# all_value

name: s6-31G
description: Spin-state corrected 6-31G basis set
elt: Co
data:
COBALT
S   6
  1  66148.990000000            0.00175979       
  2   9933.077000000            0.01348162       
  3   2262.816000000            0.06649342       
  4    637.915400000            0.23079390       
  5    204.412200000            0.47929190       
  6     69.825380000            0.35140970       
L   6
  1   1378.841000000            0.00237628             0.00397149       
  2    328.269400000            0.03167450             0.03108174       
  3    106.094600000            0.12628880             0.13574390       
  4     39.832750000           -0.02584552             0.34768270       
  5     16.186220000           -0.61834910             0.46263400       
  6      6.667788000           -0.45670080             0.20516320       
L   6
  1     54.523550000           -0.00399300            -0.00729077       
  2     18.297830000            0.07409663            -0.02926027       
  3      7.867348000            0.25420000             0.06564150       
  4      3.340534000           -0.29216570             0.40006520       
  5      1.393756000           -0.73187030             0.49502360       
  6      0.551326000           -0.20407840             0.17582400       
L   3
  1      2.151947000            0.05379843            -0.21654960       
  2      0.811063000            0.27599710             0.12404880       
  3      0.121017000           -1.12969200             0.97240640       
L   1
  1      0.043037000            1.00000000             1.00000000       
D   3
  1     25.593060000            0.09004748       
  2      6.800990000            0.39317030       
  3      2.051647000            0.69768440       
D   1
  1      0.555671000            1.0000000        
D   1
  1      0.157650000            1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: H
data:
HYDROGEN
S   7
  1      0.300996D+04           0.994949D-04     
  2      0.451373D+03           0.772617D-03     
  3      0.102806D+03           0.405930D-02     
  4      0.291474D+02           0.170977D-01     
  5      0.952878D+01           0.615690D-01     
  6      0.345638D+01           0.192015D+00     
  7      0.135638D+01           0.500000D+00     
S   1
  1      0.561300D+00           1.0000000        
S   1
  1      0.241026D+00           1.0000000        
S   1
  1      0.104273D+00           1.0000000        
S   1
  1      0.439734D-01           1.0000000        
P   1
  1      0.300000D+02           1.0000000        
P   1
  1      0.660000D+01           1.0000000        
P   1
  1      0.210000D+01           1.0000000        
P   1
  1      0.950000D+00           1.0000000        
P   1
  1      0.450000D+00           1.0000000        
P   1
  1      0.150000D+00           1.0000000        
D   1
  1      0.210000D+01           1.0000000        
D   1
  1      0.700000D+00           1.0000000        
D   1
  1      0.300000D+00           1.0000000        
F   1
  1      0.250000D+01           1.0000000        
F   1
  1      0.900000D+00           1.0000000        
G   1
  1      0.320000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: He
data:
HELIUM
S   7
  1      0.877224D+04           0.112016D-03     
  2      0.131420D+04           0.870431D-03     
  3      0.299180D+03           0.456768D-02     
  4      0.847866D+02           0.191446D-01     
  5      0.276895D+02           0.679676D-01     
  6      0.100123D+02           0.204755D+00     
  7      0.389571D+01           0.500000D+00     
S   1
  1      0.158365D+01           1.0000000        
S   1
  1      0.657655D+00           1.0000000        
S   1
  1      0.264806D+00           1.0000000        
S   1
  1      0.105914D+00           1.0000000        
P   1
  1      0.405000D+02           1.0000000        
P   1
  1      0.890000D+01           1.0000000        
P   1
  1      0.285000D+01           1.0000000        
P   1
  1      0.130000D+01           1.0000000        
P   1
  1      0.600000D+00           1.0000000        
P   1
  1      0.200000D+00           1.0000000        
D   1
  1      0.370000D+01           1.0000000        
D   1
  1      0.120000D+01           1.0000000        
D   1
  1      0.500000D+00           1.0000000        
F   1
  1      0.410000D+01           1.0000000        
F   1
  1      0.150000D+01           1.0000000        
G   1
  1      0.465000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Li
data:
LITHIUM
S   12
  1      0.884669D+05           0.125450D-04     
  2      0.132495D+05           0.975394D-04     
  3      0.301504D+04           0.513045D-03     
  4      0.854032D+03           0.216538D-02     
  5      0.278704D+03           0.786351D-02     
  6      0.100686D+03           0.253659D-01     
  7      0.394087D+02           0.719619D-01     
  8      0.164879D+02           0.181504D+00     
  9      0.734787D+01           0.348588D+00     
 10      0.359135D+01           0.532900D+00     
 11      0.195301D+01           0.500000D+00     
 12      0.101030D+01           0.770000D+00     
S   4
  1      0.377262D+02           0.102727D-02     
  2      0.778069D+01           0.171265D-01     
  3      0.195505D+01           0.158407D+00     
  4      0.481626D+00           0.500000D+00     
S   1
