.13008E+01            0.29703E+00      
 10      0.54357E+00            0.50000E+00      
 11      0.96961E-01            0.39536E-01      
S   11
  1      0.46097E+05           -0.45804E-04      
  2      0.69207E+04           -0.35112E-03      
  3      0.15752E+04           -0.18159E-02      
  4      0.44504E+03           -0.68524E-02      
  5      0.14366E+03           -0.19632E-01      
  6      0.49826E+02           -0.28037E-01      
  7      0.12081E+02            0.63819E-01      
  8      0.48928E+01            0.17247E+00      
  9      0.13008E+01           -0.18094E+00      
 10      0.54357E+00           -0.46274E+00      
 11      0.96961E-01            0.50000E+00      
S   1
  1      0.38586E-01            1.0000000        
P   8
  1      0.74067E+03            0.49118E-02      
  2      0.17447E+03            0.38632E-01      
  3      0.55373E+02            0.16431E+00      
  4      0.20234E+02            0.40636E+00      
  5      0.78652E+01            0.50000E+00      
  6      0.30838E+01            0.19046E+00      
  7      0.11488E+01            0.17802E-02      
  8      0.39011E+00            0.14402E-02      
P   8
  1      0.74067E+03           -0.12764E-02      
  2      0.17447E+03           -0.10089E-01      
  3      0.55373E+02           -0.44688E-01      
  4      0.20234E+02           -0.11620E+00      
  5      0.78652E+01           -0.15096E+00      
  6      0.30838E+01            0.83789E-01      
  7      0.11488E+01            0.50000E+00      
  8      0.39011E+00            0.32895E+00      
P   1
  1      0.78000E-01            1.0000000        
D   5
  1      0.28824E+02            0.15986E-01      
  2      0.80588E+01            0.92287E-01      
  3      0.26663E+01            0.27811E+00      
  4      0.94173E+00            0.45725E+00      
  5      0.31064E+00            0.50000E+00      
D   1
  1      0.93444E-01            1.0000000        
F   1
  1      0.931000E+00           1.0000000


name: pc-1
description: N/A
elt: Ti
data:
TITANIUM
S   11
  1      0.50936E+05            0.16712E-02      
  2      0.76471E+04            0.12836E-01      
  3      0.17406E+04            0.63898E-01      
  4      0.49177E+03            0.22615E+00      
  5      0.15879E+03            0.50000E+00      
  6      0.55129E+02            0.46917E+00      
  7      0.13483E+02            0.62437E-01      
  8      0.55039E+01           -0.20885E-01      
  9      0.14846E+01            0.81630E-02      
 10      0.61682E+00           -0.40607E-02      
 11      0.10679E+00            0.11820E-02      
S   11
  1      0.50936E+05           -0.30937E-03      
  2      0.76471E+04           -0.23686E-02      
  3      0.17406E+04           -0.12233E-01      
  4      0.49177E+03           -0.45751E-01      
  5      0.15879E+03           -0.12839E+00      
  6      0.55129E+02           -0.17166E+00      
  7      0.13483E+02            0.27780E+00      
  8      0.55039E+01            0.50000E+00      
  9      0.14846E+01            0.68150E-01      
 10      0.61682E+00           -0.17164E-01      
 11      0.10679E+00            0.40304E-02      
S   11
  1      0.50936E+05            0.10566E-03      
  2      0.76471E+04            0.80991E-03      
  3      0.17406E+04            0.41902E-02      
  4      0.49177E+03            0.15819E-01      
  5      0.15879E+03            0.45371E-01      
  6      0.55129E+02            0.64789E-01      
  7      0.13483E+02           -0.14031E+00      
  8      0.55039E+01           -0.36133E+00      
  9      0.14846E+01            0.30232E+00      
 10      0.61682E+00            0.50000E+00      
 11      0.10679E+00            0.37362E-01      
S   11
  1      0.50936E+05           -0.43149E-04      
  2      0.76471E+04           -0.33089E-03      
  3      0.17406E+04           -0.17115E-02      
  4      0.49177E+03           -0.64730E-02      
  5      0.15879E+03           -0.18597E-01      
  6      0.55129E+02           -0.26820E-01      
  7      0.13483E+02            0.60178E-01      
  8      0.55039E+01            0.16367E+00      
  9      0.14846E+01           -0.17289E+00      
 10      0.61682E+00           -0.42914E+00      
 11      0.10679E+00            0.50000E+00      
S   1
  1      0.41697E-01            1.0000000        
P   8
  1      0.82565E+03            0.48606E-02      
  2      0.19457E+03            0.38324E-01      
  3      0.61820E+02            0.16380E+00      
  4      0.22628E+02            0.40710E+00      
  5      0.88254E+01            0.50000E+00      
  6      0.34692E+01            0.18735E+00      
  7      0.13084E+01            0.10665E-02      
  8      0.44821E+00            0.15748E-02      
P   8
  1      0.82565E+03           -0.12854E-02      
  2      0.19457E+03           -0.10193E-01      
  3      0.61820E+02           -0.45384E-01      
  4      0.22628E+02           -0.11890E+00      
  5      0.88254E+01           -0.15349E+00      
  6      0.34692E+01            0.90834E-01      
  7      0.13084E+01            0.50000E+00      
  8      0.44821E+00            0.32095E+00      
P   1
  1      0.90000E-01            1.0000000        
D   5
  1      0.36191E+02            0.15178E-01      
  2      0.10203E+02            0.91318E-01      
  3      0.34312E+01            0.28210E+00      
  4      0.12439E+01            0.47267E+00      
  5      0.42753E+00            0.50000E+00      
D   1
  1      0.13088E+00            1.0000000        
F   1
  1      1.025000E+00           1.0000000


name: pc-1
description: N/A
elt: V
data:
VANADIUM
S   11
  1      0.56021E+05            0.16631E-02      
  2      0.84104E+04            0.12774E-01      
  3      0.19143E+04            0.63621E-01      
  4      0.54087E+03            0.22548E+00      
  5      0.17469E+03            0.50000E+00      
  6      0.60705E+02            0.47179E+00      
  7      0.14963E+02            0.63791E-01      
  8      0.61493E+01           -0.21278E-01      
  9      0.16787E+01            0.82046E-02      
 10      0.69217E+00           -0.40035E-02      
 11      0.11834E+00            0.11382E-02      
S   11
  1      0.56021E+05           -0.30835E-03      
  2      0.84104E+04           -0.23614E-02      
  3      0.19143E+04           -0.12198E-01      
  4      0.54087E+03           -0.45700E-01      
  5      0.17469E+03           -0.12853E+00      
  6      0.60705E+02           -0.17308E+00      
  7      0.14963E+02            0.27467E+00      
  8      0.61493E+01            0.50000E+00      
  9      0.16787E+01            0.68191E-01      
 10      0.69217E+00           -0.16641E-01      
 11      0.11834E+00            0.38216E-02      
S   11
  1      0.56021E+05            0.10658E-03      
  2      0.84104E+04            0.81729E-03      
  3      0.19143E+04            0.42283E-02      
  4      0.54087E+03            0.15999E-01      
  5      0.17469E+03            0.45988E-01      
  6      0.60705E+02            0.66269E-01      
  7      0.14963E+02           -0.14162E+00      
  8      0.61493E+01           -0.36567E+00      
  9      0.16787E+01            0.30531E+00      
 10      0.69217E+00            0.50000E+00      
 11      0.11834E+00            0.36270E-01      
S   11
  1      0.56021E+05           -0.43198E-04      
  2      0.84104E+04           -0.33141E-03      
  3      0.19143E+04           -0.17142E-02      
  4      0.54087E+03           -0.64978E-02      
  5      0.17469E+03           -0.18711E-01      
  6      0.60705E+02           -0.27232E-01      
  7      0.14963E+02            0.60326E-01      
  8      0.61493E+01            0.16444E+00      
  9      0.16787E+01           -0.17286E+00      
 10      0.69217E+00           -0.42545E+00      
 11      0.11834E+00            0.50000E+00      
S   1
  1      0.45042E-01            1.0000000        
P   8
  1      0.91263E+03            0.48403E-02      
  2      0.21515E+03            0.38235E-01      
  3      0.68419E+02            0.16406E+00      
  4      0.25078E+02            0.40897E+00      
  5      0.98054E+01            0.50000E+00      
  6      0.38576E+01            0.18332E+00      
  7      0.14678E+01            0.22075E-03      
  8      0.50494E+00            0.17067E-02      
P   8
  1      0.91263E+03           -0.12972E-02      
  2      0.21515E+03           -0.10314E-01      
  3      0.68419E+02           -0.46113E-01      
  4      0.25078E+02           -0.12147E+00      
  5      0.98054E+01           -0.15528E+00      
  6      0.38576E+01            0.99152E-01      
  7      0.14678E+01            0.50000E+00      
  8      0.50494E+00            0.31456E+00      
P   1
  1      0.10100E+00            1.0000000        
D   5
  1      0.42114E+02            0.15285E-01      
  2      0.11937E+02            0.93427E-01      
  3      0.40535E+01            0.28907E+00      
  4      0.14829E+01            0.48212E+00      
  5      0.51467E+00            0.50000E+00      
D   1
  1      0.15805E+00            1.0000000        
F   1
  1      1.127000E+00           1.0000000


name: pc-1
description: N/A
elt: Cr
data:
CHROMIUM
S   11
  1      0.61342E+05            0.16558E-02      
  2      0.92093E+04            0.12719E-01      
  3      0.20961E+04            0.63371E-01      
  4      0.59227E+03            0.22488E+00      
  5      0.19134E+03            0.50000E+00      
  6      0.66546E+02            0.47416E+00      
  7      0.16518E+02            0.64994E-01      
  8      0.68267E+01           -0.21602E-01      
  9      0.18813E+01            0.82213E-02      
 10      0.76988E+00           -0.39429E-02      
 11      0.13007E+00            0.10981E-02      
S   11
  1      0.61342E+05           -0.30748E-03      
  2      0.92093E+04           -0.23551E-02      
  3      0.20961E+04           -0.12168E-01      
  4      0.59227E+03           -0.45657E-01      
  5      0.19134E+03           -0.12867E+00      
  6      0.66546E+02           -0.17437E+00      
  7      0.16518E+02            0.27205E+00      
  8      0.68267E+01            0.50000E+00      
  9      0.18813E+01            0.68119E-01      
 10      0.76988E+00           -0.16178E-01      
 11      0.13007E+00            0.36455E-02      
S   11
  1      0.61342E+05            0.10737E-03      
  2      0.92093E+04            0.82365E-03      
  3      0.20961E+04            0.42611E-02      
  4      0.59227E+03            0.16156E-01      
  5      0.19134E+03            0.46532E-01      
  6      0.66546E+02            0.67598E-01      
  7      0.16518E+02           -0.14286E+00      
  8      0.68267E+01           -0.36925E+00      
  9      0.18813E+01            0.30824E+00      
 10      0.76988E+00            0.50000E+00      
 11      0.13007E+00            0.35372E-01      
S   11
  1      0.61342E+05           -0.43371E-04      
  2      0.92093E+04           -0.33286E-03      
  3      0.20961E+04           -0.17216E-02      
  4      0.59227E+03           -0.65394E-02      
  5      0.19134E+03           -0.18869E-01      
  6      0.66546E+02           -0.27688E-01      
  7      0.16518E+02            0.60681E-01      
  8      0.68267E+01            0.16543E+00      
  9      0.18813E+01           -0.17326E+00      
 10      0.76988E+00           -0.42327E+00      
 11      0.13007E+00            0.50000E+00      
S   1
  1      0.48340E-01            1.0000000        
P   8
  1      0.10037E+04            0.48250E-02      
  2      0.23670E+03            0.38176E-01      
  3      0.75332E+02            0.16437E+00      
  4      0.27647E+02            0.41083E+00      
  5      0.10833E+02            0.50000E+00      
  6      0.42639E+01            0.17965E+00      
  7      0.16324E+01           -0.50012E-03      
  8      0.56312E+00            0.18135E-02      
P   8
  1      0.10037E+04           -0.13074E-02      
  2      0.23670E+03           -0.10420E-01      
  3      0.75332E+02           -0.46757E-01      
  4      0.27647E+02           -0.12375E+00      
  5      0.10833E+02           -0.15671E+00      
  6      0.42639E+01            0.10700E+00      
  7      0.16324E+01            0.50000E+00      
  8      0.56312E+00            0.30920E+00      
P   1
  1      0.11300E+00            1.0000000        
D   5
  1      0.47803E+02            0.15631E-01      
  2      0.13607E+02            0.96382E-01      
  3      0.46543E+01            0.29741E+00      
  4      0.17104E+01            0.49093E+00      
  5      0.59548E+00            0.50000E+00      
D   1
  1      0.18222E+00            1.0000000        
F   1
  1      1.240000E+00           1.0000000


name: pc-1
description: N/A
elt: Mn
data:
MANGANESE
S   11
  1      0.66883E+05            0.16496E-02      
  2      0.10041E+05            0.12673E-01      
  3      0.22854E+04            0.63161E-01      
  4      0.64577E+03            0.22438E+00      
  5      0.20867E+03            0.50000E+00      
  6      0.72632E+02            0.47613E+00      
  7      0.18137E+02            0.65974E-01      
  8      0.75308E+01           -0.21827E-01      
  9      0.20877E+01            0.81889E-02      
 10      0.84772E+00           -0.38622E-02      
 11      0.14062E+00            0.10537E-02      
S   11
  1      0.66883E+05           -0.30694E-03      
  2      0.10041E+05           -0.23515E-02      
  3      0.22854E+04           -0.12151E-01      
  4      0.64577E+03           -0.45653E-01      
  5      0.20867E+03           -0.12891E+00      
  6      0.72632E+02           -0.17555E+00      
  7      0.18137E+02            0.27037E+00      
  8      0.75308E+01            0.50000E+00      
  9      0.20877E+01            0.67731E-01      
 10      0.84772E+00           -0.15724E-01      
 11      0.14062E+00            0.34788E-02      
S   11
  1      0.66883E+05            0.10832E-03      
  2      0.10041E+05            0.83125E-03      
  3      0.22854E+04            0.43002E-02      
  4      0.64577E+03            0.16334E-01      
  5      0.20867E+03            0.47126E-01      
  6      0.72632E+02            0.68935E-01      
  7      0.18137E+02           -0.14464E+00      
  8      0.75308E+01           -0.37274E+00      
  9      0.20877E+01            0.31332E+00      
 10      0.84772E+00            0.50000E+00      
 11      0.14062E+00            0.34371E-01      
S   11
  1      0.66883E+05           -0.42848E-04      
  2      0.10041E+05           -0.32896E-03      
  3      0.22854E+04           -0.17015E-02      
  4      0.64577E+03           -0.64744E-02      
  5      0.20867E+03           -0.18716E-01      
  6      0.72632E+02           -0.27651E-01      
  7      0.18137E+02            0.60165E-01      
  8      0.75308E+01            0.16353E+00      
  9      0.20877E+01           -0.17208E+00      
 10      0.84772E+00           -0.41451E+00      
 11      0.14062E+00            0.50000E+00      
S   1
  1      0.51188E-01            1.0000000        
P   8
  1      0.10996E+04            0.48064E-02      
  2      0.25940E+03            0.38093E-01      
  3      0.82614E+02            0.16457E+00      
  4      0.30354E+02            0.41239E+00      
  5      0.11916E+02            0.50000E+00      
  6      0.46921E+01            0.17653E+00      
  7      0.18031E+01           -0.10643E-02      
  8      0.62276E+00            0.18879E-02      
P   8
  1      0.10996E+04           -0.13142E-02      
  2      0.25940E+03           -0.10500E-01      
  3      0.82614E+02           -0.47279E-01      
  4      0.30354E+02           -0.12570E+00      
  5      0.11916E+02           -0.15785E+00      
  6      0.46921E+01            0.11397E+00      
  7      0.18031E+01            0.50000E+00      
  8      0.62276E+00            0.30505E+00      
P   1
  1      0.12500E+00            1.0000000        
D   5
  1      0.54249E+02            0.15643E-01      
  2      0.15506E+02            0.97445E-01      
  3      0.53408E+01            0.30131E+00      
  4      0.19744E+01            0.49562E+00      
  5      0.69159E+00            0.50000E+00      
D   1
  1      0.21227E+00            1.0000000        
F   1
  1      1.364000E+00           1.0000000


name: pc-1
description: N/A
elt: Fe
data:
IRON
S   11
  1      0.72674E+05            0.16437E-02      
  2      0.10910E+05            0.12628E-01      
  3      0.24832E+04            0.62961E-01      
  4      0.70169E+03            0.22391E+00      
  5      0.22679E+03            0.50000E+00      
  6      0.78995E+02            0.47803E+00      
  7      0.19831E+02            0.66916E-01      
  8      0.82696E+01           -0.22057E-01      
  9      0.23063E+01            0.81784E-02      
 10      0.93170E+00           -0.37941E-02      
 11      0.15024E+00            0.10133E-02      
S   11
  1      0.72674E+05           -0.30640E-03      
  2      0.10910E+05           -0.23476E-02      
  3      0.24832E+04           -0.12134E-01      
  4      0.70169E+03           -0.45643E-01      
  5      0.22679E+03           -0.12912E+00      
  6      0.78995E+02           -0.17667E+00      
  7      0.19831E+02            0.26883E+00      
  8      0.82696E+01            0.50000E+00      
  9      0.23063E+01            0.67463E-01      
 10      0.93170E+00           -0.15317E-01      
 11      0.15024E+00            0.33196E-02      
S   11
  1      0.72674E+05            0.10907E-03      
  2      0.10910E+05            0.83726E-03      
  3      0.24832E+04            0.43315E-02      
  4      0.70169E+03            0.16480E-01      
  5      0.22679E+03            0.47631E-01      
  6      0.78995E+02            0.70110E-01      
  7      0.19831E+02           -0.14609E+00      
  8      0.82696E+01           -0.37577E+00      
  9      0.23063E+01            0.31704E+00      
 10      0.93170E+00            0.50000E+00      
 11      0.15024E+00            0.33172E-01      
S   11
  1      0.72674E+05           -0.41589E-04      
  2      0.10910E+05           -0.31939E-03      
  3      0.24832E+04           -0.16520E-02      
  4      0.70169E+03           -0.62966E-02      
  5      0.22679E+03           -0.18235E-01      
  6      0.78995E+02           -0.27113E-01      
  7      0.19831E+02            0.58629E-01      
  8      0.82696E+01            0.15885E+00      
  9      0.23063E+01           -0.16754E+00      
 10      0.93170E+00           -0.39911E+00      
 11      0.15024E+00            0.50000E+00      
S   1
  1      0.54170E-01            1.0000000        
P   8
  1      0.12020E+04            0.47750E-02      
  2      0.28364E+03            0.37903E-01      
  3      0.90406E+02            0.16429E+00      
  4      0.33260E+02            0.41298E+00      
  5      0.13085E+02            0.50000E+00      
  6      0.51607E+01            0.17479E+00      
  7      0.19893E+01           -0.13337E-02      
  8      0.68911E+00            0.19180E-02      
P   8
  1      0.12020E+04           -0.13166E-02      
  2      0.28364E+03           -0.10540E-01      
  3      0.90406E+02           -0.47628E-01      
  4      0.33260E+02           -0.12720E+00      
  5      0.13085E+02           -0.15904E+00      
  6      0.51607E+01            0.11869E+00      
  7      0.19893E+01            0.50000E+00      
  8      0.68911E+00            0.30103E+00      
P   1
  1      0.13800E+00            1.0000000        
D   5
  1      0.59117E+02            0.16422E-01      
  2      0.16934E+02            0.10218E+00      
  3      0.58526E+01            0.31138E+00      
  4      0.21589E+01            0.50000E+00      
  5      0.75023E+00            0.49302E+00      
D   1
  1      0.22643E+00            1.0000000        
F   1
  1      1.500000E+00           1.0000000


name: pc-1
description: N/A
elt: Co
data:
COBALT
S   11
  1      0.78699E+05            0.16384E-02      
  2      0.11815E+05            0.12588E-01      
  3      0.26890E+04            0.62780E-01      
  4      0.75987E+03            0.22347E+00      
  5      0.24565E+03            0.50000E+00      
  6      0.85621E+02            0.47972E+00      
  7      0.21612E+02            0.67745E-01      
  8      0.90441E+01           -0.22202E-01      
  9      0.25329E+01            0.81277E-02      
 10      0.10173E+01           -0.37108E-02      
 11      0.15937E+00            0.96929E-03      
S   11
  1      0.78699E+05           -0.30577E-03      
  2      0.11815E+05           -0.23431E-02      
  3      0.26890E+04           -0.12113E-01      
  4      0.75987E+03           -0.45614E-01      
  5      0.24565E+03           -0.12925E+00      
  6      0.85621E+02           -0.17761E+00      
  7      0.21612E+02            0.26708E+00      
  8      0.90441E+01            0.50000E+00      
  9      0.25329E+01            0.67171E-01      
 10      0.10173E+01           -0.14949E-01      
 11      0.15937E+00            0.31734E-02      
S   11
  1      0.78699E+05            0.10972E-03      
  2      0.11815E+05            0.84247E-03      
  3      0.26890E+04            0.43583E-02      
  4      0.75987E+03            0.16607E-01      
  5      0.24565E+03            0.48073E-01      
  6      0.85621E+02            0.71172E-01      
  7      0.21612E+02           -0.14723E+00      
  8      0.90441E+01           -0.37836E+00      
  9      0.25329E+01            0.32049E+00      
 10      0.10173E+01            0.50000E+00      
 11      0.15937E+00            0.32125E-01      
S   11
  1      0.78699E+05           -0.40551E-04      
  2      0.11815E+05           -0.31152E-03      
  3      0.26890E+04           -0.16112E-02      
  4      0.75987E+03           -0.61508E-02      
  5      0.24565E+03           -0.17840E-01      
  6      0.85621E+02           -0.26684E-01      
  7      0.21612E+02            0.57311E-01      
  8      0.90441E+01            0.15489E+00      
  9      0.25329E+01           -0.16355E+00      
 10      0.10173E+01           -0.38609E+00      
 11      0.15937E+00            0.50000E+00      
S   1
  1      0.56766E-01            1.0000000        
P   8
  1      0.13093E+04            0.47440E-02      
  2      0.30905E+03            0.37714E-01      
  3      0.98576E+02            0.16398E+00      
  4      0.36310E+02            0.41343E+00      
  5      0.14314E+02            0.50000E+00      
  6      0.56545E+01            0.17339E+00      
  7      0.21834E+01           -0.15052E-02      
  8      0.75723E+00            0.19266E-02      
P   8
  1      0.13093E+04           -0.13174E-02      
  2      0.30905E+03           -0.10566E-01      
  3      0.98576E+02           -0.47907E-01      
  4      0.36310E+02           -0.12848E+00      
  5      0.14314E+02           -0.16009E+00      
  6      0.56545E+01            0.12274E+00      
  7      0.21834E+01            0.50000E+00      
  8      0.75723E+00            0.29839E+00      
P   1
  1      0.15100E+00            1.0000000        
D   5
  1      0.65359E+02            0.16567E-01      
  2      0.18770E+02            0.10363E+00      
  3      0.65162E+01            0.31428E+00      
  4      0.24082E+01            0.50000E+00      
  5      0.83633E+00            0.48889E+00      
D   1
  1      0.25129E+00            1.0000000        
F   1
  1      1.650000E+00           1.0000000


name: pc-1
description: N/A
elt: Ni
data:
NICKEL
S   11
  1      0.84924E+05            0.16342E-02      
  2      0.12749E+05            0.12557E-01      
  3      0.29017E+04            0.62636E-01      
  4      0.82002E+03            0.22313E+00      
  5      0.26515E+03            0.50000E+00      
  6      0.92480E+02            0.48110E+00      
  7      0.23432E+02            0.68416E-01      
  8      0.98372E+01           -0.22360E-01      
  9      0.27655E+01            0.80967E-02      
 10      0.11044E+01           -0.36445E-02      
 11      0.16880E+00            0.93297E-03      
S   11
  1      0.84924E+05           -0.30583E-03      
  2      0.12749E+05           -0.23437E-02      
  3      0.29017E+04           -0.12118E-01      
  4      0.82002E+03           -0.45670E-01      
  5      0.26515E+03           -0.12963E+00      
  6      0.92480E+02           -0.17864E+00      
  7      0.23432E+02            0.26693E+00      
  8      0.98372E+01            0.50000E+00      
  9      0.27655E+01            0.66637E-01      
 10      0.11044E+01           -0.14562E-01      
 11      0.16880E+00            0.30326E-02      
S   11
  1      0.84924E+05            0.11055E-03      
  2      0.12749E+05            0.84906E-03      
  3      0.29017E+04            0.43924E-02      
  4      0.82002E+03            0.16758E-01      
  5      0.26515E+03            0.48580E-01      
  6      0.92480E+02            0.72246E-01      
  7      0.23432E+02           -0.14921E+00      
  8      0.98372E+01           -0.38082E+00      
  9      0.27655E+01            0.32539E+00      
 10      0.11044E+01            0.50000E+00      
 11      0.16880E+00            0.31142E-01      
S   11
  1      0.84924E+05           -0.39628E-04      
  2      0.12749E+05           -0.30449E-03      
  3      0.29017E+04           -0.15749E-02      
  4      0.82002E+03           -0.60196E-02      
  5      0.26515E+03           -0.17485E-01      
  6      0.92480E+02           -0.26271E-01      
  7      0.23432E+02            0.56353E-01      
  8      0.98372E+01            0.15112E+00      
  9      0.27655E+01           -0.16061E+00      
 10      0.11044E+01           -0.37418E+00      
 11      0.16880E+00            0.50000E+00      
S   1
  1      0.59341E-01            1.0000000        
P   8
  1      0.14204E+04            0.47199E-02      
  2      0.33535E+03            0.37579E-01      
  3      0.10702E+03            0.16387E+00      
  4      0.39460E+02            0.41416E+00      
  5      0.15581E+02            0.50000E+00      
  6      0.61606E+01            0.17172E+00      
  7      0.23825E+01           -0.17461E-02      
  8      0.82706E+00            0.19509E-02      
P   8
  1      0.14204E+04           -0.13190E-02      
  2      0.33535E+03           -0.10600E-01      
  3      0.10702E+03           -0.48207E-01      
  4      0.39460E+02           -0.12977E+00      
  5      0.15581E+02           -0.16094E+00      
  6      0.61606E+01            0.12707E+00      
  7      0.23825E+01            0.50000E+00      
  8      0.82706E+00            0.29581E+00      
P   1
  1      0.16500E+00            1.0000000        
D   5
  1      0.71754E+02            0.16731E-01      
  2      0.20656E+02            0.10506E+00      
  3      0.71983E+01            0.31711E+00      
  4      0.26637E+01            0.50000E+00      
  5      0.92414E+00            0.48492E+00      
D   1
  1      0.27627E+00            1.0000000        
F   1
  1      1.815000E+00           1.0000000


name: pc-1
description: N/A
elt: Cu
data:
COPPER
S   11
  1      0.91409E+05            0.16300E-02      
  2      0.13723E+05            0.12525E-01      
  3      0.31233E+04            0.62490E-01      
  4      0.88266E+03            0.22278E+00      
  5      0.28546E+03            0.50000E+00      
  6      0.99624E+02            0.48248E+00      
  7      0.25346E+02            0.69085E-01      
  8      0.10671E+02           -0.22486E-01      
  9      0.30093E+01            0.80622E-02      
 10      0.11957E+01           -0.35853E-02      
 11      0.17913E+00            0.90153E-03      
S   11
  1      0.91409E+05           -0.30554E-03      
  2      0.13723E+05           -0.23416E-02      
  3      0.31233E+04           -0.12110E-01      
  4      0.88266E+03           -0.45677E-01      
  5      0.28546E+03           -0.12984E+00      
  6      0.99624E+02           -0.17951E+00      
  7      0.25346E+02            0.26606E+00      
  8      0.10671E+02            0.50000E+00      
  9      0.30093E+01            0.66289E-01      
 10      0.11957E+01           -0.14265E-01      
 11      0.17913E+00            0.29219E-02      
S   11
  1      0.91409E+05            0.11114E-03      
  2      0.13723E+05            0.85377E-03      
  3      0.31233E+04            0.44167E-02      
  4      0.88266E+03            0.16872E-01      
  5      0.28546E+03            0.48976E-01      
  6      0.99624E+02            0.73167E-01      
  7      0.25346E+02           -0.15052E+00      
  8      0.10671E+02           -0.38278E+00      
  9      0.30093E+01            0.32868E+00      
 10      0.11957E+01            0.50000E+00      
 11      0.17913E+00            0.30391E-01      
S   11
  1      0.91409E+05           -0.39027E-04      
  2      0.13723E+05           -0.29994E-03      
  3      0.31233E+04           -0.15514E-02      
  4      0.88266E+03           -0.59371E-02      
  5      0.28546E+03           -0.17269E-01      
  6      0.99624E+02           -0.26065E-01      
  7      0.25346E+02            0.55702E-01      
  8      0.10671E+02            0.14871E+00      
  9      0.30093E+01           -0.15845E+00      
 10      0.11957E+01           -0.36637E+00      
 11      0.17913E+00            0.50000E+00      
S   1
  1      0.62125E-01            1.0000000        
P   8
  1      0.15362E+04            0.46971E-02      
  2      0.36275E+03            0.37447E-01      
  3      0.11583E+03            0.16374E+00      
  4      0.42750E+02            0.41477E+00      
  5      0.16905E+02            0.50000E+00      
  6      0.66911E+01            0.17032E+00      
  7      0.25902E+01           -0.19212E-02      
  8      0.89956E+00            0.19650E-02      
P   8
  1      0.15362E+04           -0.13200E-02      
  2      0.36275E+03           -0.10626E-01      
  3      0.11583E+03           -0.48461E-01      
  4      0.42750E+02           -0.13090E+00      
  5      0.16905E+02           -0.16170E+00      
  6      0.66911E+01            0.13087E+00      
  7      0.25902E+01            0.50000E+00      
  8      0.89956E+00            0.29368E+00      
P   1
  1      0.18000E+00            1.0000000        
D   5
  1      0.78275E+02            0.16924E-01      
  2      0.22581E+02            0.10654E+00      
  3      0.78947E+01            0.31999E+00      
  4      0.29232E+01            0.50000E+00      
  5      0.10128E+01            0.48091E+00      
D   1
  1      0.30110E+00            1.0000000        
F   1
  1      1.997000E+00           1.0000000


name: pc-1
description: N/A
elt: Zn
data:
ZINC
S   11
  1      0.98135E+05            0.16259E-02      
  2      0.14732E+05            0.12494E-01      
  3      0.33530E+04            0.62354E-01      
  4      0.94758E+03            0.22246E+00      
  5      0.30650E+03            0.50000E+00      
  6      0.10703E+03            0.48373E+00      
  7      0.27325E+02            0.69671E-01      
  8      0.11533E+02           -0.22586E-01      
  9      0.32584E+01            0.80172E-02      
 10      0.12881E+01           -0.35255E-02      
 11      0.18909E+00            0.87137E-03      
S   11
  1      0.98135E+05           -0.30532E-03      
  2      0.14732E+05           -0.23401E-02      
  3      0.33530E+04           -0.12105E-01      
  4      0.94758E+03           -0.45695E-01      
  5      0.30650E+03           -0.13008E+00      
  6      0.10703E+03           -0.18033E+00      
  7      0.27325E+02            0.26558E+00      
  8      0.11533E+02            0.50000E+00      
  9      0.32584E+01            0.65841E-01      
 10      0.12881E+01           -0.13986E-01      
 11      0.18909E+00            0.28200E-02      
S   11
  1      0.98135E+05            0.11176E-03      
  2      0.14732E+05            0.85878E-03      
  3      0.33530E+04            0.44428E-02      
  4      0.94758E+03            0.16992E-01      
  5      0.30650E+03            0.49386E-01      
  6      0.10703E+03            0.74083E-01      
  7      0.27325E+02           -0.15204E+00      
  8      0.11533E+02           -0.38467E+00      
  9      0.32584E+01            0.33273E+00      
 10      0.12881E+01            0.50000E+00      
 11      0.18909E+00            0.29673E-01      
S   11
  1      0.98135E+05           -0.38485E-04      
  2      0.14732E+05           -0.29585E-03      
  3      0.33530E+04           -0.15302E-02      
  4      0.94758E+03           -0.58632E-02      
  5      0.30650E+03           -0.17076E-01      
  6      0.10703E+03           -0.25880E-01      
  7      0.27325E+02            0.55185E-01      
  8      0.11533E+02            0.14643E+00      
  9      0.32584E+01           -0.15675E+00      
 10      0.12881E+01           -0.35909E+00      
 11      0.18909E+00            0.50000E+00      
S   1
  1      0.64711E-01            1.0000000        
P   8
  1      0.16561E+04            0.46784E-02      
  2      0.39114E+03            0.37340E-01      
  3      0.12496E+03            0.16366E+00      
  4      0.46161E+02            0.41541E+00      
  5      0.18279E+02            0.50000E+00      
  6      0.72405E+01            0.16895E+00      
  7      0.28042E+01           -0.20832E-02      
  8      0.97365E+00            0.19749E-02      
P   8
  1      0.16561E+04           -0.13210E-02      
  2      0.39114E+03           -0.10651E-01      
  3      0.12496E+03           -0.48692E-01      
  4      0.46161E+02           -0.13192E+00      
  5      0.18279E+02           -0.16230E+00      
  6      0.72405E+01            0.13446E+00      
  7      0.28042E+01            0.50000E+00      
  8      0.97365E+00            0.29197E+00      
P   1
  1      0.19500E+00            1.0000000        
D   5
  1      0.85370E+02            0.16998E-01      
  2      0.24679E+02            0.10737E+00      
  3      0.86558E+01            0.32179E+00      
  4      0.32094E+01            0.50000E+00      
  5      0.11121E+01            0.47833E+00      
D   1
  1      0.32984E+00            1.0000000        
F   1
  1      2.196000E+00           1.0000000


name: pc-4
description: N/A
elt: H
data:
HYDROGEN
S   5
  1      0.307970E+04           0.234730E-03     
  2      0.461520E+03           0.182450E-02     
  3      0.105060E+03           0.959330E-02     
  4      0.297640E+02           0.404610E-01     
  5      0.971830E+01           0.146070E+00     
S   1
  1      0.351790E+01           1.0000000        
S   1
  1      0.137700E+01           1.0000000        
S   1
  1      0.568310E+00           1.0000000        
S   1
  1      0.243410E+00           1.0000000        
S   1
  1      0.105050E+00           1.0000000        
S   1
  1      0.441980E-01           1.0000000        
P   1
  1      0.300000E+02           1.0000000        
P   1
  1      0.660000E+01           1.0000000        
P   1
  1      0.210000E+01           1.0000000        
P   1
  1      0.950000E+00           1.0000000        
P   1
  1      0.450000E+00           1.0000000        
P   1
  1      0.150000E+00           1.0000000        
D   1
  1      0.210000E+01           1.0000000        
D   1
  1      0.700000E+00           1.0000000        
D   1
  1      0.300000E+00           1.0000000        
F   1
  1      0.250000E+01           1.0000000        
F   1
  1      0.900000E+00           1.0000000        
G   1
  1      0.320000E+01           1.0000000


name: pc-4
description: N/A
elt: He
data:
HELIUM
S   5
  1      0.878020E+04           0.146640E-02     
  2      0.131560E+04           0.113950E-01     
  3      0.299460E+03           0.598190E-01     
  4      0.848330E+02           0.250890E+00     
  5      0.276910E+02           0.891350E+00     
S   1
  1      0.100080E+02           1.0000000        
S   1
  1      0.389240E+01           1.0000000        
S   1
  1      0.158190E+01           1.0000000        
S   1
  1      0.656980E+00           1.0000000        
S   1
  1      0.264590E+00           1.0000000        
S   1
  1      0.105850E+00           1.0000000        
P   1
  1      0.405000E+02           1.0000000        
P   1
  1      0.890000E+01           1.0000000        
P   1
  1      0.285000E+01           1.0000000        
P   1
  1      0.130000E+01           1.0000000        
P   1
  1      0.600000E+00           1.0000000        
P   1
  1      0.200000E+00           1.0000000        
D   1
  1      0.370000E+01           1.0000000        
D   1
  1      0.120000E+01           1.0000000        
D   1
  1      0.500000E+00           1.0000000        
F   1
  1      0.410000E+01           1.0000000        
F   1
  1      0.150000E+01           1.0000000        
G   1
  1      0.465000E+01           1.0000000


name: pc-4
description: N/A
elt: Li
data:
LITHIUM
S   12
  1      0.706810E+05           0.543830E-05     
  2      0.135940E+05           0.332770E-04     
  3      0.310040E+04           0.191750E-03     
  4      0.826460E+03           0.896860E-03     
  5      0.253760E+03           0.344770E-02     
  6      0.884510E+02           0.114350E-01     
  7      0.344930E+02           0.309570E-01     
  8      0.148310E+02           0.732370E-01     
  9      0.692990E+01           0.126680E+00     
 10      0.346780E+01           0.214230E+00     
 11      0.183160E+01           0.178570E+00     
 12      0.100630E+01           0.284920E+00     
S   12
  1      0.135940E+05          -0.113820E-06     
  2      0.310040E+04           0.171230E-06     
  3      0.826460E+03          -0.357470E-05     
  4      0.253760E+03           0.859400E-05     
  5      0.884510E+02          -0.555670E-04     
  6      0.344930E+02           0.282130E-03     
  7      0.148310E+02          -0.455940E-03     
  8      0.692990E+01           0.524910E-02     
  9      0.346780E+01          -0.487050E-02     
 10      0.183160E+01           0.468310E-01     
 11      0.100630E+01          -0.322820E-01     
 12      0.566780E+00           0.102960E+00     
S   1
  1      0.322540E+00           1.0000000        
S   1
  1      0.182770E+00           1.0000000        
S   1
  1      0.101640E+00           1.0000000        
S   1
  1      0.546660E-01           1.0000000        
S   1
  1      0.280250E-01           1.0000000        
S   1
  1      0.134970E-01           1.0000000        
P   1
  1      0.285000E+02           1.0000000        
P   1
  1      0.664000E+01           1.0000000        
P   1
  1      0.192000E+01           1.0000000        
P   1
  1      0.770000E+00           1.0000000        
P   1
  1      0.320000E+00           1.0000000        
P   1
  1      0.150000E+00           1.0000000        
P   1
  1      0.660000E-01           1.0000000        
P   1
  1      0.250000E-01           1.0000000        
D   1
  1      0.175000E+01           1.0000000        
D   1
  1      0.300000E+00           1.0000000        
D   1
  1      0.110000E+00           1.0000000        
F   1
  1      0.500000E+00           1.0000000        
F   1
  1      0.200000E+00           1.0000000        
G   1
  1      0.550000E+00           1.0000000


name: pc-4
description: N/A
elt: Be
data:
BERYLLIUM
S   12
  1      0.139330E+06           0.243820E-05     
  2      0.267740E+05           0.149380E-04     
  3      0.611200E+04           0.858010E-04     
  4      0.163290E+04           0.400220E-03     
  5      0.503030E+03           0.152890E-02     
  6      0.176030E+03           0.505860E-02     
  7      0.689390E+02           0.136440E-01     
  8      0.297680E+02           0.327300E-01     
  9      0.139630E+02           0.575460E-01     
 10      0.700900E+01           0.100670E+00     
 11      0.370940E+01           0.863480E-01     
 12      0.203920E+01           0.126530E+00     
S   12
  1      0.267740E+05          -0.396870E-06     
  2      0.611200E+04           0.601210E-06     
  3      0.163290E+04          -0.122410E-04     
  4      0.503030E+03           0.323520E-04     
  5      0.176030E+03          -0.170060E-03     
  6      0.689390E+02           0.113620E-02     
  7      0.297680E+02          -0.641920E-03     
  8      0.139630E+02           0.215900E-01     
  9      0.700900E+01           0.425610E-03     
 10      0.370940E+01           0.181490E+00     
 11      0.203920E+01           0.123520E-01     
 12      0.114720E+01           0.384750E+00     
S   1
  1      0.650700E+00           1.0000000        
S   1
  1      0.366590E+00           1.0000000        
S   1
  1      0.202110E+00           1.0000000        
S   1
  1      0.107420E+00           1.0000000        
S   1
  1      0.542310E-01           1.0000000        
S   1
  1      0.256190E-01           1.0000000        
P   1
  1      0.457000E+02           1.0000000        
P   1
  1      0.106000E+02           1.0000000        
P   1
  1      0.308000E+01           1.0000000        
P   1
  1      0.123000E+01           1.0000000        
P   1
  1      0.510000E+00           1.0000000        
P   1
  1      0.230000E+00           1.0000000        
P   1
  1      0.106000E+00           1.0000000        
P   1
  1      0.400000E-01           1.0000000        
D   1
  1      0.335000E+01           1.0000000        
D   1
  1      0.570000E+00           1.0000000        
D   1
  1      0.210000E+00           1.0000000        
F   1
  1      0.750000E+00           1.0000000        
F   1
  1      0.300000E+00           1.0000000        
G   1
  1      0.800000E+00           1.0000000


name: pc-4
description: N/A
elt: B
data:
BORON
S   11
  1      0.742500E+06           0.121880E-05     
  2      0.110930E+06           0.943530E-05     
  3      0.252030E+05           0.502810E-04     
  4      0.712930E+04           0.209620E-03     
  5      0.232470E+04           0.777390E-03     
  6      0.839050E+03           0.247190E-02     
  7      0.327790E+03           0.746650E-02     
  8      0.136720E+03           0.190950E-01     
  9      0.602940E+02           0.467060E-01     
 10      0.277310E+02           0.850150E-01     
 11      0.129920E+02           0.142970E+00     
S   9
  1      0.712930E+04           0.231100E-05     
  2      0.232470E+04          -0.366080E-05     
  3      0.839050E+03           0.494850E-04     
  4      0.327790E+03           0.194280E-04     
  5      0.136720E+03           0.110270E-02     
  6      0.602940E+02           0.268300E-02     
  7      0.277310E+02           0.221860E-01     
  8      0.129920E+02           0.608450E-01     
  9      0.625510E+01           0.281140E+00     
S   1
  1      0.314720E+01           1.0000000        
S   1
  1      0.156270E+01           1.0000000        
S   1
  1      0.740660E+00           1.0000000        
S   1
  1      0.312900E+00           1.0000000        
S   1
  1      0.131420E+00           1.0000000        
S   1
  1      0.547070E-01           1.0000000        
P   5
  1      0.227840E+03           0.112430E-02     
  2      0.539220E+02           0.973930E-02     
  3      0.170480E+02           0.545360E-01     
  4      0.600200E+01           0.231710E+00     
  5      0.260660E+01           0.499310E+00     
P   1
  1      0.119620E+01           1.0000000        
P   1
  1      0.569670E+00           1.0000000        
P   1
  1      0.273770E+00           1.0000000        
P   1
  1      0.128800E+00           1.0000000        
P   1
  1      0.596530E-01           1.0000000        
P   1
  1      0.261900E-01           1.0000000        
D   1
  1      0.530000E+01           1.0000000        
D   1
  1      0.190000E+01           1.0000000        
D   1
  1      0.750000E+00           1.0000000        
D   1
  1      0.350000E+00           1.0000000        
D   1
  1      0.160000E+00           1.0000000        
D   1
  1      0.600000E-01           1.0000000        
F   1
  1      0.190000E+01           1.0000000        
F   1
  1      0.800000E+00           1.0000000        
F   1
  1      0.350000E+00           1.0000000        
G   1
  1      0.165000E+01           1.0000000        
G   1
  1      0.700000E+00           1.0000000        
H   1
  1      0.175000E+01           1.0000000


name: pc-4
description: N/A
elt: C
data:
CARBON
S   11
  1      0.527780E+06           0.296620E-05     
  2      0.791050E+05           0.231550E-04     
  3      0.180060E+05           0.120890E-03     
  4      0.510080E+04           0.514900E-03     
  5      0.166470E+04           0.184580E-02     
  6      0.601660E+03           0.602860E-02     
  7      0.235400E+03           0.170230E-01     
  8      0.982630E+02           0.440770E-01     
  9      0.432690E+02           0.890610E-01     
 10      0.198580E+02           0.148170E+00     
 11      0.956920E+01           0.614360E-01     
S   10
  1      0.180060E+05           0.356630E-06     
  2      0.510080E+04          -0.358770E-05     
  3      0.166470E+04           0.180860E-04     
  4      0.601660E+03           0.124610E-05     
  5      0.235400E+03           0.710750E-03     
  6      0.982630E+02           0.253460E-02     
  7      0.432690E+02           0.199340E-01     
  8      0.198580E+02           0.650470E-01     
  9      0.956920E+01           0.270000E+00     
 10      0.493730E+01           0.328540E+00     
S   1
  1      0.266870E+01           1.0000000        
S   1
  1      0.146740E+01           1.0000000        
S   1
  1      0.638630E+00           1.0000000        
S   1
  1      0.302400E+00           1.0000000        
S   1
  1      0.141160E+00           1.0000000        
S   1
  1      0.637490E-01           1.0000000        
P   5
  1      0.382210E+03           0.984840E-03     
  2      0.904890E+02           0.858470E-02     
  3      0.288710E+02           0.482720E-01     
  4      0.103850E+02           0.204540E+00     
  5      0.449720E+01           0.498670E+00     
P   1
  1      0.202740E+01           1.0000000        
P   1
  1      0.951540E+00           1.0000000        
P   1
  1      0.448150E+00           1.0000000        
P   1
  1      0.207210E+00           1.0000000        
P   1
  1      0.948700E-01           1.0000000        
P   1
  1      0.408430E-01           1.0000000        
D   1
  1      0.840000E+01           1.0000000        
D   1
  1      0.300000E+01           1.0000000        
D   1
  1      0.120000E+01           1.0000000        
D   1
  1      0.550000E+00           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
D   1
  1      0.100000E+00           1.0000000        
F   1
  1      0.210000E+01           1.0000000        
F   1
  1      0.900000E+00           1.0000000        
F   1
  1      0.400000E+00           1.0000000        
G   1
  1      0.210000E+01           1.0000000        
G   1
  1      0.900000E+00           1.0000000        
H   1
  1      0.185000E+01           1.0000000


name: pc-4
description: N/A
elt: N
data:
NITROGEN
S   11
  1      0.894760E+06           0.226320E-05     
  2      0.134830E+06           0.175410E-04     
  3      0.308080E+05           0.911680E-04     
  4      0.875150E+04           0.387400E-03     
  5      0.286200E+04           0.138700E-02     
  6      0.103530E+04           0.455030E-02     
  7      0.404730E+03           0.130090E-01     
  8      0.168330E+03           0.346960E-01     
  9      0.736950E+02           0.748040E-01     
 10      0.337530E+02           0.134570E+00     
 11      0.161570E+02           0.116720E+00     
S   9
  1      0.875150E+04          -0.321300E-05     
  2      0.286200E+04           0.137030E-04     
  3      0.103530E+04          -0.148620E-04     
  4      0.404730E+03           0.481020E-03     
  5      0.168330E+03           0.153840E-02     
  6      0.736950E+02           0.135550E-01     
  7      0.337530E+02           0.473110E-01     
  8      0.161570E+02           0.201600E+00     
  9      0.796880E+01           0.407130E+00     
S   1
  1      0.395210E+01           1.0000000        
S   1
  1      0.194540E+01           1.0000000        
S   1
  1      0.929290E+00           1.0000000        
S   1
  1      0.440850E+00           1.0000000        
S   1
  1      0.203400E+00           1.0000000        
S   1
  1      0.912260E-01           1.0000000        
P   5
  1      0.566230E+03           0.924330E-03     
  2      0.134100E+03           0.808980E-02     
  3      0.430130E+02           0.454630E-01     
  4      0.156120E+02           0.196220E+00     
  5      0.664270E+01           0.517540E+00     
P   1
  1      0.297480E+01           1.0000000        
P   1
  1      0.138850E+01           1.0000000        
P   1
  1      0.650120E+00           1.0000000        
P   1
  1      0.300280E+00           1.0000000        
P   1
  1      0.136200E+00           1.0000000        
P   1
  1      0.578450E-01           1.0000000        
D   1
  1      0.128000E+02           1.0000000        
D   1
  1      0.440000E+01           1.0000000        
D   1
  1      0.175000E+01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
D   1
  1      0.370000E+00           1.0000000        
D   1
  1      0.150000E+00           1.0000000        
F   1
  1      0.230000E+01           1.0000000        
F   1
  1      0.100000E+01           1.0000000        
F   1
  1      0.450000E+00           1.0000000        
G   1
  1      0.255000E+01           1.0000000        
G   1
  1      0.110000E+01           1.0000000        
H   1
  1      0.195000E+01           1.0000000


name: pc-4
description: N/A
elt: O
data:
OXYGEN
S   11
  1      0.125970E+07           0.206840E-05     
  2      0.190110E+06           0.159600E-04     
  3      0.434490E+05           0.833280E-04     
  4      0.123420E+05           0.352120E-03     
  5      0.403500E+04           0.127090E-02     
  6      0.145970E+04           0.413240E-02     
  7      0.570660E+03           0.119700E-01     
  8      0.237500E+03           0.315610E-01     
  9      0.104110E+03           0.699600E-01     
 10      0.475810E+02           0.127020E+00     
 11      0.225460E+02           0.118990E+00     
S   9
  1      0.123420E+05          -0.880840E-06     
  2      0.403500E+04           0.749180E-05     
  3      0.145970E+04           0.189250E-04     
  4      0.570660E+03           0.351660E-03     
  5      0.237500E+03           0.170470E-02     
  6      0.104110E+03           0.114120E-01     
  7      0.475810E+02           0.460250E-01     
  8      0.225460E+02           0.191400E+00     
  9      0.110930E+02           0.402600E+00     
S   1
  1      0.554090E+01           1.0000000        
S   1
  1      0.277940E+01           1.0000000        
S   1
  1      0.128370E+01           1.0000000        
S   1
  1      0.596490E+00           1.0000000        
S   1
  1      0.270570E+00           1.0000000        
S   1
  1      0.120280E+00           1.0000000        
P   5
  1      0.708610E+03           0.104560E-02     
  2      0.167860E+03           0.912920E-02     
  3      0.539670E+02           0.509770E-01     
  4      0.198070E+02           0.215990E+00     
  5      0.838320E+01           0.587770E+00     
P   1
  1      0.374470E+01           1.0000000        
P   1
  1      0.173220E+01           1.0000000        
P   1
  1      0.799770E+00           1.0000000        
P   1
  1      0.363230E+00           1.0000000        
P   1
  1      0.159630E+00           1.0000000        
P   1
  1      0.656640E-01           1.0000000        
D   1
  1      0.182000E+02           1.0000000        
D   1
  1      0.600000E+01           1.0000000        
D   1
  1      0.240000E+01           1.0000000        
D   1
  1      0.110000E+01           1.0000000        
D   1
  1      0.500000E+00           1.0000000        
D   1
  1      0.200000E+00           1.0000000        
F   1
  1      0.260000E+01           1.0000000        
F   1
  1      0.115000E+01           1.0000000        
F   1
  1      0.500000E+00           1.0000000        
G   1
  1      0.305000E+01           1.0000000        
G   1
  1      0.130000E+01           1.0000000        
H   1
  1      0.205000E+01           1.0000000


name: pc-4
description: N/A
elt: F
data:
FLUORINE
S   11
  1      0.185600E+07           0.171720E-05     
  2      0.280070E+06           0.132440E-04     
  3      0.640780E+05           0.690150E-04     
  4      0.182160E+05           0.291620E-03     
  5      0.595780E+04           0.105220E-02     
  6      0.215500E+04           0.343010E-02     
  7      0.841960E+03           0.997250E-02     
  8      0.349820E+03           0.266250E-01     
  9      0.152790E+03           0.603970E-01     
 10      0.693670E+02           0.114680E+00     
 11      0.325740E+02           0.114870E+00     
S   9
  1      0.182160E+05          -0.809130E-06     
  2      0.595780E+04           0.584830E-05     
  3      0.215500E+04           0.111810E-04     
  4      0.841960E+03           0.264520E-03     
  5      0.349820E+03           0.124470E-02     
  6      0.152790E+03           0.880460E-02     
  7      0.693670E+02           0.366660E-01     
  8      0.325740E+02           0.162120E+00     
  9      0.158890E+02           0.374030E+00     
S   1
  1      0.786510E+01           1.0000000        
S   1
  1      0.391990E+01           1.0000000        
S   1
  1      0.178610E+01           1.0000000        
S   1
  1      0.820650E+00           1.0000000        
S   1
  1      0.369370E+00           1.0000000        
S   1
  1      0.161980E+00           1.0000000        
P   5
  1      0.917890E+03           0.104500E-02     
  2      0.217410E+03           0.914290E-02     
  3      0.699390E+02           0.512270E-01     
  4      0.258310E+02           0.215580E+00     
  5      0.109690E+02           0.596600E+00     
P   1
  1      0.492150E+01           1.0000000        
P   1
  1      0.228390E+01           1.0000000        
P   1
  1      0.105790E+01           1.0000000        
P   1
  1      0.481350E+00           1.0000000        
P   1
  1      0.209020E+00           1.0000000        
P   1
  1      0.855560E-01           1.0000000        
D   1
  1      0.255000E+02           1.0000000        
D   1
  1      0.800000E+01           1.0000000        
D   1
  1      0.320000E+01           1.0000000        
D   1
  1      0.145000E+01           1.0000000        
D   1
  1      0.650000E+00           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
F   1
  1      0.310000E+01           1.0000000        
F   1
  1      0.135000E+01           1.0000000        
F   1
  1      0.600000E+00           1.0000000        
G   1
  1      0.360000E+01           1.0000000        
G   1
  1      0.155000E+01           1.0000000        
H   1
  1      0.215000E+01           1.0000000


name: pc-4
description: N/A
elt: Ne
data:
NEON
S   11
  1      0.252260E+07           0.766530E-05     
  2      0.377060E+06           0.598260E-04     
  3      0.857130E+05           0.314410E-03     
  4      0.242610E+05           0.133260E-02     
  5      0.791170E+04           0.483320E-02     
  6      0.285550E+04           0.157630E-01     
  7      0.111360E+04           0.461230E-01     
  8      0.461890E+03           0.123390E+00     
  9      0.201350E+03           0.284280E+00     
 10      0.911980E+02           0.545690E+00     
 11      0.426800E+02           0.581410E+00     
S   9
  1      0.242610E+05          -0.203210E-06     
  2      0.791170E+04           0.212160E-05     
  3      0.285550E+04           0.758350E-05     
  4      0.111360E+04           0.110550E-03     
  5      0.461890E+03           0.582830E-03     
  6      0.201350E+03           0.387530E-02     
  7      0.911980E+02           0.170860E-01     
  8      0.426800E+02           0.749780E-01     
  9      0.207420E+02           0.183910E+00     
S   1
  1      0.102490E+02           1.0000000        
S   1
  1      0.510130E+01           1.0000000        
S   1
  1      0.230310E+01           1.0000000        
S   1
  1      0.105310E+01           1.0000000        
S   1
  1      0.472220E+00           1.0000000        
S   1
  1      0.204660E+00           1.0000000        
P   5
  1      0.116990E+04           0.510640E-03     
  2      0.277110E+03           0.447380E-02     
  3      0.892640E+02           0.251100E-01     
  4      0.331000E+02           0.105930E+00     
  5      0.140310E+02           0.299580E+00     
P   1
  1      0.629850E+01           1.0000000        
P   1
  1      0.292340E+01           1.0000000        
P   1
  1      0.135370E+01           1.0000000        
P   1
  1      0.613620E+00           1.0000000        
P   1
  1      0.263620E+00           1.0000000        
P   1
  1      0.107550E+00           1.0000000        
D   1
  1      0.320000E+02           1.0000000        
D   1
  1      0.101000E+02           1.0000000        
D   1
  1      0.400000E+01           1.0000000        
D   1
  1      0.185000E+01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
D   1
  1      0.300000E+00           1.0000000        
F   1
  1      0.360000E+01           1.0000000        
F   1
  1      0.155000E+01           1.0000000        
F   1
  1      0.700000E+00           1.0000000        
G   1
  1      0.420000E+01           1.0000000        
G   1
  1      0.180000E+01           1.0000000        
H   1
  1      0.225000E+01           1.0000000


name: pc-4
description: N/A
elt: Na
data:
SODIUM
S   15
  1      0.191870E+07           0.274290E-05     
  2      0.287270E+06           0.213320E-04     
  3      0.653820E+05           0.112210E-03     
  4      0.185230E+05           0.473690E-03     
  5      0.604540E+04           0.172350E-02     
  6      0.218420E+04           0.559140E-02     
  7      0.853110E+03           0.164610E-01     
  8      0.354690E+03           0.437760E-01     
  9      0.155330E+03           0.102660E+00     
 10      0.712340E+02           0.200740E+00     
 11      0.338350E+02           0.309520E+00     
 12      0.163490E+02           0.308260E+00     
 13      0.800820E+01           0.148550E+00     
 14      0.367130E+01           0.171130E-01     
 15      0.171180E+01          -0.155410E-02     
S   11
  1      0.218420E+04          -0.179020E-04     
  2      0.853110E+03          -0.649780E-04     
  3      0.354690E+03          -0.609090E-03     
  4      0.155330E+03          -0.260940E-02     
  5      0.712340E+02          -0.132950E-01     
  6      0.338350E+02          -0.398670E-01     
  7      0.163490E+02          -0.961080E-01     
  8      0.800820E+01          -0.704790E-01     
  9      0.367130E+01           0.245650E+00     
 10      0.171180E+01           0.553620E+00     
 11      0.791470E+00           0.458690E+00     
S   13
  1      0.604540E+04          -0.144460E-05     
  2      0.218420E+04          -0.130570E-04     
  3      0.853110E+03          -0.974170E-04     
  4      0.354690E+03          -0.637870E-03     
  5      0.155330E+03          -0.333940E-02     
  6      0.712340E+02          -0.151450E-01     
  7      0.338350E+02          -0.490790E-01     
  8      0.163490E+02          -0.108650E+00     
  9      0.800820E+01          -0.885270E-01     
 10      0.367130E+01           0.293660E+00     
 11      0.171180E+01           0.479150E+00     
 12      0.791470E+00           0.156800E+00     
 13      0.354790E+00          -0.578530E+00     
S   1
  1      0.906640E-01           1.0000000        
S   1
  1      0.443130E-01           1.0000000        
S   1
  1      0.219480E-01           1.0000000        
S   1
  1      0.108210E-01           1.0000000        
P   11
  1      0.304420E+04           0.293550E-04     
  2      0.720020E+03           0.261000E-03     
  3      0.234420E+03           0.148190E-02     
  4      0.896660E+02           0.648150E-02     
  5      0.366950E+02           0.248030E-01     
  6      0.162560E+02           0.659540E-01     
  7      0.765930E+01           0.147940E+00     
  8      0.371250E+01           0.244000E+00     
  9      0.179920E+01           0.302440E+00     
 10      0.862880E+00           0.275570E+00     
 11      0.401040E+00           0.162190E+00     
P   1
  1      0.177590E+00           1.0000000        
P   1
  1      0.807000E-01           1.0000000        
P   1
  1      0.367000E-01           1.0000000        
P   1
  1      0.167000E-01           1.0000000        
D   1
  1      0.235000E+01           1.0000000        
D   1
  1      0.560000E+00           1.0000000        
D   1
  1      0.140000E+00           1.0000000        
F   1
  1      0.108000E+01           1.0000000        
F   1
  1      0.240000E+00           1.0000000        
G   1
  1      0.300000E+00           1.0000000


name: pc-4
description: N/A
elt: Mg
data:
MAGNESIUM
S   15
  1      0.319910E+07           0.901890E-06     
  2      0.479000E+06           0.701150E-05     
  3      0.109010E+06           0.368920E-04     
  4      0.308780E+05           0.155840E-03     
  5      0.100750E+05           0.567840E-03     
  6      0.363790E+04           0.184930E-02     
  7      0.141950E+04           0.548860E-02     
  8      0.589350E+03           0.148710E-01     
  9      0.257530E+03           0.363150E-01     
 10      0.117170E+03           0.775130E-01     
 11      0.547620E+02           0.135930E+00     
 12      0.262880E+02           0.164900E+00     
 13      0.128600E+02           0.112400E+00     
 14      0.626040E+01           0.265010E-01     
 15      0.285140E+01           0.682220E-04     
S   11
  1      0.363790E+04          -0.336150E-05     
  2      0.141950E+04          -0.111860E-04     
  3      0.589350E+03          -0.111260E-03     
  4      0.257530E+03          -0.500000E-03     
  5      0.117170E+03          -0.266410E-02     
  6      0.547620E+02          -0.983480E-02     
  7      0.262880E+02          -0.259640E-01     
  8      0.128600E+02          -0.398890E-01     
  9      0.626040E+01           0.292860E-01     
 10      0.285140E+01           0.167000E+00     
 11      0.130580E+01           0.156890E+00     
S   11
  1      0.141950E+04           0.138720E-05     
  2      0.589350E+03           0.109740E-04     
  3      0.257530E+03           0.563830E-04     
  4      0.117170E+03           0.260100E-03     
  5      0.547620E+02           0.926960E-03     
  6      0.262880E+02           0.140020E-02     
  7      0.128600E+02           0.210320E-03     
  8      0.626040E+01          -0.139360E-02     
  9      0.285140E+01           0.633850E-01     
 10      0.130580E+01           0.351780E+00     
 11      0.583310E+00           0.459800E+00     
S   1
  1      0.168490E+00           1.0000000        
S   1
  1      0.856460E-01           1.0000000        
S   1
  1      0.450770E-01           1.0000000        
S   1
  1      0.219340E-01           1.0000000        
P   11
  1      0.415780E+04           0.123420E-04     
  2      0.984530E+03           0.109780E-03     
  3      0.320090E+03           0.630860E-03     
  4      0.121730E+03           0.283310E-02     
  5      0.498920E+02           0.107730E-01     
  6      0.225420E+02           0.287720E-01     
  7      0.107490E+02           0.665370E-01     
  8      0.528990E+01           0.115570E+00     
  9      0.259960E+01           0.154170E+00     
 10      0.125180E+01           0.146650E+00     
 11      0.592460E+00           0.819040E-01     
P   1
  1      0.269410E+00           1.0000000        
P   1
  1      0.122500E+00           1.0000000        
P   1
  1      0.557000E-01           1.0000000        
P   1
  1      0.253000E-01           1.0000000        
D   1
  1      0.336000E+01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
D   1
  1      0.200000E+00           1.0000000        
F   1
  1      0.135000E+01           1.0000000        
F   1
  1      0.300000E+00           1.0000000        
G   1
  1      0.350000E+00           1.0000000


name: pc-4
description: N/A
elt: Al
data:
ALUMINUM
S   15
  1      0.384520E+07           0.175380E-05     
  2      0.575260E+06           0.136540E-04     
  3      0.130860E+06           0.718690E-04     
  4      0.370630E+05           0.303550E-03     
  5      0.120940E+05           0.110600E-02     
  6      0.436680E+04           0.360350E-02     
  7      0.170360E+04           0.107020E-01     
  8      0.707130E+03           0.290360E-01     
  9      0.308970E+03           0.710450E-01     
 10      0.140710E+03           0.151950E+00     
 11      0.659170E+02           0.267920E+00     
 12      0.317300E+02           0.329140E+00     
 13      0.155870E+02           0.229980E+00     
 14      0.763820E+01           0.574330E-01     
 15      0.354540E+01           0.402600E-03     
S   11
  1      0.436680E+04          -0.113250E-04     
  2      0.170360E+04          -0.600500E-04     
  3      0.707130E+03          -0.463440E-03     
  4      0.308970E+03          -0.237800E-02     
  5      0.140710E+03          -0.118420E-01     
  6      0.659170E+02          -0.456750E-01     
  7      0.317300E+02          -0.118640E+00     
  8      0.155870E+02          -0.190880E+00     
  9      0.763820E+01           0.124210E+00     
 10      0.354540E+01           0.723530E+00     
 11      0.166790E+01           0.756650E+00     
S   13
  1      0.120940E+05          -0.109120E-05     
  2      0.436680E+04          -0.104990E-04     
  3      0.170360E+04          -0.786800E-04     
  4      0.707130E+03          -0.520230E-03     
  5      0.308970E+03          -0.291520E-02     
  6      0.140710E+03          -0.138480E-01     
  7      0.659170E+02          -0.549680E-01     
  8      0.317300E+02          -0.138500E+00     
  9      0.155870E+02          -0.226630E+00     
 10      0.763820E+01           0.154540E+00     
 11      0.354540E+01           0.758440E+00     
 12      0.166790E+01           0.531340E+00     
 13      0.769390E+00          -0.503620E+00     
S   1
  1      0.279170E+00           1.0000000        
S   1
  1      0.140160E+00           1.0000000        
S   1
  1      0.703360E-01           1.0000000        
S   1
  1      0.336600E-01           1.0000000        
P   11
  1      0.568730E+04           0.199820E-04     
  2      0.134520E+04           0.177280E-03     
  3      0.436380E+03           0.103710E-02     
  4      0.165450E+03           0.470060E-02     
  5      0.686190E+02           0.174270E-01     
  6      0.318750E+02           0.466430E-01     
  7      0.154320E+02           0.112240E+00     
  8      0.775700E+01           0.204570E+00     
  9      0.392560E+01           0.298280E+00     
 10      0.197640E+01           0.301420E+00     
 11      0.999180E+00           0.189050E+00     
P   10
  1      0.134520E+04           0.100950E-04     
  2      0.165450E+03           0.228580E-03     
  3      0.686190E+02          -0.265280E-03     
  4      0.318750E+02           0.155100E-02     
  5      0.154320E+02          -0.904470E-02     
  6      0.775700E+01          -0.361670E-02     
  7      0.392560E+01          -0.704860E-01     
  8      0.197640E+01          -0.117160E-01     
  9      0.999180E+00           0.440730E-01     
 10      0.506300E+00           0.553100E+00     
P   1
  1      0.258470E+00           1.0000000        
P   1
  1      0.115660E+00           1.0000000        
P   1
  1      0.510480E-01           1.0000000        
P   1
  1      0.212000E-01           1.0000000        
D   1
  1      0.178100E+02           1.0000000        
D   1
  1      0.509000E+01           1.0000000        
D   1
  1      0.175000E+01           1.0000000        
D   1
  1      0.630000E+00           1.0000000        
D   1
  1      0.270000E+00           1.0000000        
D   1
  1      0.110000E+00           1.0000000        
F   1
  1      0.217000E+01           1.0000000        
F   1
  1      0.510000E+00           1.0000000        
F   1
  1      0.210000E+00           1.0000000        
G   1
  1      0.114000E+01           1.0000000        
G   1
  1      0.380000E+00           1.0000000        
H   1
  1      0.690000E+00           1.0000000


name: pc-4
description: N/A
elt: Si
data:
SILICON
S   15
  1      0.461580E+07           0.165860E-05     
  2      0.719010E+06           0.121340E-04     
  3      0.169990E+06           0.609690E-04     
  4      0.494000E+05           0.251240E-03     
  5      0.163850E+05           0.900880E-03     
  6      0.598540E+04           0.290390E-02     
  7      0.235410E+04           0.858520E-02     
  8      0.981400E+03           0.234210E-01     
  9      0.428900E+03           0.584220E-01     
 10      0.194540E+03           0.129770E+00     
 11      0.907770E+02           0.240370E+00     
 12      0.437150E+02           0.324800E+00     
 13      0.214910E+02           0.266840E+00     
 14      0.106690E+02           0.913240E-01     
 15      0.488820E+01           0.534240E-02     
S   12
  1      0.163850E+05          -0.945940E-06     
  2      0.598540E+04          -0.193880E-05     
  3      0.235410E+04          -0.421750E-04     
  4      0.981400E+03          -0.204690E-03     
  5      0.428900E+03          -0.142610E-02     
  6      0.194540E+03          -0.637950E-02     
  7      0.907770E+02          -0.286640E-01     
  8      0.437150E+02          -0.756950E-01     
  9      0.214910E+02          -0.154730E+00     
 10      0.106690E+02           0.159130E-01     
 11      0.488820E+01           0.463440E+00     
 12      0.233610E+01           0.602180E+00     
S   12
  1      0.598540E+04          -0.381010E-05     
  2      0.235410E+04          -0.289990E-04     
  3      0.981400E+03          -0.188680E-03     
  4      0.428900E+03          -0.109670E-02     
  5      0.194540E+03          -0.533750E-02     
  6      0.907770E+02          -0.227490E-01     
  7      0.437150E+02          -0.629360E-01     
  8      0.214910E+02          -0.125250E+00     
  9      0.106690E+02           0.521670E-02     
 10      0.488820E+01           0.430800E+00     
 11      0.233610E+01           0.718330E+00     
 12      0.109670E+01           0.383600E+00     
S   1
  1      0.423120E+00           1.0000000        
S   1
  1      0.242760E+00           1.0000000        
S   1
  1      0.117030E+00           1.0000000        
S   1
  1      0.528610E-01           1.0000000        
P   11
  1      0.645330E+04           0.216530E-04     
  2      0.153390E+04           0.191620E-03     
  3      0.498380E+03           0.111430E-02     
  4      0.188980E+03           0.508300E-02     
  5      0.778870E+02           0.192690E-01     
  6      0.355140E+02           0.530910E-01     
  7      0.170160E+02           0.126390E+00     
  8      0.849770E+01           0.223120E+00     
  9      0.435440E+01           0.298540E+00     
 10      0.225750E+01           0.286510E+00     
 11      0.115970E+01           0.171680E+00     
P   11
  1      0.153390E+04           0.958440E-06     
  2      0.498380E+03          -0.174750E-06     
  3      0.188980E+03           0.199210E-04     
  4      0.778870E+02          -0.389700E-04     
  5      0.355140E+02           0.633270E-04     
  6      0.170160E+02          -0.140570E-02     
  7      0.849770E+01          -0.120800E-02     
  8      0.435440E+01          -0.113900E-01     
  9      0.225750E+01           0.460790E-02     
 10      0.115970E+01          -0.576880E-03     
 11      0.593430E+00           0.131740E+00     
P   1
  1      0.290120E+00           1.0000000        
P   1
  1      0.138250E+00           1.0000000        
P   1
  1      0.645940E-01           1.0000000        
P   1
  1      0.283540E-01           1.0000000        
D   1
  1      0.195200E+02           1.0000000        
D   1
  1      0.558000E+01           1.0000000        
D   1
  1      0.192000E+01           1.0000000        
D   1
  1      0.690000E+00           1.0000000        
D   1
  1      0.299000E+00           1.0000000        
D   1
  1      0.125000E+00           1.0000000        
F   1
  1      0.264000E+01           1.0000000        
F   1
  1      0.620000E+00           1.0000000        
F   1
  1      0.260000E+00           1.0000000        
G   1
  1      0.135000E+01           1.0000000        
G   1
  1      0.450000E+00           1.0000000        
H   1
  1      0.780000E+00           1.0000000


name: pc-4
description: N/A
elt: P
data:
PHOSPHORUS
S   15
  1      0.526250E+07           0.167230E-05     
  2      0.822130E+06           0.122070E-04     
  3      0.194250E+06           0.614400E-04     
  4      0.564240E+05           0.253220E-03     
  5      0.187160E+05           0.907520E-03     
  6      0.683930E+04           0.292300E-02     
  7      0.269310E+04           0.861380E-02     
  8      0.112650E+04           0.233290E-01     
  9      0.495210E+03           0.576410E-01     
 10      0.226380E+03           0.126940E+00     
 11      0.106620E+03           0.234080E+00     
 12      0.519050E+02           0.318050E+00     
 13      0.258510E+02           0.270020E+00     
 14      0.130220E+02           0.101970E+00     
 15      0.605680E+01           0.808990E-02     
S   12
  1      0.187160E+05          -0.879610E-06     
  2      0.683930E+04          -0.119970E-05     
  3      0.269310E+04          -0.367780E-04     
  4      0.112650E+04          -0.164670E-03     
  5      0.495210E+03          -0.118610E-02     
  6      0.226380E+03          -0.509360E-02     
  7      0.106620E+03          -0.229390E-01     
  8      0.519050E+02          -0.595030E-01     
  9      0.258510E+02          -0.125320E+00     
 10      0.130220E+02          -0.340880E-02     
 11      0.605680E+01           0.334610E+00     
 12      0.295740E+01           0.503800E+00     
S   12
  1      0.683930E+04          -0.485950E-05     
  2      0.269310E+04          -0.378590E-04     
  3      0.112650E+04          -0.240170E-03     
  4      0.495210E+03          -0.138650E-02     
  5      0.226380E+03          -0.661190E-02     
  6      0.106620E+03          -0.278470E-01     
  7      0.519050E+02          -0.765660E-01     
  8      0.258510E+02          -0.155270E+00     
  9      0.130220E+02          -0.171240E-01     
 10      0.605680E+01           0.488420E+00     
 11      0.295740E+01           0.908950E+00     
 12      0.140780E+01           0.536490E+00     
S   1
  1      0.571870E+00           1.0000000        
S   1
  1      0.310780E+00           1.0000000        
S   1
  1      0.149470E+00           1.0000000        
S   1
  1      0.683130E-01           1.0000000        
P   11
  1      0.774860E+04           0.208700E-04     
  2      0.183360E+04           0.185960E-03     
  3      0.595550E+03           0.107990E-02     
  4      0.226610E+03           0.489460E-02     
  5      0.941910E+02           0.183200E-01     
  6      0.433320E+02           0.506690E-01     
  7      0.209070E+02           0.121560E+00     
  8      0.105020E+02           0.219310E+00     
  9      0.542550E+01           0.296400E+00     
 10      0.288180E+01           0.281790E+00     
 11      0.152840E+01           0.178530E+00     
P   11
  1      0.183360E+04           0.817170E-06     
  2      0.595550E+03          -0.284830E-06     
  3      0.226610E+03           0.159730E-04     
  4      0.941910E+02          -0.473960E-04     
  5      0.433320E+02           0.117440E-05     
  6      0.209070E+02          -0.158320E-02     
  7      0.105020E+02          -0.181170E-02     
  8      0.542550E+01          -0.134650E-01     
  9      0.288180E+01           0.615030E-02     
 10      0.152840E+01          -0.714440E-02     
 11      0.810810E+00           0.143150E+00     
P   1
  1      0.390280E+00           1.0000000        
P   1
  1      0.186450E+00           1.0000000        
P   1
  1      0.875670E-01           1.0000000        
P   1
  1      0.386730E-01           1.0000000        
D   1
  1      0.212300E+02           1.0000000        
D   1
  1      0.607000E+01           1.0000000        
D   1
  1      0.209000E+01           1.0000000        
D   1
  1      0.750000E+00           1.0000000        
D   1
  1      0.325000E+00           1.0000000        
D   1
  1      0.135000E+00           1.0000000        
F   1
  1      0.312000E+01           1.0000000        
F   1
  1      0.730000E+00           1.0000000        
F   1
  1      0.300000E+00           1.0000000        
G   1
  1      0.155000E+01           1.0000000        
G   1
  1      0.520000E+00           1.0000000        
H   1
  1      0.870000E+00           1.0000000


name: pc-4
description: N/A
elt: S
data:
SULFUR
S   15
  1      0.635920E+07           0.155750E-05     
  2      0.983890E+06           0.115630E-04     
  3      0.229770E+06           0.590170E-04     
  4      0.662760E+05           0.244740E-03     
  5      0.218840E+05           0.881590E-03     
  6      0.796960E+04           0.284940E-02     
  7      0.312990E+04           0.842730E-02     
  8      0.130520E+04           0.229510E-01     
  9      0.571700E+03           0.570380E-01     
 10      0.260580E+03           0.126160E+00     
 11      0.122480E+03           0.233730E+00     
 12      0.595180E+02           0.318830E+00     
 13      0.296270E+02           0.270980E+00     
 14      0.149430E+02           0.102170E+00     
 15      0.704790E+01           0.813260E-02     
S   12
  1      0.218840E+05          -0.824570E-06     
  2      0.796960E+04          -0.103270E-05     
  3      0.312990E+04          -0.341210E-04     
  4      0.130520E+04          -0.151870E-03     
  5      0.571700E+03          -0.110930E-02     
  6      0.260580E+03          -0.479670E-02     
  7      0.122480E+03          -0.216820E-01     
  8      0.595180E+02          -0.569080E-01     
  9      0.296270E+02          -0.119150E+00     
 10      0.149430E+02          -0.271680E-02     
 11      0.704790E+01           0.303650E+00     
 12      0.350400E+01           0.475880E+00     
S   12
  1      0.796960E+04          -0.281560E-05     
  2      0.312990E+04          -0.210790E-04     
  3      0.130520E+04          -0.137090E-03     
  4      0.571700E+03          -0.789350E-03     
  5      0.260580E+03          -0.382300E-02     
  6      0.122480E+03          -0.160720E-01     
  7      0.595180E+02          -0.449220E-01     
  8      0.296270E+02          -0.901370E-01     
  9      0.149430E+02          -0.106310E-01     
 10      0.704790E+01           0.276870E+00     
 11      0.350400E+01           0.519600E+00     
 12      0.169970E+01           0.309910E+00     
S   1
  1      0.731010E+00           1.0000000        
S   1
  1      0.379480E+00           1.0000000        
S   1
  1      0.181850E+00           1.0000000        
S   1
  1      0.839610E-01           1.0000000        
P   11
  1      0.934140E+04           0.194930E-04     
  2      0.220860E+04           0.174320E-03     
  3      0.716270E+03           0.101610E-02     
  4      0.272510E+03           0.461720E-02     
  5      0.113770E+03           0.171630E-01     
  6      0.525710E+02           0.481320E-01     
  7      0.253970E+02           0.117040E+00     
  8      0.127700E+02           0.216020E+00     
  9      0.662240E+01           0.295280E+00     
 10      0.353880E+01           0.288250E+00     
 11      0.187560E+01           0.179820E+00     
P   11
  1      0.220860E+04           0.610440E-06     
  2      0.716270E+03          -0.337610E-06     
  3      0.272510E+03           0.106260E-04     
  4      0.113770E+03          -0.501760E-04     
  5      0.525710E+02          -0.780470E-04     
  6      0.253970E+02          -0.161880E-02     
  7      0.127700E+02          -0.265510E-02     
  8      0.662240E+01          -0.137770E-01     
  9      0.353880E+01           0.242460E-02     
 10      0.187560E+01           0.585720E-03     
 11      0.990180E+00           0.165180E+00     
P   1
  1      0.477230E+00           1.0000000        
P   1
  1      0.226920E+00           1.0000000        
P   1
  1      0.104730E+00           1.0000000        
P   1
  1      0.453030E-01           1.0000000        
D   1
  1      0.229300E+02           1.0000000        
D   1
  1      0.655000E+01           1.0000000        
D   1
  1      0.226000E+01           1.0000000        
D   1
  1      0.810000E+00           1.0000000        
D   1
  1      0.351000E+00           1.0000000        
D   1
  1      0.146000E+00           1.0000000        
F   1
  1      0.359000E+01           1.0000000        
F   1
  1      0.840000E+00           1.0000000        
F   1
  1      0.350000E+00           1.0000000        
G   1
  1      0.176000E+01           1.0000000        
G   1
  1      0.590000E+00           1.0000000        
H   1
  1      0.950000E+00           1.0000000


name: pc-4
description: N/A
elt: Cl
data:
CHLORINE
S   15
  1      0.742120E+07           0.149920E-05     
  2      0.114110E+07           0.112430E-04     
  3      0.264430E+06           0.580000E-04     
  4      0.757910E+05           0.242150E-03     
  5      0.249250E+05           0.875500E-03     
  6      0.905260E+04           0.283760E-02     
  7      0.354810E+04           0.840860E-02     
  8      0.147800E+04           0.229060E-01     
  9      0.647350E+03           0.568950E-01     
 10      0.295330E+03           0.125690E+00     
 11      0.138980E+03           0.233270E+00     
 12      0.675490E+02           0.318940E+00     
 13      0.336610E+02           0.271170E+00     
 14      0.170270E+02           0.102470E+00     
 15      0.815040E+01           0.830670E-02     
S   12
  1      0.249250E+05          -0.133580E-05     
  2      0.905260E+04          -0.184400E-05     
  3      0.354810E+04          -0.581690E-04     
  4      0.147800E+04          -0.266340E-03     
  5      0.647350E+03          -0.191720E-02     
  6      0.295330E+03          -0.835970E-02     
  7      0.138980E+03          -0.375020E-01     
  8      0.675490E+02          -0.994950E-01     
  9      0.336610E+02          -0.206400E+00     
 10      0.170270E+02          -0.520630E-02     
 11      0.815040E+01           0.500480E+00     
 12      0.413190E+01           0.833320E+00     
S   12
  1      0.905260E+04          -0.370580E-05     
  2      0.354810E+04          -0.292350E-04     
  3      0.147800E+04          -0.189020E-03     
  4      0.647350E+03          -0.109400E-02     
  5      0.295330E+03          -0.529080E-02     
  6      0.138980E+03          -0.222050E-01     
  7      0.675490E+02          -0.624550E-01     
  8      0.336610E+02          -0.124390E+00     
  9      0.170270E+02          -0.149730E-01     
 10      0.815040E+01           0.364400E+00     
 11      0.413190E+01           0.687170E+00     
 12      0.204570E+01           0.393430E+00     
S   1
  1      0.940290E+00           1.0000000        
S   1
  1      0.469010E+00           1.0000000        
S   1
  1      0.222190E+00           1.0000000        
S   1
  1      0.102200E+00           1.0000000        
P   11
  1      0.110350E+05           0.185140E-04     
  2      0.261150E+04           0.165270E-03     
  3      0.848020E+03           0.962330E-03     
  4      0.323000E+03           0.437770E-02     
  5      0.135330E+03           0.162180E-01     
  6      0.626840E+02           0.461040E-01     
  7      0.302980E+02           0.113480E+00     
  8      0.152400E+02           0.213530E+00     
  9      0.792590E+01           0.294380E+00     
 10      0.428530E+01           0.287780E+00     
 11      0.230430E+01           0.182690E+00     
P   11
  1      0.261150E+04           0.561370E-06     
  2      0.848020E+03          -0.348440E-06     
  3      0.323000E+03           0.920070E-05     
  4      0.135330E+03          -0.511180E-04     
  5      0.626840E+02          -0.105970E-03     
  6      0.302980E+02          -0.166890E-02     
  7      0.152400E+02          -0.309980E-02     
  8      0.792590E+01          -0.146280E-01     
  9      0.428530E+01           0.123450E-02     
 10      0.230430E+01           0.153150E-02     
 11      0.123570E+01           0.169930E+00     
P   1
  1      0.600210E+00           1.0000000        
P   1
  1      0.287390E+00           1.0000000        
P   1
  1      0.131850E+00           1.0000000        
P   1
  1      0.569700E-01           1.0000000        
D   1
  1      0.246300E+02           1.0000000        
D   1
  1      0.704000E+01           1.0000000        
D   1
  1      0.243000E+01           1.0000000        
D   1
  1      0.870000E+00           1.0000000        
D   1
  1      0.377000E+00           1.0000000        
D   1
  1      0.157000E+00           1.0000000        
F   1
  1      0.406000E+01           1.0000000        
F   1
  1      0.950000E+00           1.0000000        
F   1
  1      0.390000E+00           1.0000000        
G   1
  1      0.197000E+01           1.0000000        
G   1
  1      0.660000E+00           1.0000000        
H   1
  1      0.104000E+01           1.0000000


name: pc-4
description: N/A
elt: Ar
data:
ARGON
S   15
  1      0.944510E+07           0.647130E-06     
  2      0.141410E+07           0.503360E-05     
  3      0.321810E+06           0.264820E-04     
  4      0.911580E+05           0.111900E-03     
  5      0.297430E+05           0.407910E-03     
  6      0.107400E+05           0.133090E-02     
  7      0.419000E+04           0.396580E-02     
  8      0.173890E+04           0.108630E-01     
  9      0.759290E+03           0.271590E-01     
 10      0.345500E+03           0.605140E-01     
 11      0.162360E+03           0.113510E+00     
 12      0.788880E+02           0.158270E+00     
 13      0.393210E+02           0.139000E+00     
 14      0.199180E+02           0.556450E-01     
 15      0.957640E+01           0.513770E-02     
S   12
  1      0.297430E+05          -0.562840E-06     
  2      0.107400E+05          -0.404410E-06     
  3      0.419000E+04          -0.236590E-04     
  4      0.173890E+04          -0.102670E-03     
  5      0.759290E+03          -0.778910E-03     
  6      0.345500E+03          -0.337400E-02     
  7      0.162360E+03          -0.154820E-01     
  8      0.788880E+02          -0.416870E-01     
  9      0.393210E+02          -0.894240E-01     
 10      0.199180E+02          -0.106220E-01     
 11      0.957640E+01           0.200990E+00     
 12      0.491610E+01           0.367220E+00     
S   12
  1      0.107400E+05          -0.430140E-05     
  2      0.419000E+04          -0.322640E-04     
  3      0.173890E+04          -0.215590E-03     
  4      0.759290E+03          -0.124380E-02     
  5      0.345500E+03          -0.612440E-02     
  6      0.162360E+03          -0.258780E-01     
  7      0.788880E+02          -0.748300E-01     
  8      0.393210E+02          -0.152780E+00     
  9      0.199180E+02          -0.370790E-01     
 10      0.957640E+01           0.435240E+00     
 11      0.491610E+01           0.885820E+00     
 12      0.246480E+01           0.609510E+00     
S   1
  1      0.118300E+01           1.0000000        
S   1
  1      0.575210E+00           1.0000000        
S   1
  1      0.270410E+00           1.0000000        
S   1
  1      0.123120E+00           1.0000000        
P   11
  1      0.130060E+05           0.869280E-05     
  2      0.307810E+04           0.776110E-04     
  3      0.999560E+03           0.452490E-03     
  4      0.380970E+03           0.205950E-02     
  5      0.160280E+03           0.758720E-02     
  6      0.744940E+02           0.218220E-01     
  7      0.360650E+02           0.543320E-01     
  8      0.181640E+02           0.104420E+00     
  9      0.946650E+01           0.146450E+00     
 10      0.516300E+01           0.144260E+00     
 11      0.280850E+01           0.943790E-01     
P   11
  1      0.307810E+04           0.275660E-05     
  2      0.999560E+03          -0.182720E-05     
  3      0.380970E+03           0.453980E-04     
  4      0.160280E+03          -0.255510E-03     
  5      0.744940E+02          -0.549680E-03     
  6      0.360650E+02          -0.835420E-02     
  7      0.181640E+02          -0.165040E-01     
  8      0.946650E+01          -0.765420E-01     
  9      0.516300E+01           0.166060E-02     
 10      0.280850E+01           0.120150E-02     
 11      0.152350E+01           0.851690E+00     
P   1
  1      0.743790E+00           1.0000000        
P   1
  1      0.356800E+00           1.0000000        
P   1
  1      0.162210E+00           1.0000000        
P   1
  1      0.699560E-01           1.0000000        
D   1
  1      0.263300E+02           1.0000000        
D   1
  1      0.753000E+01           1.0000000        
D   1
  1      0.260000E+01           1.0000000        
D   1
  1      0.930000E+00           1.0000000        
D   1
  1      0.410000E+00           1.0000000        
D   1
  1      0.170000E+00           1.0000000        
F   1
  1      0.453000E+01           1.0000000        
F   1
  1      0.106000E+01           1.0000000        
F   1
  1      0.440000E+00           1.0000000        
G   1
  1      0.218000E+01           1.0000000        
G   1
  1      0.730000E+00           1.0000000        
H   1
  1      0.112000E+01           1.0000000


name: pcJ-0
description: N/A
elt: H
data:
HYDROGEN
S   3
  1      0.135775E+04           0.662212E-03     
  2      0.543100E+02           0.301327E-01     
  3      0.434480E+01           0.500000E+00     
S   1
  1      0.660491E+00           1.0000000        
S   1
  1      0.136687E+00           1.0000000


name: pcJ-0
description: N/A
elt: He
data:
HELIUM
S   3
  1      0.412812E+04           0.691634E-03     
  2      0.165125E+03           0.312785E-01     
  3      0.132100E+02           0.500000E+00     
S   1
  1      0.194344E+01           1.0000000        
S   1
  1      0.354434E+00           1.0000000


name: pcJ-0
description: N/A
elt: B
data:
BORON
S   4
  1      0.949153E+05           0.895474E-04     
  2      0.379661E+04           0.406499E-02     
  3      0.303729E+03           0.701581E-01     
  4      0.458945E+02           0.500000E+00     
S   1
  1      0.102055E+02           1.0000000        
S   1
  1      0.263484E+01           1.0000000        
S   1
  1      0.193796E+00           1.0000000        
P   2
  1      0.181374E+02           0.437247E-01     
  2      0.279036E+01           0.500000E+00     
P   1
  1      0.541947E+00           1.0000000        
P   1
  1      0.118759E+00           1.0000000


name: pcJ-0
description: N/A
elt: C
data:
CARBON
S   4
  1      0.139534E+06           0.897831E-04     
  2      0.558136E+04           0.404024E-02     
  3      0.446509E+03           0.697449E-01     
  4      0.674620E+02           0.500000E+00     
S   1
  1      0.150674E+02           1.0000000        
S   1
  1      0.393876E+01           1.0000000        
S   1
  1      0.299915E+00           1.0000000        
P   2
  1      0.283900E+02           0.422513E-01     
  2      0.436769E+01           0.500000E+00     
P   1
  1      0.869817E+00           1.0000000        
P   1
  1      0.188934E+00           1.0000000


name: pcJ-0
description: N/A
elt: N
data:
NITROGEN
S   4
  1      0.192453E+06           0.893681E-04     
  2      0.769812E+04           0.402418E-02     
  3      0.615850E+03           0.694684E-01     
  4      0.930439E+02           0.500000E+00     
S   1
  1      0.208479E+02           1.0000000        
S   1
  1      0.549589E+01           1.0000000        
S   1
  1      0.426240E+00           1.0000000        
P   2
  1      0.407418E+02           0.413624E-01     
  2      0.626797E+01           0.500000E+00     
P   1
  1      0.126901E+01           1.0000000        
P   1
  1      0.273903E+00           1.0000000


name: pcJ-0
description: N/A
elt: O
data:
OXYGEN
S   4
  1      0.253789E+06           0.889629E-04     
  2      0.101516E+05           0.401214E-02     
  3      0.812125E+03           0.692649E-01     
  4      0.122693E+03           0.500000E+00     
S   1
  1      0.275608E+02           1.0000000        
S   1
  1      0.731726E+01           1.0000000        
S   1
  1      0.579240E+00           1.0000000        
P   2
  1      0.534157E+02           0.410416E-01     
  2      0.821779E+01           0.500000E+00     
P   1
  1      0.167544E+01           1.0000000        
P   1
  1      0.350672E+00           1.0000000


name: pcJ-0
description: N/A
elt: F
data:
FLUORINE
S   4
  1      0.323467E+06           0.887582E-04     
  2      0.129387E+05           0.400349E-02     
  3      0.103509E+04           0.691137E-01     
  4      0.156377E+03           0.500000E+00     
S   1
  1      0.351961E+02           1.0000000        
S   1
  1      0.939211E+01           1.0000000        
S   1
  1      0.753418E+00           1.0000000        
P   2
  1      0.688964E+02           0.406431E-01     
  2      0.105994E+02           0.500000E+00     
P   1
  1      0.217334E+01           1.0000000        
P   1
  1      0.448707E+00           1.0000000


name: pcJ-0
description: N/A
elt: Ne
data:
NEON
S   4
  1      0.401394E+06           0.886049E-04     
  2      0.160557E+05           0.399685E-02     
  3      0.128446E+04           0.689968E-01     
  4      0.194051E+03           0.500000E+00     
S   1
  1      0.437457E+02           1.0000000        
S   1
  1      0.117195E+02           1.0000000        
S   1
  1      0.947459E+00           1.0000000        
P   2
  1      0.867619E+02           0.402974E-01     
  2      0.133480E+02           0.500000E+00     
P   1
  1      0.275089E+01           1.0000000        
P   1
  1      0.564341E+00           1.0000000


name: pcJ-0
description: N/A
elt: Al
data:
ALUMINUM
S   6
  1      0.205847E+07           0.673179E-05     
  2      0.823389E+05           0.302836E-03     
  3      0.658711E+04           0.532919E-02     
  4      0.990919E+03           0.417754E-01     
  5      0.225287E+03           0.188097E+00     
  6      0.628659E+02           0.500000E+00     
S   7
  1      0.205847E+07           0.347638E-05     
  2      0.823389E+05           0.157463E-03     
  3      0.658711E+04           0.274887E-02     
  4      0.990919E+03           0.222165E-01     
  5      0.225287E+03           0.103317E+00     
  6      0.628659E+02           0.343078E+00     
  7      0.194320E+02           0.500000E+00     
S   1
  1      0.362074E+01           1.0000000        
S   1
  1      0.122881E+01           1.0000000        
S   1
  1      0.120680E+00           1.0000000        
P   3
  1      0.470372E+03           0.498187E-02     
  2      0.723649E+02           0.833220E-01     
  3      0.165426E+02           0.500000E+00     
P   2
  1      0.482391E+01           0.500000E+00     
  2      0.143358E+01           0.458919E+00     
P   1
  1      0.276885E+00           1.0000000        
P   1
  1      0.698563E-01           1.0000000


name: pcJ-0
description: N/A
elt: Si
data:
SILICON
S   6
  1      0.241969E+07           0.667155E-05     
  2      0.967877E+05           0.300129E-03     
  3      0.774301E+04           0.528194E-02     
  4      0.116473E+04           0.414336E-01     
  5      0.264821E+03           0.187015E+00     
  6      0.739675E+02           0.500000E+00     
S   7
  1      0.241969E+07           0.339561E-05     
  2      0.967877E+05           0.153752E-03     
  3      0.774301E+04           0.268532E-02     
  4      0.116473E+04           0.217054E-01     
  5      0.264821E+03           0.101287E+00     
  6      0.739675E+02           0.337589E+00     
  7      0.229125E+02           0.500000E+00     
S   1
  1      0.437414E+01           1.0000000        
S   1
  1      0.153907E+01           1.0000000        
S   1
  1      0.167749E+00           1.0000000        
P   3
  1      0.624520E+03           0.468394E-02     
  2      0.960800E+02           0.800629E-01     
  3      0.221500E+02           0.500000E+00     
P   2
  1      0.656300E+01           0.457523E+00     
  2      0.202500E+01           0.500000E+00     
P   1
  1      0.477800E+00           1.0000000        
P   1
  1      0.128240E+00           1.0000000


name: pcJ-0
description: N/A
elt: P
data:
PHOSPHORUS
S   6
  1      0.280963E+07           0.662016E-05     
  2      0.112385E+06           0.297792E-03     
  3      0.899080E+04           0.524165E-02     
  4      0.135236E+04           0.411387E-01     
  5      0.307498E+03           0.186102E+00     
  6      0.859408E+02           0.500000E+00     
S   7
  1      0.280963E+07           0.333087E-05     
  2      0.112385E+06           0.150794E-03     
  3      0.899080E+04           0.263469E-02     
  4      0.135236E+04           0.212973E-01     
  5      0.307498E+03           0.996746E-01     
  6      0.859408E+02           0.333446E+00     
  7      0.266714E+02           0.500000E+00     
S   1
  1      0.518810E+01           1.0000000        
S   1
  1      0.187780E+01           1.0000000        
S   1
  1      0.220100E+00           1.0000000        
P   3
  1      0.725670E+03           0.464506E-02     
  2      0.111642E+03           0.797233E-01     
  3      0.257839E+02           0.500000E+00     
P   2
  1      0.767250E+01           0.500000E+00     
  2      0.239958E+01           0.490193E+00     
P   1
  1      0.549434E+00           1.0000000        
P   1
  1      0.147479E+00           1.0000000


name: pcJ-0
description: N/A
elt: S
data:
SULFUR
S   6
  1      0.322806E+07           0.657749E-05     
  2      0.129122E+06           0.295881E-03     
  3      0.103298E+05           0.520846E-02     
  4      0.155372E+04           0.408944E-01     
  5      0.353302E+03           0.185345E+00     
  6      0.988050E+02           0.500000E+00     
S   7
  1      0.322806E+07           0.327819E-05     
  2      0.129122E+06           0.148404E-03     
  3      0.103298E+05           0.259357E-02     
  4      0.155372E+04           0.209689E-01     
  5      0.353302E+03           0.983499E-01     
  6      0.988050E+02           0.330197E+00     
  7      0.307160E+02           0.500000E+00     
S   1
  1      0.606325E+01           1.0000000        
S   1
  1      0.224749E+01           1.0000000        
S   1
  1      0.278535E+00           1.0000000        
P   3
  1      0.843459E+03           0.458827E-02     
  2      0.129763E+03           0.790930E-01     
  3      0.300246E+02           0.500000E+00     
P   2
  1      0.897333E+01           0.500000E+00     
  2      0.284402E+01           0.427041E+00     
P   1
  1      0.633607E+00           1.0000000        
P   1
  1      0.169552E+00           1.0000000


name: pcJ-0
description: N/A
elt: Cl
data:
CHLORINE
S   6
  1      0.367469E+07           0.654179E-05     
  2      0.146988E+06           0.294279E-03     
  3      0.117590E+05           0.518068E-02     
  4      0.176863E+04           0.406916E-01     
  5      0.402188E+03           0.184727E+00     
  6      0.112540E+03           0.500000E+00     
S   7
  1      0.367469E+07           0.323553E-05     
  2      0.146988E+06           0.146473E-03     
  3      0.117590E+05           0.256000E-02     
  4      0.176863E+04           0.207066E-01     
  5      0.402188E+03           0.972751E-01     
  6      0.112540E+03           0.327695E+00     
  7      0.350390E+02           0.500000E+00     
S   1
  1      0.699558E+01           1.0000000        
S   1
  1      0.264547E+01           1.0000000        
S   1
  1      0.341568E+00           1.0000000        
P   3
  1      0.979321E+03           0.452274E-02     
  2      0.150665E+03           0.783425E-01     
  3      0.349330E+02           0.500000E+00     
P   2
  1      0.104915E+02           0.500000E+00     
  2      0.337258E+01           0.400799E+00     
P   1
  1      0.759889E+00           1.0000000        
P   1
  1      0.202894E+00           1.0000000


name: pcJ-0
description: N/A
elt: Ar
data:
ARGON
S   6
  1      0.414912E+07           0.651250E-05     
  2      0.165965E+06           0.292914E-03     
  3      0.132772E+05           0.515730E-02     
  4      0.199692E+04           0.405205E-01     
  5      0.454119E+03           0.184199E+00     
  6      0.127136E+03           0.500000E+00     
S   7
  1      0.414912E+07           0.320116E-05     
  2      0.165965E+06           0.144906E-03     
  3      0.132772E+05           0.253251E-02     
  4      0.199692E+04           0.204930E-01     
  5      0.454119E+03           0.963934E-01     
  6      0.127136E+03           0.325778E+00     
  7      0.396371E+02           0.500000E+00     
S   1
  1      0.798167E+01           1.0000000        
S   1
  1      0.307062E+01           1.0000000        
S   1
  1      0.409083E+00           1.0000000        
P   3
  1      0.112602E+04           0.446529E-02     
  2      0.173234E+03           0.776707E-01     
  3      0.402385E+02           0.500000E+00     
P   2
  1      0.121389E+02           0.500000E+00     
  2      0.395271E+01           0.385197E+00     
P   1
  1      0.906259E+00           1.0000000        
P   1
  1      0.242517E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: H
data:
HYDROGEN
S   3
  1      0.135775E+04           0.662272E-03     
  2      0.543100E+02           0.301414E-01     
  3      0.434480E+01           0.500000E+00     
S   1
  1      0.660491E+00           1.0000000        
S   1
  1      0.136687E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: He
data:
HELIUM
S   3
  1      0.412812E+04           0.691643E-03     
  2      0.165125E+03           0.312799E-01     
  3      0.132100E+02           0.500000E+00     
S   1
  1      0.194344E+01           1.0000000        
S   1
  1      0.354434E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: B
data:
BORON
S   4
  1      0.949153E+05           0.901807E-04     
  2      0.379661E+04           0.406466E-02     
  3      0.303729E+03           0.701586E-01     
  4      0.458945E+02           0.500000E+00     
S   1
  1      0.102055E+02           1.0000000        
S   1
  1      0.263484E+01           1.0000000        
S   1
  1      0.193796E+00           1.0000000        
P   2
  1      0.181374E+02           0.437380E-01     
  2      0.279036E+01           0.500000E+00     
P   1
  1      0.541947E+00           1.0000000        
P   1
  1      0.118759E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: C
data:
CARBON
S   4
  1      0.139534E+06           0.896135E-04     
  2      0.558136E+04           0.404014E-02     
  3      0.446509E+03           0.697444E-01     
  4      0.674620E+02           0.500000E+00     
S   1
  1      0.150674E+02           1.0000000        
S   1
  1      0.393876E+01           1.0000000        
S   1
  1      0.299915E+00           1.0000000        
P   2
  1      0.283900E+02           0.422609E-01     
  2      0.436769E+01           0.500000E+00     
P   1
  1      0.869817E+00           1.0000000        
P   1
  1      0.188934E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: N
data:
NITROGEN
S   4
  1      0.192453E+06           0.892391E-04     
  2      0.769812E+04           0.402406E-02     
  3      0.615850E+03           0.694692E-01     
  4      0.930439E+02           0.500000E+00     
S   1
  1      0.208479E+02           1.0000000        
S   1
  1      0.549589E+01           1.0000000        
S   1
  1      0.426240E+00           1.0000000        
P   2
  1      0.407418E+02           0.413737E-01     
  2      0.626797E+01           0.500000E+00     
P   1
  1      0.126901E+01           1.0000000        
P   1
  1      0.273903E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: O
data:
OXYGEN
S   4
  1      0.253789E+06           0.889624E-04     
  2      0.101516E+05           0.401221E-02     
  3      0.812125E+03           0.692649E-01     
  4      0.122693E+03           0.500000E+00     
S   1
  1      0.275608E+02           1.0000000        
S   1
  1      0.731726E+01           1.0000000        
S   1
  1      0.579240E+00           1.0000000        
P   2
  1      0.534157E+02           0.410447E-01     
  2      0.821779E+01           0.500000E+00     
P   1
  1      0.167544E+01           1.0000000        
P   1
  1      0.350672E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: F
data:
FLUORINE
S   4
  1      0.323467E+06           0.887559E-04     
  2      0.129387E+05           0.400340E-02     
  3      0.103509E+04           0.691120E-01     
  4      0.156377E+03           0.500000E+00     
S   1
  1      0.351961E+02           1.0000000        
S   1
  1      0.939211E+01           1.0000000        
S   1
  1      0.753418E+00           1.0000000        
P   2
  1      0.688964E+02           0.406446E-01     
  2      0.105994E+02           0.500000E+00     
P   1
  1      0.217334E+01           1.0000000        
P   1
  1      0.448707E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: Ne
data:
NEON
S   4
  1      0.401394E+06           0.886012E-04     
  2      0.160557E+05           0.399682E-02     
  3      0.128446E+04           0.689966E-01     
  4      0.194051E+03           0.500000E+00     
S   1
  1      0.437457E+02           1.0000000        
S   1
  1      0.117195E+02           1.0000000        
S   1
  1      0.947459E+00           1.0000000        
P   2
  1      0.867619E+02           0.402987E-01     
  2      0.133480E+02           0.500000E+00     
P   1
  1      0.275089E+01           1.0000000        
P   1
  1      0.564341E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: Al
data:
ALUMINUM
S   6
  1      0.205847E+07           0.107743E-04     
  2      0.823389E+05           0.480939E-03     
  3      0.658711E+04           0.854161E-02     
  4      0.990919E+03           0.645919E-01     
  5      0.225287E+03           0.279183E+00     
  6      0.628659E+02           0.500000E+00     
S   6
  1      0.823389E+05           0.225910E-05     
  2      0.658711E+04          -0.765230E-05     
  3      0.990919E+03           0.137207E-02     
  4      0.225287E+03           0.132223E-01     
  5      0.628659E+02           0.181722E+00     
  6      0.194320E+02           0.500000E+00     
S   1
  1      0.362074E+01           1.0000000        
S   1
  1      0.122881E+01           1.0000000        
S   1
  1      0.120680E+00           1.0000000        
P   4
  1      0.470372E+03           0.200190E-02     
  2      0.723649E+02           0.334877E-01     
  3      0.165426E+02           0.200927E+00     
  4      0.482391E+01           0.500000E+00     
P   1
  1      0.143358E+01           1.0000000        
P   1
  1      0.276885E+00           1.0000000        
P   1
  1      0.698563E-01           1.0000000


name: pcJ-0_2006
description: N/A
elt: Si
data:
SILICON
S   6
  1      0.241969E+07           0.106115E-04     
  2      0.967877E+05           0.473830E-03     
  3      0.774301E+04           0.841185E-02     
  4      0.116473E+04           0.637158E-01     
  5      0.264821E+03           0.275783E+00     
  6      0.739675E+02           0.500000E+00     
S   6
  1      0.967877E+05           0.211590E-05     
  2      0.774301E+04          -0.656670E-05     
  3      0.116473E+04           0.131430E-02     
  4      0.264821E+03           0.130302E-01     
  5      0.739675E+02           0.177575E+00     
  6      0.229125E+02           0.500000E+00     
S   1
  1      0.437414E+01           1.0000000        
S   1
  1      0.153907E+01           1.0000000        
S   1
  1      0.167749E+00           1.0000000        
P   4
  1      0.624520E+03           0.175676E-02     
  2      0.960800E+02           0.300305E-01     
  3      0.221500E+02           0.187537E+00     
  4      0.656300E+01           0.500000E+00     
P   1
  1      0.202500E+01           1.0000000        
P   1
  1      0.477800E+00           1.0000000        
P   1
  1      0.128240E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: P
data:
PHOSPHORUS
S   6
  1      0.280963E+07           0.104905E-04     
  2      0.112385E+06           0.468505E-03     
  3      0.899080E+04           0.831582E-02     
  4      0.135236E+04           0.630556E-01     
  5      0.307498E+03           0.273367E+00     
  6      0.859408E+02           0.500000E+00     
S   6
  1      0.112385E+06          -0.202240E-05     
  2      0.899080E+04           0.589970E-05     
  3      0.135236E+04          -0.127411E-02     
  4      0.307498E+03          -0.128669E-01     
  5      0.859408E+02          -0.174671E+00     
  6      0.266714E+02          -0.500000E+00     
S   1
  1      0.518810E+01           1.0000000        
S   1
  1      0.187780E+01           1.0000000        
S   1
  1      0.220100E+00           1.0000000        
P   4
  1      0.725670E+03           0.175004E-02     
  2      0.111642E+03           0.300354E-01     
  3      0.257839E+02           0.188374E+00     
  4      0.767250E+01           0.500000E+00     
P   1
  1      0.239958E+01           1.0000000        
P   1
  1      0.549434E+00           1.0000000        
P   1
  1      0.147479E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: S
data:
SULFUR
S   6
  1      0.322806E+07           0.104069E-04     
  2      0.129122E+06           0.464806E-03     
  3      0.103298E+05           0.824996E-02     
  4      0.155372E+04           0.625968E-01     
  5      0.353302E+03           0.271808E+00     
  6      0.988050E+02           0.500000E+00     
S   6
  1      0.129122E+06           0.196660E-05     
  2      0.103298E+05          -0.568000E-05     
  3      0.155372E+04           0.124804E-02     
  4      0.353302E+03           0.127159E-01     
  5      0.988050E+02           0.172666E+00     
  6      0.307160E+02           0.500000E+00     
S   1
  1      0.606325E+01           1.0000000        
S   1
  1      0.224749E+01           1.0000000        
S   1
  1      0.278535E+00           1.0000000        
P   4
  1      0.843459E+03           0.172554E-02     
  2      0.129763E+03           0.297469E-01     
  3      0.300246E+02           0.188043E+00     
  4      0.897333E+01           0.500000E+00     
P   1
  1      0.284402E+01           1.0000000        
P   1
  1      0.633607E+00           1.0000000        
P   1
  1      0.169552E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: Cl
data:
CHLORINE
S   6
  1      0.367469E+07           0.103491E-04     
  2      0.146988E+06           0.462223E-03     
  3      0.117590E+05           0.820493E-02     
  4      0.176863E+04           0.622773E-01     
  5      0.402188E+03           0.270847E+00     
  6      0.112540E+03           0.500000E+00     
S   6
  1      0.146988E+06           0.193780E-05     
  2      0.117590E+05          -0.571310E-05     
  3      0.176863E+04           0.123196E-02     
  4      0.402188E+03           0.125818E-01     
  5      0.112540E+03           0.171338E+00     
  6      0.350390E+02           0.500000E+00     
S   1
  1      0.699558E+01           1.0000000        
S   1
  1      0.264547E+01           1.0000000        
S   1
  1      0.341568E+00           1.0000000        
P   4
  1      0.979321E+03           0.169008E-02     
  2      0.150665E+03           0.292766E-01     
  3      0.349330E+02           0.186847E+00     
  4      0.104915E+02           0.500000E+00     
P   1
  1      0.337258E+01           1.0000000        
P   1
  1      0.759889E+00           1.0000000        
P   1
  1      0.202894E+00           1.0000000


name: pcJ-0_2006
description: N/A
elt: Ar
data:
ARGON
S   6
  1      0.414912E+07           0.103145E-04     
  2      0.165965E+06           0.460572E-03     
  3      0.132772E+05           0.817725E-02     
  4      0.199692E+04           0.620730E-01     
  5      0.454119E+03           0.270380E+00     
  6      0.127136E+03           0.500000E+00     
S   6
  1      0.165965E+06           0.196830E-05     
  2      0.132772E+05          -0.528390E-05     
  3      0.199692E+04           0.122908E-02     
  4      0.454119E+03           0.124839E-01     
  5      0.127136E+03           0.170609E+00     
  6      0.396371E+02           0.500000E+00     
S   1
  1      0.798167E+01           1.0000000        
S   1
  1      0.307062E+01           1.0000000        
S   1
  1      0.409083E+00           1.0000000        
P   4
  1      0.112602E+04           0.165962E-02     
  2      0.173234E+03           0.288673E-01     
  3      0.402385E+02           0.185835E+00     
  4      0.121389E+02           0.500000E+00     
P   1
  1      0.395271E+01           1.0000000        
P   1
  1      0.906259E+00           1.0000000        
P   1
  1      0.242517E+00           1.0000000


name: pc-3
description: N/A
elt: H
data:
HYDROGEN
S   5
  1      0.774690E+03           0.131630E-02     
  2      0.116160E+03           0.102260E-01     
  3      0.264490E+02           0.536290E-01     
  4      0.750150E+01           0.222850E+00     
  5      0.245680E+01           0.753740E+00     
S   1
  1      0.887740E+00           1.0000000        
S   1
  1      0.340850E+00           1.0000000        
S   1
  1      0.134770E+00           1.0000000        
S   1
  1      0.522630E-01           1.0000000        
P   1
  1      0.650000E+01           1.0000000        
P   1
  1      0.155000E+01           1.0000000        
P   1
  1      0.550000E+00           1.0000000        
P   1
  1      0.200000E+00           1.0000000        
D   1
  1      0.195000E+01           1.0000000        
D   1
  1      0.650000E+00           1.0000000        
F   1
  1      0.220000E+01           1.0000000


name: pc-3
description: N/A
elt: He
data:
HELIUM
S   5
  1      0.216740E+04           0.841530E-03     
  2      0.324990E+03           0.652740E-02     
  3      0.739940E+02           0.339950E-01     
  4      0.209750E+02           0.138110E+00     
  5      0.684520E+01           0.441950E+00     
S   1
  1      0.243940E+01           1.0000000        
S   1
  1      0.902510E+00           1.0000000        
S   1
  1      0.333130E+00           1.0000000        
S   1
  1      0.124130E+00           1.0000000        
P   1
  1      0.107000E+02           1.0000000        
P   1
  1      0.255000E+01           1.0000000        
P   1
  1      0.900000E+00           1.0000000        
P   1
  1      0.330000E+00           1.0000000        
D   1
  1      0.320000E+01           1.0000000        
D   1
  1      0.107000E+01           1.0000000        
F   1
  1      0.320000E+01           1.0000000


name: pc-3
description: N/A
elt: Li
data:
LITHIUM
S   9
  1      0.130180E+05           0.514480E-04     
  2      0.195010E+04           0.397160E-03     
  3      0.443840E+03           0.210140E-02     
  4      0.125760E+03           0.864300E-02     
  5      0.410940E+02           0.305770E-01     
  6      0.148820E+02           0.853970E-01     
  7      0.580750E+01           0.194150E+00     
  8      0.238910E+01           0.285920E+00     
  9      0.101840E+01           0.305300E+00     
S   9
  1      0.195010E+04           0.153040E-05     
  2      0.443840E+03          -0.310360E-05     
  3      0.125760E+03           0.570260E-04     
  4      0.410940E+02          -0.384710E-04     
  5      0.148820E+02           0.143160E-02     
  6      0.580750E+01           0.164970E-02     
  7      0.238910E+01           0.236850E-01     
  8      0.101840E+01           0.202470E-01     
  9      0.444040E+00           0.100640E+00     
S   1
  1      0.194050E+00           1.0000000        
S   1
  1      0.840390E-01           1.0000000        
S   1
  1      0.379210E-01           1.0000000        
S   1
  1      0.166400E-01           1.0000000        
P   1
  1      0.154000E+02           1.0000000        
P   1
  1      0.359000E+01           1.0000000        
P   1
  1      0.109000E+01           1.0000000        
P   1
  1      0.350000E+00           1.0000000        
P   1
  1      0.130000E+00           1.0000000        
P   1
  1      0.500000E-01           1.0000000        
D   1
  1      0.480000E+00           1.0000000        
D   1
  1      0.150000E+00           1.0000000        
F   1
  1      0.350000E+00           1.0000000


name: pc-3
description: N/A
elt: Be
data:
BERYLLIUM
S   9
  1      0.266730E+05           0.219750E-04     
  2      0.399630E+04           0.169540E-03     
  3      0.909670E+03           0.897570E-03     
  4      0.257770E+03           0.369380E-02     
  5      0.842340E+02           0.131410E-01     
  6      0.305450E+02           0.371790E-01     
  7      0.120200E+02           0.859990E-01     
  8      0.504950E+01           0.130480E+00     
  9      0.217190E+01           0.138710E+00     
S   9
  1      0.399630E+04           0.493050E-05     
  2      0.909670E+03          -0.913350E-05     
  3      0.257770E+03           0.194400E-03     
  4      0.842340E+02           0.956220E-05     
  5      0.305450E+02           0.570280E-02     
  6      0.120200E+02           0.123440E-01     
  7      0.504950E+01           0.104030E+00     
  8      0.217190E+01           0.188820E+00     
  9      0.934100E+00           0.421110E+00     
S   1
  1      0.389180E+00           1.0000000        
S   1
  1      0.174020E+00           1.0000000        
S   1
  1      0.760280E-01           1.0000000        
S   1
  1      0.322650E-01           1.0000000        
P   1
  1      0.278000E+02           1.0000000        
P   1
  1      0.646000E+01           1.0000000        
P   1
  1      0.196000E+01           1.0000000        
P   1
  1      0.630000E+00           1.0000000        
P   1
  1      0.240000E+00           1.0000000        
P   1
  1      0.900000E-01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
F   1
  1      0.550000E+00           1.0000000


name: pc-3
description: N/A
elt: B
data:
BORON
S   9
  1      0.574150E+05           0.298380E-04     
  2      0.860150E+04           0.230440E-03     
  3      0.195780E+04           0.121950E-02     
  4      0.554610E+03           0.504630E-02     
  5      0.181050E+03           0.181230E-01     
  6      0.654910E+02           0.533180E-01     
  7      0.255990E+02           0.132770E+00     
  8      0.105320E+02           0.230690E+00     
  9      0.444650E+01           0.255450E+00     
S   9
  1      0.860150E+04           0.427510E-05     
  2      0.195780E+04          -0.707370E-05     
  3      0.554610E+03           0.176690E-03     
  4      0.181050E+03           0.135380E-03     
  5      0.654910E+02           0.601230E-02     
  6      0.255990E+02           0.198470E-01     
  7      0.105320E+02           0.144670E+00     
  8      0.444650E+01           0.393600E+00     
  9      0.188320E+01           0.806980E+00     
S   1
  1      0.698310E+00           1.0000000        
S   1
  1      0.343100E+00           1.0000000        
S   1
  1      0.142760E+00           1.0000000        
S   1
  1      0.581570E-01           1.0000000        
P   5
  1      0.901110E+02           0.558170E-03     
  2      0.211650E+02           0.455240E-02     
  3      0.656180E+01           0.223130E-01     
  4      0.256460E+01           0.594710E-01     
  5      0.105100E+01           0.162560E+00     
P   1
  1      0.451930E+00           1.0000000        
P   1
  1      0.194680E+00           1.0000000        
P   1
  1      0.832120E-01           1.0000000        
P   1
  1      0.332970E-01           1.0000000        
D   1
  1      0.400000E+01           1.0000000        
D   1
  1      0.105000E+01           1.0000000        
D   1
  1      0.400000E+00           1.0000000        
D   1
  1      0.150000E+00           1.0000000        
F   1
  1      0.120000E+01           1.0000000        
F   1
  1      0.520000E+00           1.0000000        
G   1
  1      0.130000E+01           1.0000000


name: pc-3
description: N/A
elt: C
data:
CARBON
S   9
  1      0.871410E+05           0.281830E-04     
  2      0.130520E+05           0.218190E-03     
  3      0.297060E+04           0.115110E-02     
  4      0.841460E+03           0.478590E-02     
  5      0.274590E+03           0.171340E-01     
  6      0.992150E+02           0.511200E-01     
  7      0.386940E+02           0.128050E+00     
  8      0.159110E+02           0.227730E+00     
  9      0.676680E+01           0.247580E+00     
S   9
  1      0.130520E+05           0.259300E-05     
  2      0.297060E+04          -0.309070E-05     
  3      0.841460E+03           0.122470E-03     
  4      0.274590E+03           0.254940E-03     
  5      0.992150E+02           0.512540E-02     
  6      0.386940E+02           0.219550E-01     
  7      0.159110E+02           0.141120E+00     
  8      0.676680E+01           0.413030E+00     
  9      0.289840E+01           0.827140E+00     
S   1
  1      0.112460E+01           1.0000000        
S   1
  1      0.514460E+00           1.0000000        
S   1
  1      0.211760E+00           1.0000000        
S   1
  1      0.850170E-01           1.0000000        
P   5
  1      0.148240E+03           0.507560E-03     
  2      0.349120E+02           0.421260E-02     
  3      0.108940E+02           0.213350E-01     
  4      0.419340E+01           0.623290E-01     
  5      0.171340E+01           0.166420E+00     
P   1
  1      0.735660E+00           1.0000000        
P   1
  1      0.316370E+00           1.0000000        
P   1
  1      0.132420E+00           1.0000000        
P   1
  1      0.519010E-01           1.0000000        
D   1
  1      0.520000E+01           1.0000000        
D   1
  1      0.135000E+01           1.0000000        
D   1
  1      0.520000E+00           1.0000000        
D   1
  1      0.200000E+00           1.0000000        
F   1
  1      0.150000E+01           1.0000000        
F   1
  1      0.650000E+00           1.0000000        
G   1
  1      0.140000E+01           1.0000000


name: pc-3
description: N/A
elt: N
data:
NITROGEN
S   9
  1      0.124550E+06           0.266720E-04     
  2      0.186560E+05           0.206840E-03     
  3      0.424510E+04           0.108930E-02     
  4      0.120210E+04           0.454630E-02     
  5      0.392140E+03           0.162370E-01     
  6      0.141580E+03           0.489570E-01     
  7      0.551360E+02           0.123170E+00     
  8      0.226430E+02           0.224250E+00     
  9      0.965660E+01           0.238760E+00     
S   8
  1      0.186560E+05           0.140880E-05     
  2      0.120210E+04           0.814390E-04     
  3      0.392140E+03           0.324390E-03     
  4      0.141580E+03           0.436210E-02     
  5      0.551360E+02           0.228380E-01     
  6      0.226430E+02           0.134620E+00     
  7      0.965660E+01           0.425010E+00     
  8      0.416850E+01           0.825170E+00     
S   1
  1      0.166780E+01           1.0000000        
S   1
  1      0.745740E+00           1.0000000        
S   1
  1      0.305160E+00           1.0000000        
S   1
  1      0.120890E+00           1.0000000        
P   5
  1      0.218290E+03           0.482810E-03     
  2      0.514880E+02           0.404200E-02     
  3      0.161300E+02           0.209460E-01     
  4      0.613070E+01           0.647570E-01     
  5      0.250520E+01           0.170420E+00     
P   1
  1      0.107300E+01           1.0000000        
P   1
  1      0.458380E+00           1.0000000        
P   1
  1      0.189480E+00           1.0000000        
P   1
  1      0.733590E-01           1.0000000        
D   1
  1      0.600000E+01           1.0000000        
D   1
  1      0.165000E+01           1.0000000        
D   1
  1      0.650000E+00           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
F   1
  1      0.180000E+01           1.0000000        
F   1
  1      0.770000E+00           1.0000000        
G   1
  1      0.150000E+01           1.0000000


name: pc-3
description: N/A
elt: O
data:
OXYGEN
S   9
  1      0.164030E+06           0.265210E-04     
  2      0.245670E+05           0.205710E-03     
  3      0.559100E+04           0.108270E-02     
  4      0.158360E+04           0.451900E-02     
  5      0.516670E+03           0.161350E-01     
  6      0.186560E+03           0.487160E-01     
  7      0.726960E+02           0.122680E+00     
  8      0.299920E+02           0.221890E+00     
  9      0.128990E+02           0.239040E+00     
S   8
  1      0.245670E+05           0.133220E-05     
  2      0.158360E+04           0.802520E-04     
  3      0.516670E+03           0.345120E-03     
  4      0.186560E+03           0.444840E-02     
  5      0.726960E+02           0.236010E-01     
  6      0.299920E+02           0.138610E+00     
  7      0.128990E+02           0.428720E+00     
  8      0.561350E+01           0.848730E+00     
S   1
  1      0.229860E+01           1.0000000        
S   1
  1      0.999800E+00           1.0000000        
S   1
  1      0.407460E+00           1.0000000        
S   1
  1      0.159220E+00           1.0000000        
P   5
  1      0.272020E+03           0.549410E-03     
  2      0.642430E+02           0.458340E-02     
  3      0.202490E+02           0.235730E-01     
  4      0.764380E+01           0.743380E-01     
  5      0.312320E+01           0.187550E+00     
P   1
  1      0.132510E+01           1.0000000        
P   1
  1      0.555510E+00           1.0000000        
P   1
  1      0.222290E+00           1.0000000        
P   1
  1      0.840100E-01           1.0000000        
D   1
  1      0.700000E+01           1.0000000        
D   1
  1      0.200000E+01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
D   1
  1      0.300000E+00           1.0000000        
F   1
  1      0.210000E+01           1.0000000        
F   1
  1      0.900000E+00           1.0000000        
G   1
  1      0.160000E+01           1.0000000


name: pc-3
description: N/A
elt: F
data:
FLUORINE
S   9
  1      0.215660E+06           0.253780E-04     
  2      0.322990E+05           0.196930E-03     
  3      0.735040E+04           0.103600E-02     
  4      0.208180E+04           0.432940E-02     
  5      0.679090E+03           0.154620E-01     
  6      0.245100E+03           0.469030E-01     
  7      0.954620E+02           0.118810E+00     
  8      0.394220E+02           0.217110E+00     
  9      0.170180E+02           0.236990E+00     
S   8
  1      0.322990E+05           0.101920E-05     
  2      0.208180E+04           0.680960E-04     
  3      0.679090E+03           0.346200E-03     
  4      0.245100E+03           0.413970E-02     
  5      0.954620E+02           0.230730E-01     
  6      0.394220E+02           0.133950E+00     
  7      0.170180E+02           0.422460E+00     
  8      0.745250E+01           0.859990E+00     
S   1
  1      0.313290E+01           1.0000000        
S   1
  1      0.133950E+01           1.0000000        
S   1
  1      0.542180E+00           1.0000000        
S   1
  1      0.209040E+00           1.0000000        
P   5
  1      0.351220E+03           0.552630E-03     
  2      0.829780E+02           0.462850E-02     
  3      0.262670E+02           0.238020E-01     
  4      0.993070E+01           0.762620E-01     
  5      0.406700E+01           0.189640E+00     
P   1
  1      0.172460E+01           1.0000000        
P   1
  1      0.719760E+00           1.0000000        
P   1
  1      0.286240E+00           1.0000000        
P   1
  1      0.107890E+00           1.0000000        
D   1
  1      0.840000E+01           1.0000000        
D   1
  1      0.260000E+01           1.0000000        
D   1
  1      0.100000E+01           1.0000000        
D   1
  1      0.350000E+00           1.0000000        
F   1
  1      0.260000E+01           1.0000000        
F   1
  1      0.105000E+01           1.0000000        
G   1
  1      0.170000E+01           1.0000000


name: pc-3
description: N/A
elt: Ne
data:
NEON
S   9
  1      0.270660E+06           0.124650E-04     
  2      0.405410E+05           0.967800E-04     
  3      0.922650E+04           0.508630E-03     
  4      0.261320E+04           0.212860E-02     
  5      0.852390E+03           0.759220E-02     
  6      0.307610E+03           0.231160E-01     
  7      0.119760E+03           0.586140E-01     
  8      0.494370E+02           0.108070E+00     
  9      0.213690E+02           0.116600E+00     
S   8
  1      0.922650E+04           0.646630E-06     
  2      0.261320E+04           0.274090E-04     
  3      0.852390E+03           0.186610E-03     
  4      0.307610E+03           0.194920E-02     
  5      0.119760E+03           0.117730E-01     
  6      0.494370E+02           0.661460E-01     
  7      0.213690E+02           0.214570E+00     
  8      0.939210E+01           0.429870E+00     
S   1
  1      0.398320E+01           1.0000000        
S   1
  1      0.168870E+01           1.0000000        
S   1
  1      0.680300E+00           1.0000000        
S   1
  1      0.260240E+00           1.0000000        
P   5
  1      0.443450E+03           0.274680E-02     
  2      0.104820E+03           0.230810E-01     
  3      0.332550E+02           0.119300E+00     
  4      0.125480E+02           0.388630E+00     
  5      0.514210E+01           0.957900E+00     
P   1
  1      0.217830E+01           1.0000000        
P   1
  1      0.906450E+00           1.0000000        
P   1
  1      0.359940E+00           1.0000000        
P   1
  1      0.135150E+00           1.0000000        
D   1
  1      0.100000E+02           1.0000000        
D   1
  1      0.300000E+01           1.0000000        
D   1
  1      0.115000E+01           1.0000000        
D   1
  1      0.400000E+00           1.0000000        
F   1
  1      0.280000E+01           1.0000000        
F   1
  1      0.115000E+01           1.0000000        
G   1
  1      0.180000E+01           1.0000000


name: pc-3
description: N/A
elt: Na
data:
SODIUM
S   12
  1      0.421840E+06           0.182130E-04     
  2      0.631880E+05           0.141530E-03     
  3      0.143810E+05           0.743800E-03     
  4      0.407370E+04           0.312730E-02     
  5      0.132910E+04           0.112490E-01     
  6      0.479990E+03           0.352920E-01     
  7      0.187360E+03           0.953900E-01     
  8      0.777700E+02           0.210010E+00     
  9      0.337990E+02           0.344170E+00     
 10      0.151270E+02           0.327010E+00     
 11      0.693200E+01           0.121220E+00     
 12      0.276510E+01           0.644090E-02     
S   10
  1      0.407370E+04          -0.658890E-05     
  2      0.132910E+04          -0.106440E-04     
  3      0.479990E+03          -0.265650E-03     
  4      0.187360E+03          -0.112860E-02     
  5      0.777700E+02          -0.804960E-02     
  6      0.337990E+02          -0.260370E-01     
  7      0.151270E+02          -0.706220E-01     
  8      0.693200E+01          -0.122170E-01     
  9      0.276510E+01           0.260470E+00     
 10      0.113970E+01           0.359250E+00     
S   10
  1      0.132910E+04          -0.126410E-05     
  2      0.479990E+03          -0.110250E-04     
  3      0.187360E+03          -0.769170E-04     
  4      0.777700E+02          -0.432740E-03     
  5      0.337990E+02          -0.169970E-02     
  6      0.151270E+02          -0.435420E-02     
  7      0.693200E+01          -0.178400E-02     
  8      0.276510E+01           0.252370E-01     
  9      0.113970E+01           0.766860E-01     
 10      0.452130E+00           0.111320E+00     
S   1
  1      0.826030E-01           1.0000000        
S   1
  1      0.415100E-01           1.0000000        
S   1
  1      0.186180E-01           1.0000000        
P   9
  1      0.115680E+04           0.158350E-03     
  2      0.274420E+03           0.137160E-02     
  3      0.891390E+02           0.740860E-02     
  4      0.332590E+02           0.312140E-01     
  5      0.135570E+02           0.909200E-01     
  6      0.596240E+01           0.201370E+00     
  7      0.268240E+01           0.307320E+00     
  8      0.119710E+01           0.333470E+00     
  9      0.517890E+00           0.229470E+00     
P   1
  1      0.213310E+00           1.0000000        
P   1
  1      0.100000E+00           1.0000000        
P   1
  1      0.370000E-01           1.0000000        
D   1
  1      0.910000E+00           1.0000000        
D   1
  1      0.190000E+00           1.0000000        
F   1
  1      0.270000E+00           1.0000000


name: pc-3
description: N/A
elt: Mg
data:
MAGNESIUM
S   12
  1      0.564790E+06           0.787630E-05     
  2      0.845890E+05           0.612150E-04     
  3      0.192510E+05           0.321790E-03     
  4      0.545280E+04           0.135380E-02     
  5      0.177910E+04           0.487800E-02     
  6      0.642580E+03           0.153760E-01     
  7      0.250920E+03           0.420810E-01     
  8      0.104190E+03           0.951870E-01     
  9      0.452750E+02           0.164140E+00     
 10      0.203180E+02           0.171190E+00     
 11      0.933190E+01           0.766260E-01     
 12      0.369780E+01           0.637870E-02     
S   10
  1      0.545280E+04          -0.298670E-05     
  2      0.177910E+04          -0.639120E-05     
  3      0.642580E+03          -0.130960E-03     
  4      0.250920E+03          -0.607810E-03     
  5      0.104190E+03          -0.421360E-02     
  6      0.452750E+02          -0.149090E-01     
  7      0.203180E+02          -0.418680E-01     
  8      0.933190E+01          -0.216670E-01     
  9      0.369780E+01           0.145990E+00     
 10      0.157250E+01           0.201660E+00     
S   10
  1      0.177910E+04           0.379680E-05     
  2      0.642580E+03           0.310480E-04     
  3      0.250920E+03           0.222840E-03     
  4      0.104190E+03           0.120920E-02     
  5      0.452750E+02           0.476660E-02     
  6      0.203180E+02           0.102690E-01     
  7      0.933190E+01           0.471000E-02     
  8      0.369780E+01          -0.133980E-01     
  9      0.157250E+01           0.234820E+00     
 10      0.649490E+00           0.487910E+00     
S   1
  1      0.159010E+00           1.0000000        
S   1
  1      0.716650E-01           1.0000000        
S   1
  1      0.299420E-01           1.0000000        
P   9
  1      0.151690E+04           0.716080E-04     
  2      0.359790E+03           0.623140E-03     
  3      0.116760E+03           0.341360E-02     
  4      0.435800E+02           0.145310E-01     
  5      0.179260E+02           0.428700E-01     
  6      0.793560E+01           0.977890E-01     
  7      0.360380E+01           0.154570E+00     
  8      0.164410E+01           0.168280E+00     
  9      0.741120E+00           0.113330E+00     
P   1
  1      0.316660E+00           1.0000000        
P   1
  1      0.149000E+00           1.0000000        
P   1
  1      0.550000E-01           1.0000000        
D   1
  1      0.120000E+01           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
F   1
  1      0.330000E+00           1.0000000


name: pc-3
description: N/A
elt: Al
data:
ALUMINUM
S   12
  1      0.721490E+06           0.141920E-04     
  2      0.108090E+06           0.110260E-03     
  3      0.246050E+05           0.579460E-03     
  4      0.697140E+04           0.243790E-02     
  5      0.227490E+04           0.879450E-02     
  6      0.821600E+03           0.278210E-01     
  7      0.320780E+03           0.768160E-01     
  8      0.133150E+03           0.177100E+00     
  9      0.578170E+02           0.316030E+00     
 10      0.259540E+02           0.351080E+00     
 11      0.118990E+02           0.176190E+00     
 12      0.474990E+01           0.182680E-01     
S   10
  1      0.697140E+04          -0.493330E-05     
  2      0.227490E+04          -0.862570E-05     
  3      0.821600E+03          -0.203730E-03     
  4      0.320780E+03          -0.914550E-03     
  5      0.133150E+03          -0.657840E-02     
  6      0.578170E+02          -0.239550E-01     
  7      0.259540E+02          -0.710310E-01     
  8      0.118990E+02          -0.504540E-01     
  9      0.474990E+01           0.223110E+00     
 10      0.206880E+01           0.347080E+00     
S   10
  1      0.227490E+04          -0.159130E-06     
  2      0.821600E+03          -0.131770E-05     
  3      0.320780E+03          -0.982250E-05     
  4      0.133150E+03          -0.624400E-04     
  5      0.578170E+02          -0.308250E-03     
  6      0.259540E+02          -0.125880E-02     
  7      0.118990E+02          -0.186120E-02     
  8      0.474990E+01           0.112090E-01     
  9      0.206880E+01           0.835410E-01     
 10      0.877790E+00           0.134660E+00     
S   1
  1      0.249510E+00           1.0000000        
S   1
  1      0.114620E+00           1.0000000        
S   1
  1      0.481930E-01           1.0000000        
P   9
  1      0.201970E+04           0.121560E-03     
  2      0.478630E+03           0.106070E-02     
  3      0.155020E+03           0.593650E-02     
  4      0.579040E+02           0.253820E-01     
  5      0.241400E+02           0.761880E-01     
  6      0.107890E+02           0.179970E+00     
  7      0.497300E+01           0.302750E+00     
  8      0.231610E+01           0.344780E+00     
  9      0.107910E+01           0.237630E+00     
P   9
  1      0.478630E+03           0.542360E-04     
  2      0.155020E+03          -0.376470E-04     
  3      0.579040E+02           0.893640E-03     
  4      0.241400E+02          -0.359030E-02     
  5      0.107890E+02          -0.368970E-02     
  6      0.497300E+01          -0.540690E-01     
  7      0.231610E+01          -0.333730E-01     
  8      0.107910E+01           0.454730E-02     
  9      0.491590E+00           0.870540E+00     
P   1
  1      0.204820E+00           1.0000000        
P   1
  1      0.792560E-01           1.0000000        
P   1
  1      0.289280E-01           1.0000000        
D   1
  1      0.560000E+01           1.0000000        
D   1
  1      0.147000E+01           1.0000000        
D   1
  1      0.440000E+00           1.0000000        
D   1
  1      0.160000E+00           1.0000000        
F   1
  1      0.960000E+00           1.0000000        
F   1
  1      0.320000E+00           1.0000000        
G   1
  1      0.580000E+00           1.0000000


name: pc-3
description: N/A
elt: Si
data:
SILICON
S   12
  1      0.877450E+06           0.133960E-04     
  2      0.131450E+06           0.104070E-03     
  3      0.299290E+05           0.546780E-03     
  4      0.848020E+04           0.230100E-02     
  5      0.276720E+04           0.830540E-02     
  6      0.999400E+03           0.263220E-01     
  7      0.390140E+03           0.730330E-01     
  8      0.161910E+03           0.170100E+00     
  9      0.703040E+02           0.308910E+00     
 10      0.315790E+02           0.354730E+00     
 11      0.144800E+02           0.188720E+00     
 12      0.583830E+01           0.219530E-01     
S   10
  1      0.848020E+04          -0.422290E-05     
  2      0.276720E+04          -0.633560E-05     
  3      0.999400E+03          -0.169100E-03     
  4      0.390140E+03          -0.737150E-03     
  5      0.161910E+03          -0.544610E-02     
  6      0.703040E+02          -0.200100E-01     
  7      0.315790E+02          -0.613730E-01     
  8      0.144800E+02          -0.490020E-01     
  9      0.583830E+01           0.176270E+00     
 10      0.259460E+01           0.300800E+00     
S   10
  1      0.276720E+04          -0.118300E-05     
  2      0.999400E+03          -0.103490E-04     
  3      0.390140E+03          -0.743220E-04     
  4      0.161910E+03          -0.437130E-03     
  5      0.703040E+02          -0.193740E-02     
  6      0.315790E+02          -0.585630E-02     
  7      0.144800E+02          -0.683610E-02     
  8      0.583830E+01           0.278700E-01     
  9      0.259460E+01           0.127670E+00     
 10      0.112500E+01           0.174220E+00     
S   1
  1      0.353560E+00           1.0000000        
S   1
  1      0.161600E+00           1.0000000        
S   1
  1      0.672610E-01           1.0000000        
P   9
  1      0.230310E+04           0.131050E-03     
  2      0.545840E+03           0.114650E-02     
  3      0.177050E+03           0.636520E-02     
  4      0.663770E+02           0.271970E-01     
  5      0.276010E+02           0.819250E-01     
  6      0.123430E+02           0.191470E+00     
  7      0.568940E+01           0.315830E+00     
  8      0.264060E+01           0.351830E+00     
  9      0.120940E+01           0.212920E+00     
P   9
  1      0.545840E+03           0.612000E-05     
  2      0.177050E+03          -0.590220E-05     
  3      0.663770E+02           0.864530E-04     
  4      0.276010E+02          -0.530490E-03     
  5      0.123430E+02          -0.890380E-03     
  6      0.568940E+01          -0.798250E-02     
  7      0.264060E+01          -0.376310E-02     
  8      0.120940E+01           0.107870E-01     
  9      0.520130E+00           0.181860E+00     
P   1
  1      0.232560E+00           1.0000000        
P   1
  1      0.981410E-01           1.0000000        
P   1
  1      0.383600E-01           1.0000000        
D   1
  1      0.666000E+01           1.0000000        
D   1
  1      0.175000E+01           1.0000000        
D   1
  1      0.520000E+00           1.0000000        
D   1
  1      0.190000E+00           1.0000000        
F   1
  1      0.115000E+01           1.0000000        
F   1
  1      0.380000E+00           1.0000000        
G   1
  1      0.650000E+00           1.0000000


name: pc-3
description: N/A
elt: P
data:
PHOSPHORUS
S   12
  1      0.106370E+07           0.125090E-04     
  2      0.160000E+06           0.966710E-04     
  3      0.365130E+05           0.506820E-03     
  4      0.103590E+05           0.213100E-02     
  5      0.338280E+04           0.769250E-02     
  6      0.122230E+04           0.244210E-01     
  7      0.477300E+03           0.681220E-01     
  8      0.198090E+03           0.160690E+00     
  9      0.859940E+02           0.298670E+00     
 10      0.386270E+02           0.358780E+00     
 11      0.176880E+02           0.206160E+00     
 12      0.725510E+01           0.273860E-01     
S   10
  1      0.103590E+05          -0.345020E-05     
  2      0.338280E+04          -0.534270E-05     
  3      0.122230E+04          -0.138140E-03     
  4      0.477300E+03          -0.608820E-03     
  5      0.198090E+03          -0.450640E-02     
  6      0.859940E+02          -0.170710E-01     
  7      0.386270E+02          -0.539540E-01     
  8      0.176880E+02          -0.514940E-01     
  9      0.725510E+01           0.137580E+00     
 10      0.326990E+01           0.275250E+00     
S   10
  1      0.338280E+04          -0.175570E-05     
  2      0.122230E+04          -0.158010E-04     
  3      0.477300E+03          -0.113530E-03     
  4      0.198090E+03          -0.673290E-03     
  5      0.859940E+02          -0.303140E-02     
  6      0.386270E+02          -0.922920E-02     
  7      0.176880E+02          -0.119360E-01     
  8      0.725510E+01           0.357250E-01     
  9      0.326990E+01           0.158750E+00     
 10      0.143130E+01           0.212360E+00     
S   1
  1      0.470470E+00           1.0000000        
S   1
  1      0.212890E+00           1.0000000        
S   1
  1      0.877420E-01           1.0000000        
P   9
  1      0.276220E+04           0.126180E-03     
  2      0.654780E+03           0.110480E-02     
  3      0.212580E+03           0.614830E-02     
  4      0.798950E+02           0.263070E-01     
  5      0.333660E+02           0.798660E-01     
  6      0.149860E+02           0.188400E+00     
  7      0.696800E+01           0.313620E+00     
  8      0.328180E+01           0.353260E+00     
  9      0.152470E+01           0.213660E+00     
P   9
  1      0.654780E+03           0.595920E-05     
  2      0.212580E+03          -0.680860E-05     
  3      0.798950E+02           0.745130E-04     
  4      0.333660E+02          -0.606640E-03     
  5      0.149860E+02          -0.126040E-02     
  6      0.696800E+01          -0.947190E-02     
  7      0.328180E+01          -0.440140E-02     
  8      0.152470E+01           0.124660E-01     
  9      0.669240E+00           0.213430E+00     
P   1
  1      0.299290E+00           1.0000000        
P   1
  1      0.128110E+00           1.0000000        
P   1
  1      0.509920E-01           1.0000000        
D   1
  1      0.771000E+01           1.0000000        
D   1
  1      0.203000E+01           1.0000000        
D   1
  1      0.600000E+00           1.0000000        
D   1
  1      0.220000E+00           1.0000000        
F   1
  1      0.134000E+01           1.0000000        
F   1
  1      0.450000E+00           1.0000000        
G   1
  1      0.720000E+00           1.0000000


name: pc-3
description: N/A
elt: S
data:
SULFUR
S   12
  1      0.125040E+07           0.120230E-04     
  2      0.188080E+06           0.929350E-04     
  3      0.429180E+05           0.487200E-03     
  4      0.121790E+05           0.204790E-02     
  5      0.397870E+04           0.738970E-02     
  6      0.143810E+04           0.234810E-01     
  7      0.561670E+03           0.656850E-01     
  8      0.233110E+03           0.155970E+00     
  9      0.101220E+03           0.293220E+00     
 10      0.454930E+02           0.360110E+00     
 11      0.208470E+02           0.215060E+00     
 12      0.864920E+01           0.307820E-01     
S   10
  1      0.121790E+05          -0.303830E-05     
  2      0.397870E+04          -0.464560E-05     
  3      0.143810E+04          -0.123160E-03     
  4      0.561670E+03          -0.547230E-03     
  5      0.233110E+03          -0.407020E-02     
  6      0.101220E+03          -0.156520E-01     
  7      0.454930E+02          -0.503090E-01     
  8      0.208470E+02          -0.515170E-01     
  9      0.864920E+01           0.118230E+00     
 10      0.394560E+01           0.256280E+00     
S   10
  1      0.397870E+04          -0.230670E-05     
  2      0.143810E+04          -0.195560E-04     
  3      0.561670E+03          -0.143860E-03     
  4      0.233110E+03          -0.844190E-03     
  5      0.101220E+03          -0.386210E-02     
  6      0.454930E+02          -0.118130E-01     
  7      0.208470E+02          -0.161140E-01     
  8      0.864920E+01           0.414920E-01     
  9      0.394560E+01           0.185170E+00     
 10      0.174720E+01           0.239630E+00     
S   1
  1      0.599530E+00           1.0000000        
S   1
  1      0.271270E+00           1.0000000        
S   1
  1      0.110800E+00           1.0000000        
P   9
  1      0.328580E+04           0.120620E-03     
  2      0.778930E+03           0.105870E-02     
  3      0.252760E+03           0.591910E-02     
  4      0.951000E+02           0.254050E-01     
  5      0.398200E+02           0.778590E-01     
  6      0.179250E+02           0.185780E+00     
  7      0.836990E+01           0.313470E+00     
  8      0.396550E+01           0.357180E+00     
  9      0.185400E+01           0.211790E+00     
P   9
  1      0.778930E+03           0.423970E-05     
  2      0.252760E+03          -0.743330E-05     
  3      0.951000E+02           0.277260E-04     
  4      0.398200E+02          -0.650280E-03     
  5      0.179250E+02          -0.189330E-02     
  6      0.836990E+01          -0.101910E-01     
  7      0.396550E+01          -0.762910E-02     
  8      0.185400E+01           0.210320E-01     
  9      0.819710E+00           0.243470E+00     
P   1
  1      0.361170E+00           1.0000000        
P   1
  1      0.150970E+00           1.0000000        
P   1
  1      0.596200E-01           1.0000000        
D   1
  1      0.876000E+01           1.0000000        
D   1
  1      0.230000E+01           1.0000000        
D   1
  1      0.680000E+00           1.0000000        
D   1
  1      0.250000E+00           1.0000000        
F   1
  1      0.153000E+01           1.0000000        
F   1
  1      0.510000E+00           1.0000000        
G   1
  1      0.790000E+00           1.0000000


name: pc-3
description: N/A
elt: Cl
data:
CHLORINE
S   12
  1      0.146110E+07           0.115340E-04     
  2      0.219590E+06           0.892350E-04     
  3      0.500850E+05           0.468110E-03     
  4      0.142060E+05           0.196920E-02     
  5      0.463890E+04           0.711120E-02     
  6      0.167630E+04           0.226250E-01     
  7      0.654510E+03           0.634880E-01     
  8      0.271530E+03           0.151730E+00     
  9      0.117870E+03           0.288260E+00     
 10      0.529840E+02           0.361130E+00     
 11      0.242920E+02           0.223030E+00     
 12      0.101840E+02           0.340310E-01     
S   10
  1      0.142060E+05          -0.270930E-05     
  2      0.463890E+04          -0.431910E-05     
  3      0.167630E+04          -0.109070E-03     
  4      0.654510E+03          -0.488530E-03     
  5      0.271530E+03          -0.363270E-02     
  6      0.117870E+03          -0.141420E-01     
  7      0.529840E+02          -0.461670E-01     
  8      0.242920E+02          -0.501070E-01     
  9      0.101840E+02           0.999990E-01     
 10      0.469280E+01           0.237500E+00     
S   10
  1      0.463890E+04          -0.287400E-05     
  2      0.167630E+04          -0.249490E-04     
  3      0.654510E+03          -0.182720E-03     
  4      0.271530E+03          -0.108210E-02     
  5      0.117870E+03          -0.498460E-02     
  6      0.529840E+02          -0.154140E-01     
  7      0.242920E+02          -0.217740E-01     
  8      0.101840E+02           0.488810E-01     
  9      0.469280E+01           0.218080E+00     
 10      0.209740E+01           0.274120E+00     
S   1
  1      0.748670E+00           1.0000000        
S   1
  1      0.336130E+00           1.0000000        
S   1
  1      0.135730E+00           1.0000000        
P   9
  1      0.384570E+04           0.116530E-03     
  2      0.911230E+03           0.102500E-02     
  3      0.295640E+03           0.574810E-02     
  4      0.111400E+03           0.247000E-01     
  5      0.467670E+02           0.762630E-01     
  6      0.211060E+02           0.183430E+00     
  7      0.990580E+01           0.312190E+00     
  8      0.473470E+01           0.358360E+00     
  9      0.223640E+01           0.211760E+00     
P   9
  1      0.911230E+03           0.357610E-05     
  2      0.295640E+03          -0.777680E-05     
  3      0.111400E+03           0.676660E-05     
  4      0.467670E+02          -0.693940E-03     
  5      0.211060E+02          -0.225630E-02     
  6      0.990580E+01          -0.110180E-01     
  7      0.473470E+01          -0.936630E-02     
  8      0.223640E+01           0.251710E-01     
  9      0.100710E+01           0.255740E+00     
P   1
  1      0.443690E+00           1.0000000        
P   1
  1      0.184880E+00           1.0000000        
P   1
  1      0.732680E-01           1.0000000        
D   1
  1      0.981000E+01           1.0000000        
D   1
  1      0.258000E+01           1.0000000        
D   1
  1      0.760000E+00           1.0000000        
D   1
  1      0.280000E+00           1.0000000        
F   1
  1      0.172000E+01           1.0000000        
F   1
  1      0.570000E+00           1.0000000        
G   1
  1      0.860000E+00           1.0000000


name: pc-3
description: N/A
elt: Ar
data:
ARGON
S   12
  1      0.170220E+07           0.551030E-05     
  2      0.254910E+06           0.428350E-04     
  3      0.580110E+05           0.225230E-03     
  4      0.164310E+05           0.948870E-03     
  5      0.536050E+04           0.343160E-02     
  6      0.193540E+04           0.109390E-01     
  7      0.755090E+03           0.307910E-01     
  8      0.313080E+03           0.739870E-01     
  9      0.135880E+03           0.141870E+00     
 10      0.610920E+02           0.180890E+00     
 11      0.280240E+02           0.115080E+00     
 12      0.118600E+02           0.185790E-01     
S   10
  1      0.164310E+05          -0.120360E-05     
  2      0.536050E+04          -0.200190E-05     
  3      0.193540E+04          -0.494290E-04     
  4      0.755090E+03          -0.224480E-03     
  5      0.313080E+03          -0.166520E-02     
  6      0.135880E+03          -0.657890E-02     
  7      0.610920E+02          -0.217340E-01     
  8      0.280240E+02          -0.248510E-01     
  9      0.118600E+02           0.435860E-01     
 10      0.551170E+01           0.113360E+00     
S   10
  1      0.536050E+04          -0.162490E-05     
  2      0.193540E+04          -0.142250E-04     
  3      0.755090E+03          -0.104270E-03     
  4      0.313080E+03          -0.620780E-03     
  5      0.135880E+03          -0.288130E-02     
  6      0.610920E+02          -0.902010E-02     
  7      0.280240E+02          -0.132260E-01     
  8      0.118600E+02           0.263290E-01     
  9      0.551170E+01           0.121050E+00     
 10      0.248220E+01           0.151700E+00     
S   1
  1      0.917610E+00           1.0000000        
S   1
  1      0.407030E+00           1.0000000        
S   1
  1      0.162380E+00           1.0000000        
P   9
  1      0.441550E+04           0.572820E-04     
  2      0.104630E+04           0.504270E-03     
  3      0.339540E+03           0.283210E-02     
  4      0.128100E+03           0.121860E-01     
  5      0.538230E+02           0.379240E-01     
  6      0.243070E+02           0.917620E-01     
  7      0.114400E+02           0.156560E+00     
  8      0.551320E+01           0.178750E+00     
  9      0.263310E+01           0.104470E+00     
P   9
  1      0.104630E+04           0.147880E-05     
  2      0.339540E+03          -0.422610E-05     
  3      0.128100E+03          -0.694260E-05     
  4      0.538230E+02          -0.373310E-03     
  5      0.243070E+02          -0.132140E-02     
  6      0.114400E+02          -0.599320E-02     
  7      0.551320E+01          -0.517140E-02     
  8      0.263310E+01           0.141100E-01     
  9      0.121090E+01           0.132760E+00     
P   1
  1      0.534110E+00           1.0000000        
P   1
  1      0.223140E+00           1.0000000        
P   1
  1      0.887920E-01           1.0000000        
D   1
  1      0.108600E+02           1.0000000        
D   1
  1      0.286000E+01           1.0000000        
D   1
  1      0.840000E+00           1.0000000        
D   1
  1      0.310000E+00           1.0000000        
F   1
  1      0.191000E+01           1.0000000        
F   1
  1      0.630000E+00           1.0000000        
G   1
  1      0.930000E+00           1.0000000


name: pc-2
description: N/A
elt: H
data:
HYDROGEN
S   4
  1      0.754230E+02           0.240650E-02     
  2      0.113500E+02           0.184870E-01     
  3      0.259930E+01           0.897420E-01     
  4      0.735130E+00           0.281110E+00     
S   1
  1      0.231670E+00           1.0000000        
S   1
  1      0.741470E-01           1.0000000        
P   1
  1      0.160000E+01           1.0000000        
P   1
  1      0.450000E+00           1.0000000        
D   1
  1      0.125000E+01           1.0000000


name: pc-2
description: N/A
elt: He
data:
HELIUM
S   4
  1      0.221770E+03           0.144090E-02     
  2      0.333750E+02           0.108940E-01     
  3      0.761140E+01           0.501890E-01     
  4      0.210890E+01           0.142900E+00     
S   1
  1      0.628780E+00           1.0000000        
S   1
  1      0.184690E+00           1.0000000        
P   1
  1      0.240000E+01           1.0000000        
P   1
  1      0.680000E+00           1.0000000        
D   1
  1      0.180000E+01           1.0000000


name: pc-2
description: N/A
elt: Li
data:
LITHIUM
S   7
  1      0.150250E+04           0.761370E-03     
  2      0.225510E+03           0.587120E-02     
  3      0.513750E+02           0.297430E-01     
  4      0.145470E+02           0.109590E+00     
  5      0.466450E+01           0.280000E+00     
  6      0.160080E+01           0.441630E+00     
  7      0.552620E+00           0.299220E+00     
S   7
  1      0.225510E+03           0.210450E-04     
  2      0.513750E+02          -0.121770E-03     
  3      0.145470E+02          -0.100880E-03     
  4      0.466450E+01          -0.844260E-02     
  5      0.160080E+01          -0.243940E-01     
  6      0.552620E+00          -0.907180E-01     
  7      0.103660E+00           0.306590E+00     
S   1
  1      0.474420E-01           1.0000000        
S   1
  1      0.197900E-01           1.0000000        
P   3
  1      0.530000E+01           0.554503E-02     
  2      0.115000E+01           0.550912E-01     
  3      0.290000E+00           0.875615E-01     
P   1
  1      0.900000E-01           1.0000000        
D   1
  1      0.260000E+00           1.0000000


name: pc-2
description: N/A
elt: Be
data:
BERYLLIUM
S   7
  1      0.306730E+04           0.326830E-03     
  2      0.460240E+03           0.252340E-02     
  3      0.104800E+03           0.128670E-01     
  4      0.296570E+02           0.486070E-01     
  5      0.953650E+01           0.131110E+00     
  6      0.331060E+01           0.221240E+00     
  7      0.118040E+01           0.163450E+00     
S   7
  1      0.460240E+03           0.138940E-05     
  2      0.104800E+03          -0.364310E-04     
  3      0.296570E+02          -0.331960E-03     
  4      0.953650E+01          -0.366180E-02     
  5      0.331060E+01          -0.175400E-01     
  6      0.118040E+01          -0.409050E-01     
  7      0.268710E+00           0.113570E+00     
S   1
  1      0.117740E+00           1.0000000        
S   1
  1      0.446850E-01           1.0000000        
P   3
  1      0.824000E+01           0.111471E-01     
  2      0.179000E+01           0.805494E-01     
  3      0.450000E+00           0.255744E+00     
P   1
  1      0.140000E+00           1.0000000        
D   1
  1      0.390000E+00           1.0000000


name: pc-2
description: N/A
elt: B
data:
BORON
S   7
  1      0.522040E+04           0.595300E-03     
  2      0.783190E+03           0.459910E-02     
  3      0.178310E+03           0.235300E-01     
  4      0.504690E+02           0.900150E-01     
  5      0.162850E+02           0.249880E+00     
  6      0.568850E+01           0.442370E+00     
  7      0.204950E+01           0.345360E+00     
S   7
  1      0.783190E+03           0.165880E-05     
  2      0.178310E+03          -0.685210E-04     
  3      0.504690E+02          -0.687510E-03     
  4      0.162850E+02          -0.736900E-02     
  5      0.568850E+01          -0.370980E-01     
  6      0.204950E+01          -0.869860E-01     
  7      0.514730E+00           0.213610E+00     
S   1
  1      0.215560E+00           1.0000000        
S   1
  1      0.774570E-01           1.0000000        
P   4
  1      0.218100E+02           0.588410E-02     
  2      0.489300E+01           0.417980E-01     
  3      0.139760E+01           0.155670E+00     
  4      0.477470E+00           0.359970E+00     
P   1
  1      0.164190E+00           1.0000000        
P   1
  1      0.540040E-01           1.0000000        
D   1
  1      0.105000E+01           1.0000000        
D   1
  1      0.350000E+00           1.0000000        
F   1
  1      0.870000E+00           1.0000000


name: pc-2
description: N/A
elt: C
data:
CARBON
S   7
  1      0.785710E+04           0.568250E-03     
  2      0.117870E+04           0.439150E-02     
  3      0.268320E+03           0.225040E-01     
  4      0.759480E+02           0.866530E-01     
  5      0.245590E+02           0.244050E+00     
  6      0.862120E+01           0.441480E+00     
  7      0.312780E+01           0.353320E+00     
S   7
  1      0.117870E+04          -0.594920E-06     
  2      0.268320E+03          -0.627480E-04     
  3      0.759480E+02          -0.757730E-03     
  4      0.245590E+02          -0.733080E-02     
  5      0.862120E+01          -0.389320E-01     
  6      0.312780E+01          -0.889080E-01     
  7      0.822020E+00           0.216890E+00     
S   1
  1      0.330170E+00           1.0000000        
S   1
  1      0.114630E+00           1.0000000        
P   4
  1      0.337750E+02           0.602940E-02     
  2      0.767660E+01           0.432280E-01     
  3      0.223570E+01           0.163010E+00     
  4      0.764470E+00           0.365040E+00     
P   1
  1      0.262320E+00           1.0000000        
P   1
  1      0.846380E-01           1.0000000        
D   1
  1      0.140000E+01           1.0000000        
D   1
  1      0.450000E+00           1.0000000        
F   1
  1      0.950000E+00           1.0000000


name: pc-2
description: N/A
elt: N
data:
NITROGEN
S   7
  1      0.111010E+05           0.545700E-03     
  2      0.166530E+04           0.421810E-02     
  3      0.379080E+03           0.216450E-01     
  4      0.107300E+03           0.837760E-01     
  5      0.347470E+02           0.238810E+00     
  6      0.122490E+02           0.439940E+00     
  7      0.447430E+01           0.363640E+00     
S   7
  1      0.166530E+04          -0.150060E-05     
  2      0.379080E+03          -0.587530E-04     
  3      0.107300E+03          -0.774530E-03     
  4      0.347470E+02          -0.721610E-02     
  5      0.122490E+02          -0.393380E-01     
  6      0.447430E+01          -0.906110E-01     
  7      0.124040E+01           0.198820E+00     
S   1
  1      0.487430E+00           1.0000000        
S   1
  1      0.164840E+00           1.0000000        
P   4
  1      0.479340E+02           0.617060E-02     
  2      0.109990E+02           0.442600E-01     
  3      0.324720E+01           0.168250E+00     
  4      0.111140E+01           0.368480E+00     
P   1
  1      0.379880E+00           1.0000000        
P   1
  1      0.120680E+00           1.0000000        
D   1
  1      0.180000E+01           1.0000000        
D   1
  1      0.550000E+00           1.0000000        
F   1
  1      0.102000E+01           1.0000000


name: pc-2
description: N/A
elt: O
data:
OXYGEN
S   7
  1      0.147820E+05           0.535190E-03     
  2      0.221730E+04           0.413750E-02     
  3      0.504740E+03           0.212450E-01     
  4      0.142870E+03           0.824530E-01     
  5      0.463000E+02           0.236710E+00     
  6      0.163370E+02           0.440390E+00     
  7      0.598280E+01           0.364650E+00     
S   7
  1      0.221730E+04          -0.192750E-05     
  2      0.504740E+03          -0.579640E-04     
  3      0.142870E+03          -0.794940E-03     
  4      0.463000E+02          -0.731250E-02     
  5      0.163370E+02          -0.405740E-01     
  6      0.598280E+01          -0.915940E-01     
  7      0.167180E+01           0.209400E+00     
S   1
  1      0.646620E+00           1.0000000        
S   1
  1      0.216690E+00           1.0000000        
P   4
  1      0.604240E+02           0.689490E-02     
  2      0.139350E+02           0.490050E-01     
  3      0.415310E+01           0.182550E+00     
  4      0.141580E+01           0.376330E+00     
P   1
  1      0.475490E+00           1.0000000        
P   1
  1      0.145290E+00           1.0000000        
D   1
  1      0.220000E+01           1.0000000        
D   1
  1      0.650000E+00           1.0000000        
F   1
  1      0.110000E+01           1.0000000


name: pc-2
description: N/A
elt: F
data:
FLUORINE
S   7
  1      0.191270E+05           0.522500E-03     
  2      0.286890E+04           0.404000E-02     
  3      0.653040E+03           0.207590E-01     
  4      0.184850E+03           0.808000E-01     
  5      0.599490E+02           0.233620E+00     
  6      0.211900E+02           0.439650E+00     
  7      0.778460E+01           0.370410E+00     
S   7
  1      0.286890E+04          -0.225760E-05     
  2      0.653040E+03          -0.566400E-04     
  3      0.184850E+03          -0.797820E-03     
  4      0.599490E+02          -0.727130E-02     
  5      0.211900E+02          -0.408310E-01     
  6      0.778460E+01          -0.929310E-01     
  7      0.223050E+01           0.202280E+00     
S   1
  1      0.854090E+00           1.0000000        
S   1
  1      0.283360E+00           1.0000000        
P   4
  1      0.776390E+02           0.703130E-02     
  2      0.179650E+02           0.501370E-01     
  3      0.540050E+01           0.185530E+00     
  4      0.184230E+01           0.375460E+00     
P   1
  1      0.615320E+00           1.0000000        
P   1
  1      0.184890E+00           1.0000000        
D   1
  1      0.280000E+01           1.0000000        
D   1
  1      0.800000E+00           1.0000000        
F   1
  1      0.120000E+01           1.0000000


name: pc-2
description: N/A
elt: Ne
data:
NEON
S   7
  1      0.238800E+05           0.258350E-03     
  2      0.358170E+04           0.199770E-02     
  3      0.815270E+03           0.102690E-01     
  4      0.230770E+03           0.400360E-01     
  5      0.748840E+02           0.116190E+00     
  6      0.265180E+02           0.219590E+00     
  7      0.976920E+01           0.186080E+00     
S   7
  1      0.358170E+04          -0.765350E-05     
  2      0.815270E+03          -0.136380E-03     
  3      0.230770E+03          -0.206690E-02     
  4      0.748840E+02          -0.181400E-01     
  5      0.265180E+02          -0.103790E+00     
  6      0.976920E+01          -0.232830E+00     
  7      0.283050E+01           0.507980E+00     
S   1
  1      0.107400E+01           1.0000000        
S   1
  1      0.354000E+00           1.0000000        
P   4
  1      0.971060E+02           0.356680E-02     
  2      0.225430E+02           0.254670E-01     
  3      0.681730E+01           0.940160E-01     
  4      0.232630E+01           0.187960E+00     
P   1
  1      0.774250E+00           1.0000000        
P   1
  1      0.230260E+00           1.0000000        
D   1
  1      0.300000E+01           1.0000000        
D   1
  1      0.850000E+00           1.0000000        
F   1
  1      0.130000E+01           1.0000000


name: pc-2
description: N/A
elt: Na
data:
SODIUM
S   9
  1      0.644740E+05           0.190200E-03     
  2      0.966750E+04           0.147490E-02     
  3      0.220080E+04           0.767780E-02     
  4      0.623260E+03           0.313330E-01     
  5      0.203120E+03           0.102690E+00     
  6      0.729440E+02           0.255980E+00     
  7      0.280260E+02           0.415170E+00     
  8      0.110550E+02           0.304730E+00     
  9      0.354900E+01           0.411460E-01     
S   8
  1      0.220080E+04          -0.138810E-04     
  2      0.623260E+03          -0.142420E-03     
  3      0.203120E+03          -0.181590E-02     
  4      0.729440E+02          -0.120930E-01     
  5      0.280260E+02          -0.568230E-01     
  6      0.110550E+02          -0.101100E+00     
  7      0.354900E+01           0.224980E+00     
  8      0.140820E+01           0.517110E+00     
S   9
  1      0.220080E+04           0.450010E-05     
  2      0.623260E+03           0.544690E-04     
  3      0.203120E+03           0.610580E-03     
  4      0.729440E+02           0.417240E-02     
  5      0.280260E+02           0.182310E-01     
  6      0.110550E+02           0.290170E-01     
  7      0.354900E+01          -0.529320E-01     
  8      0.140820E+01           0.169650E+00     
  9      0.511480E+00           0.884780E+00     
S   1
  1      0.695340E-01           1.0000000        
S   1
  1      0.251200E-01           1.0000000        
P   7
  1      0.230530E+03           0.254200E-02     
  2      0.542010E+02           0.197680E-01     
  3      0.174020E+02           0.834800E-01     
  4      0.631520E+01           0.232820E+00     
  5      0.240840E+01           0.382160E+00     
  6      0.902490E+00           0.379850E+00     
  7      0.314500E+00           0.162870E+00     
P   1
  1      0.121000E+00           1.0000000        
P   1
  1      0.390000E-01           1.0000000        
D   1
  1      0.240000E+00           1.0000000


name: pc-2
description: N/A
elt: Mg
data:
MAGNESIUM
S   9
  1      0.810170E+05           0.890530E-04     
  2      0.121430E+05           0.690880E-03     
  3      0.276380E+04           0.359990E-02     
  4      0.782580E+03           0.147210E-01     
  5      0.255030E+03           0.485720E-01     
  6      0.916230E+02           0.122790E+00     
  7      0.352450E+02           0.205060E+00     
  8      0.139600E+02           0.159130E+00     
  9      0.474220E+01           0.250990E-01     
S   9
  1      0.121430E+05          -0.521340E-06     
  2      0.276380E+04          -0.407530E-05     
  3      0.782580E+03          -0.824830E-04     
  4      0.255030E+03          -0.707270E-03     
  5      0.916230E+02          -0.549130E-02     
  6      0.352450E+02          -0.238590E-01     
  7      0.139600E+02          -0.498270E-01     
  8      0.474220E+01           0.834970E-01     
  9      0.192840E+01           0.195630E+00     
S   9
  1      0.276380E+04          -0.119100E-04     
  2      0.782580E+03          -0.147810E-03     
  3      0.255030E+03          -0.168720E-02     
  4      0.916230E+02          -0.118640E-01     
  5      0.352450E+02          -0.559830E-01     
  6      0.139600E+02          -0.113110E+00     
  7      0.474220E+01           0.187890E+00     
  8      0.192840E+01           0.717520E+00     
  9      0.724240E+00           0.539560E+00     
S   1
  1      0.123530E+00           1.0000000        
S   1
  1      0.430320E-01           1.0000000        
P   7
  1      0.309050E+03           0.111300E-02     
  2      0.728940E+02           0.875690E-02     
  3      0.234940E+02           0.382540E-01     
  4      0.856190E+01           0.110950E+00     
  5      0.330680E+01           0.191740E+00     
  6      0.126940E+01           0.194570E+00     
  7      0.461060E+00           0.782040E-01     
P   1
  1      0.177000E+00           1.0000000        
P   1
  1      0.570000E-01           1.0000000        
D   1
  1      0.300000E+00           1.0000000


name: pc-2
description: N/A
elt: Al
data:
ALUMINUM
S   9
  1      0.997410E+05           0.168090E-03     
  2      0.149490E+05           0.130410E-02     
  3      0.340250E+04           0.679790E-02     
  4      0.963530E+03           0.278400E-01     
  5      0.314050E+03           0.923580E-01     
  6      0.112880E+03           0.236330E+00     
  7      0.434740E+02           0.404840E+00     
  8      0.172920E+02           0.329920E+00     
  9      0.616220E+01           0.585210E-01     
S   9
  1      0.149490E+05          -0.480000E-06     
  2      0.340250E+04          -0.204740E-05     
  3      0.963530E+03          -0.557330E-04     
  4      0.314050E+03          -0.418530E-03     
  5      0.112880E+03          -0.348130E-02     
  6      0.434740E+02          -0.148640E-01     
  7      0.172920E+02          -0.340120E-01     
  8      0.616220E+01           0.438960E-01     
  9      0.252260E+01           0.119580E+00     
S   9
  1      0.340250E+04          -0.555800E-05     
  2      0.963530E+03          -0.690470E-04     
  3      0.314050E+03          -0.790850E-03     
  4      0.112880E+03          -0.564140E-02     
  5      0.434740E+02          -0.272880E-01     
  6      0.172920E+02          -0.595380E-01     
  7      0.616220E+01           0.723930E-01     
  8      0.252260E+01           0.412260E+00     
  9      0.968740E+00           0.391650E+00     
S   1
  1      0.192510E+00           1.0000000        
S   1
  1      0.678130E-01           1.0000000        
P   7
  1      0.579710E+03           0.105610E-02     
  2      0.137540E+03           0.863350E-02     
  3      0.440670E+02           0.432270E-01     
  4      0.161480E+02           0.141680E+00     
  5      0.648880E+01           0.303520E+00     
  6      0.266320E+01           0.403890E+00     
  7      0.107920E+01           0.286420E+00     
P   7
  1      0.137540E+03           0.296660E-04     
  2      0.440670E+02          -0.105930E-03     
  3      0.161480E+02          -0.173700E-03     
  4      0.648880E+01          -0.443150E-02     
  5      0.266320E+01          -0.441340E-02     
  6      0.107920E+01          -0.107230E-02     
  7      0.397710E+00           0.176500E+00     
P   1
  1      0.134750E+00           1.0000000        
P   1
  1      0.421850E-01           1.0000000        
D   1
  1      0.147000E+01           1.0000000        
D   1
  1      0.330000E+00           1.0000000        
F   1
  1      0.480000E+00           1.0000000


name: pc-2
description: N/A
elt: Si
data:
SILICON
S   9
  1      0.120040E+06           0.160750E-03     
  2      0.179910E+05           0.124720E-02     
  3      0.409480E+04           0.650400E-02     
  4      0.115960E+04           0.266650E-01     
  5      0.378000E+03           0.888160E-01     
  6      0.135930E+03           0.229320E+00     
  7      0.524110E+02           0.400250E+00     
  8      0.209270E+02           0.338280E+00     
  9      0.771300E+01           0.655120E-01     
S   9
  1      0.179910E+05          -0.684030E-06     
  2      0.409480E+04          -0.211240E-05     
  3      0.115960E+04          -0.691570E-04     
  4      0.378000E+03          -0.480800E-03     
  5      0.135930E+03          -0.416940E-02     
  6      0.524110E+02          -0.176740E-01     
  7      0.209270E+02          -0.428910E-01     
  8      0.771300E+01           0.453680E-01     
  9      0.316040E+01           0.139040E+00     
S   9
  1      0.409480E+04          -0.398970E-05     
  2      0.115960E+04          -0.502030E-04     
  3      0.378000E+03          -0.575530E-03     
  4      0.135930E+03          -0.415240E-02     
  5      0.524110E+02          -0.204370E-01     
  6      0.209270E+02          -0.469980E-01     
  7      0.771300E+01           0.439860E-01     
  8      0.316040E+01           0.339570E+00     
  9      0.123480E+01           0.350380E+00     
S   1
  1      0.267750E+00           1.0000000        
S   1
  1      0.940670E-01           1.0000000        
P   7
  1      0.677130E+03           0.109250E-02     
  2      0.160670E+03           0.896010E-02     
  3      0.515850E+02           0.447440E-01     
  4      0.189480E+02           0.147480E+00     
  5      0.761630E+01           0.314800E+00     
  6      0.313170E+01           0.413390E+00     
  7      0.127030E+01           0.264400E+00     
P   7
  1      0.160670E+03           0.790140E-05     
  2      0.515850E+02          -0.136130E-03     
  3      0.189480E+02          -0.903780E-03     
  4      0.761630E+01          -0.558630E-02     
  5      0.313170E+01          -0.101410E-01     
  6      0.127030E+01           0.186610E-01     
  7      0.433320E+00           0.288900E+00     
P   1
  1      0.160880E+00           1.0000000        
P   1
  1      0.548830E-01           1.0000000        
D   1
  1      0.168000E+01           1.0000000        
D   1
  1      0.380000E+00           1.0000000        
F   1
  1      0.540000E+00           1.0000000


name: pc-2
description: N/A
elt: P
data:
PHOSPHORUS
S   9
  1      0.145680E+06           0.150160E-03     
  2      0.218360E+05           0.116500E-02     
  3      0.496990E+04           0.607980E-02     
  4      0.140730E+04           0.249680E-01     
  5      0.458780E+03           0.836370E-01     
  6      0.165080E+03           0.218630E+00     
  7      0.637440E+02           0.392340E+00     
  8      0.255980E+02           0.350380E+00     
  9      0.993070E+01           0.772870E-01     
S   9
  1      0.218360E+05          -0.105090E-05     
  2      0.496990E+04          -0.168010E-05     
  3      0.140730E+04          -0.876010E-04     
  4      0.458780E+03          -0.527450E-03     
  5      0.165080E+03          -0.495750E-02     
  6      0.637440E+02          -0.205350E-01     
  7      0.255980E+02          -0.550300E-01     
  8      0.993070E+01           0.415830E-01     
  9      0.396860E+01           0.170290E+00     
S   9
  1      0.496990E+04          -0.248630E-05     
  2      0.140730E+04          -0.309550E-04     
  3      0.458780E+03          -0.357760E-03     
  4      0.165080E+03          -0.261230E-02     
  5      0.637440E+02          -0.132040E-01     
  6      0.255980E+02          -0.328480E-01     
  7      0.993070E+01           0.181820E-01     
  8      0.396860E+01           0.257220E+00     
  9      0.155650E+01           0.306820E+00     
S   1
  1      0.354040E+00           1.0000000        
S   1
  1      0.123940E+00           1.0000000        
P   7
  1      0.826230E+03           0.102250E-02     
  2      0.196020E+03           0.844720E-02     
  3      0.629510E+02           0.426640E-01     
  4      0.232220E+02           0.142390E+00     
  5      0.938850E+01           0.310590E+00     
  6      0.389970E+01           0.416720E+00     
  7      0.160480E+01           0.266180E+00     
P   7
  1      0.196020E+03           0.410820E-05     
  2      0.629510E+02          -0.150570E-03     
  3      0.232220E+02          -0.111410E-02     
  4      0.938850E+01          -0.649420E-02     
  5      0.389970E+01          -0.124690E-01     
  6      0.160480E+01           0.234580E-01     
  7      0.560530E+00           0.322700E+00     
P   1
  1      0.211750E+00           1.0000000        
P   1
  1      0.734860E-01           1.0000000        
D   1
  1      0.189000E+01           1.0000000        
D   1
  1      0.430000E+00           1.0000000        
F   1
  1      0.600000E+00           1.0000000


name: pc-2
description: N/A
elt: S
data:
SULFUR
S   9
  1      0.172030E+06           0.143530E-03     
  2      0.257830E+05           0.111370E-02     
  3      0.586820E+04           0.581430E-02     
  4      0.166170E+04           0.239030E-01     
  5      0.541750E+03           0.803540E-01     
  6      0.195010E+03           0.211750E+00     
  7      0.753960E+02           0.386640E+00     
  8      0.304070E+02           0.357470E+00     
  9      0.121210E+02           0.861310E-01     
S   9
  1      0.257830E+05          -0.118620E-05     
  2      0.586820E+04          -0.123210E-05     
  3      0.166170E+04          -0.904800E-04     
  4      0.541750E+03          -0.501050E-03     
  5      0.195010E+03          -0.495100E-02     
  6      0.753960E+02          -0.202520E-01     
  7      0.304070E+02          -0.573880E-01     
  8      0.121210E+02           0.348470E-01     
  9      0.477770E+01           0.168330E+00     
S   9
  1      0.586820E+04          -0.219720E-05     
  2      0.166170E+04          -0.283670E-04     
  3      0.541750E+03          -0.325910E-03     
  4      0.195010E+03          -0.241310E-02     
  5      0.753960E+02          -0.123520E-01     
  6      0.304070E+02          -0.321190E-01     
  7      0.121210E+02           0.116110E-01     
  8      0.477770E+01           0.255420E+00     
  9      0.189060E+01           0.313840E+00     
S   1
  1      0.446860E+00           1.0000000        
S   1
  1      0.156210E+00           1.0000000        
P   7
  1      0.968120E+03           0.100480E-02     
  2      0.229700E+03           0.833130E-02     
  3      0.738330E+02           0.422600E-01     
  4      0.273120E+02           0.142060E+00     
  5      0.110740E+02           0.312560E+00     
  6      0.463070E+01           0.419330E+00     
  7      0.192990E+01           0.259240E+00     
P   7
  1      0.229700E+03          -0.806930E-05     
  2      0.738330E+02          -0.169430E-03     
  3      0.273120E+02          -0.152430E-02     
  4      0.110740E+02          -0.719930E-02     
  5      0.463070E+01          -0.161130E-01     
  6      0.192990E+01           0.342340E-01     
  7      0.687830E+00           0.355180E+00     
P   1
  1      0.256630E+00           1.0000000        
P   1
  1      0.872510E-01           1.0000000        
D   1
  1      0.210000E+01           1.0000000        
D   1
  1      0.480000E+00           1.0000000        
F   1
  1      0.660000E+00           1.0000000


name: pc-2
description: N/A
elt: Cl
data:
CHLORINE
S   9
  1      0.201150E+06           0.137530E-03     
  2      0.301460E+05           0.106710E-02     
  3      0.686100E+04           0.557370E-02     
  4      0.194280E+04           0.229350E-01     
  5      0.633420E+03           0.773540E-01     
  6      0.228100E+03           0.205340E+00     
  7      0.882880E+02           0.380930E+00     
  8      0.357500E+02           0.363610E+00     
  9      0.145710E+02           0.951820E-01     
S   9
  1      0.301460E+05          -0.133900E-05     
  2      0.686100E+04          -0.947140E-06     
  3      0.194280E+04          -0.946530E-04     
  4      0.633420E+03          -0.483370E-03     
  5      0.228100E+03          -0.500090E-02     
  6      0.882880E+02          -0.202300E-01     
  7      0.357500E+02          -0.602090E-01     
  8      0.145710E+02           0.291950E-01     
  9      0.565800E+01           0.169930E+00     
S   9
  1      0.686100E+04          -0.196740E-05     
  2      0.194280E+04          -0.248680E-04     
  3      0.633420E+03          -0.289670E-03     
  4      0.228100E+03          -0.215130E-02     
  5      0.882880E+02          -0.111950E-01     
  6      0.357500E+02          -0.301800E-01     
  7      0.145710E+02           0.594560E-02     
  8      0.565800E+01           0.247020E+00     
  9      0.225540E+01           0.314120E+00     
S   1
  1      0.549470E+00           1.0000000        
S   1
  1      0.191260E+00           1.0000000        
P   7
  1      0.112990E+04           0.976210E-03     
  2      0.268060E+03           0.812600E-02     
  3      0.862220E+02           0.414330E-01     
  4      0.319790E+02           0.140350E+00     
  5      0.130080E+02           0.312070E+00     
  6      0.547660E+01           0.420990E+00     
  7      0.230900E+01           0.256640E+00     
P   7
  1      0.268060E+03          -0.115960E-04     
  2      0.862220E+02          -0.182890E-03     
  3      0.319790E+02          -0.171700E-02     
  4      0.130080E+02          -0.789740E-02     
  5      0.547660E+01          -0.182370E-01     
  6      0.230900E+01           0.400350E-01     
  7      0.846010E+00           0.367170E+00     
P   1
  1      0.316590E+00           1.0000000        
P   1
  1      0.107160E+00           1.0000000        
D   1
  1      0.231000E+01           1.0000000        
D   1
  1      0.520000E+00           1.0000000        
F   1
  1      0.720000E+00           1.0000000


name: pc-2
description: N/A
elt: Ar
data:
ARGON
S   9
  1      0.232510E+06           0.662580E-04     
  2      0.348440E+05           0.514120E-03     
  3      0.793030E+04           0.268610E-02     
  4      0.224570E+04           0.110620E-01     
  5      0.732220E+03           0.374080E-01     
  6      0.263770E+03           0.999280E-01     
  7      0.102190E+03           0.187880E+00     
  8      0.415250E+02           0.184270E+00     
  9      0.172020E+02           0.517820E-01     
S   9
  1      0.348440E+05          -0.706230E-05     
  2      0.793030E+04          -0.242260E-05     
  3      0.224570E+04          -0.475640E-03     
  4      0.732220E+03          -0.227710E-02     
  5      0.263770E+03          -0.245270E-01     
  6      0.102190E+03          -0.981940E-01     
  7      0.415250E+02          -0.304590E+00     
  8      0.172020E+02           0.119400E+00     
  9      0.659670E+01           0.831730E+00     
S   9
  1      0.793030E+04          -0.937990E-06     
  2      0.224570E+04          -0.118310E-04     
  3      0.732220E+03          -0.138170E-03     
  4      0.263770E+03          -0.103240E-02     
  5      0.102190E+03          -0.543290E-02     
  6      0.415250E+02          -0.150850E-01     
  7      0.172020E+02           0.111200E-02     
  8      0.659670E+01           0.124610E+00     
  9      0.264770E+01           0.160830E+00     
S   1
  1      0.661930E+00           1.0000000        
S   1
  1      0.229010E+00           1.0000000        
P   7
  1      0.129770E+04           0.479970E-03     
  2      0.307860E+03           0.400670E-02     
  3      0.990960E+02           0.204970E-01     
  4      0.368370E+02           0.698190E-01     
  5      0.150270E+02           0.156250E+00     
  6      0.636620E+01           0.210990E+00     
  7      0.271100E+01           0.126650E+00     
P   7
  1      0.307860E+03          -0.664160E-05     
  2      0.990960E+02          -0.988130E-04     
  3      0.368370E+02          -0.935710E-03     
  4      0.150270E+02          -0.431330E-02     
  5      0.636620E+01          -0.986480E-02     
  6      0.271100E+01           0.223340E-01     
  7      0.101820E+01           0.188330E+00     
P   1
  1      0.382740E+00           1.0000000        
P   1
  1      0.129460E+00           1.0000000        
D   1
  1      0.252000E+01           1.0000000        
D   1
  1      0.570000E+00           1.0000000        
F   1
  1      0.780000E+00           1.0000000


name: pc-2
description: N/A
elt: K
data:
POTASSIUM
S   14
  1      0.49031E+06            0.76873E-04      
  2      0.73452E+05            0.59725E-03      
  3      0.16715E+05            0.31309E-02      
  4      0.47333E+04            0.13065E-01      
  5      0.15432E+04            0.45878E-01      
  6      0.55614E+03            0.13523E+00      
  7      0.21583E+03            0.31543E+00      
  8      0.88671E+02            0.50000E+00      
  9      0.37545E+02            0.39731E+00      
 10      0.14821E+02            0.75162E-01      
 11      0.66038E+01           -0.77805E-02      
 12      0.28439E+01            0.26869E-02      
 13      0.83912E+00           -0.82649E-03      
 14      0.31699E+00            0.33236E-03      
S   14
  1      0.49031E+06           -0.14557E-04      
  2      0.73452E+05           -0.11322E-03      
  3      0.16715E+05           -0.59406E-03      
  4      0.47333E+04           -0.24963E-02      
  5      0.15432E+04           -0.89015E-02      
  6      0.55614E+03           -0.27450E-01      
  7      0.21583E+03           -0.70947E-01      
  8      0.88671E+02           -0.14113E+00      
  9      0.37545E+02           -0.16641E+00      
 10      0.14821E+02            0.81108E-01      
 11      0.66038E+01            0.50000E+00      
 12      0.28439E+01            0.38155E+00      
 13      0.83912E+00            0.27774E-01      
 14      0.31699E+00           -0.52890E-02      
S   14
  1      0.49031E+06            0.45420E-05      
  2      0.73452E+05            0.35396E-04      
  3      0.16715E+05            0.18523E-03      
  4      0.47333E+04            0.78178E-03      
  5      0.15432E+04            0.27789E-02      
  6      0.55614E+03            0.86600E-02      
  7      0.21583E+03            0.22444E-01      
  8      0.88671E+02            0.46255E-01      
  9      0.37545E+02            0.56351E-01      
 10      0.14821E+02           -0.29235E-01      
 11      0.66038E+01           -0.26267E+00      
 12      0.28439E+01           -0.26850E+00      
 13      0.83912E+00            0.50000E+00      
 14      0.31699E+00            0.45268E+00      
S   14
  1      0.49031E+06            0.21833E-05      
  2      0.73452E+05            0.17029E-04      
  3      0.16715E+05            0.89005E-04      
  4      0.47333E+04            0.37632E-03      
  5      0.15432E+04            0.13349E-02      
  6      0.55614E+03            0.41736E-02      
  7      0.21583E+03            0.10789E-01      
  8      0.88671E+02            0.22405E-01      
  9      0.37545E+02            0.27190E-01      
 10      0.14821E+02           -0.13836E-01      
 11      0.66038E+01           -0.13431E+00      
 12      0.28439E+01           -0.14280E+00      
 13      0.83912E+00            0.32871E+00      
 14      0.31699E+00            0.50000E+00      
S   1
  1      0.46463E-01            1.0000000        
S   1
  1      0.18969E-01            1.0000000        
P   9
  1      0.15652E+04            0.10191E-02      
  2      0.37132E+03            0.85666E-02      
  3      0.11948E+03            0.44395E-01      
  4      0.44573E+02            0.15358E+00      
  5      0.18273E+02            0.35430E+00      
  6      0.78009E+01            0.50000E+00      
  7      0.33555E+01            0.32838E+00      
  8      0.13020E+01            0.49690E-01      
  9      0.51452E+00           -0.42662E-02      
P   9
  1      0.15652E+04           -0.25097E-03      
  2      0.37132E+03           -0.21181E-02      
  3      0.11948E+03           -0.11110E-01      
  4      0.44573E+02           -0.39456E-01      
  5      0.18273E+02           -0.95531E-01      
  6      0.78009E+01           -0.14269E+00      
  7      0.33555E+01           -0.46495E-01      
  8      0.13020E+01            0.32716E+00      
  9      0.51452E+00            0.50000E+00      
P   1
  1      0.18643E+00            1.0000000        
P   1
  1      0.40400E-01            1.0000000        
D   3
  1      0.67900E+01            0.70953E-01      
  2      0.16960E+01            0.26515E+00      
  3      0.49800E+00            0.50000E+00      
D   1
  1      0.12600E+00            1.0000000        
D   1
  1      0.28200E-01            1.0000000