  1      0.229140D+00           1.0000000        
S   1
  1      0.932706D-01           1.0000000        
S   1
  1      0.417901D-01           1.0000000        
S   1
  1      0.179044D-01           1.0000000        
P   5
  1      0.291378D+02           0.174429D-02     
  2      0.677082D+01           0.135730D-01     
  3      0.197116D+01           0.711501D-01     
  4      0.653531D+00           0.201363D+00     
  5      0.258316D+00           0.500000D+00     
P   1
  1      0.105819D+00           1.0000000        
P   1
  1      0.431498D-01           1.0000000        
P   1
  1      0.165491D-01           1.0000000        
D   1
  1      0.175000D+01           1.0000000        
D   1
  1      0.300000D+00           1.0000000        
D   1
  1      0.110000D+00           1.0000000        
F   1
  1      0.500000D+00           1.0000000        
F   1
  1      0.200000D+00           1.0000000        
G   1
  1      0.550000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Be
data:
BERYLLIUM
S   12
  1      0.242387D+06           0.671218D-05     
  2      0.363406D+05           0.520966D-04     
  3      0.828251D+04           0.273398D-03     
  4      0.235049D+04           0.115170D-02     
  5      0.768341D+03           0.418157D-02     
  6      0.277860D+03           0.135649D-01     
  7      0.108503D+03           0.399140D-01     
  8      0.450030D+02           0.104239D+00     
  9      0.196716D+02           0.241942D+00     
 10      0.877289D+01           0.442318D+00     
 11      0.455897D+01           0.500000D+00     
 12      0.212678D+01           0.715523D+00     
S   4
  1      0.467790D+02           0.167625D-02     
  2      0.120719D+02           0.254590D-01     
  3      0.347695D+01           0.199557D+00     
  4      0.102619D+01           0.500000D+00     
S   1
  1      0.480281D+00           1.0000000        
S   1
  1      0.195855D+00           1.0000000        
S   1
  1      0.821252D-01           1.0000000        
S   1
  1      0.340092D-01           1.0000000        
P   5
  1      0.447721D+02           0.173722D-02     
  2      0.104671D+02           0.135661D-01     
  3      0.311028D+01           0.704636D-01     
  4      0.104755D+01           0.206665D+00     
  5      0.413337D+00           0.500000D+00     
P   1
  1      0.168212D+00           1.0000000        
P   1
  1      0.675834D-01           1.0000000        
P   1
  1      0.255653D-01           1.0000000        
D   1
  1      0.335000D+01           1.0000000        
D   1
  1      0.570000D+00           1.0000000        
D   1
  1      0.210000D+00           1.0000000        
F   1
  1      0.750000D+00           1.0000000        
F   1
  1      0.300000D+00           1.0000000        
G   1
  1      0.800000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: B
data:
BORON
S   12
  1      0.432161D+06           0.545386D-05     
  2      0.649530D+05           0.421889D-04     
  3      0.148254D+05           0.221125D-03     
  4      0.420988D+04           0.931265D-03     
  5      0.137637D+04           0.338272D-02     
  6      0.497923D+03           0.109725D-01     
  7      0.194812D+03           0.322387D-01     
  8      0.814167D+02           0.842943D-01     
  9      0.355115D+02           0.200592D+00     
 10      0.163145D+02           0.354518D+00     
 11      0.833424D+01           0.500000D+00     
 12      0.378189D+01           0.664912D+00     
S   4
  1      0.603010D+02           0.256607D-02     
  2      0.178042D+02           0.292357D-01     
  3      0.583388D+01           0.193257D+00     
  4      0.187876D+01           0.500000D+00     
S   1
  1      0.922869D+00           1.0000000        
S   1
  1      0.352789D+00           1.0000000        
S   1
  1      0.143448D+00           1.0000000        
S   1
  1      0.580750D-01           1.0000000        
P   7
  1      0.227013D+03           0.250211D-03     
  2      0.538077D+02           0.215948D-02     
  3      0.170458D+02           0.120450D-01     
  4      0.602063D+01           0.507921D-01     
  5      0.262812D+01           0.109064D+00     
  6      0.120656D+01           0.274524D+00     
  7      0.574525D+00           0.500000D+00     
P   1
  1      0.275979D+00           1.0000000        
P   1
  1      0.129688D+00           1.0000000        
P   1
  1      0.600059D-01           1.0000000        
P   1
  1      0.263074D-01           1.0000000        
D   1
  1      0.530000D+01           1.0000000        
D   1
  1      0.190000D+01           1.0000000        
D   1
  1      0.750000D+00           1.0000000        
D   1
  1      0.350000D+00           1.0000000        
D   1
  1      0.160000D+00           1.0000000        
D   1
  1      0.600000D-01           1.0000000        
F   1
  1      0.190000D+01           1.0000000        
F   1
  1      0.800000D+00           1.0000000        
F   1
  1      0.350000D+00           1.0000000        
G   1
  1      0.165000D+01           1.0000000        
G   1
  1      0.700000D+00           1.0000000        
H   1
  1      0.175000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: C
data:
CARBON
S   12
  1      0.713988D+06           0.405120D-05     
  2      0.107119D+06           0.314303D-04     
  3      0.244063D+05           0.165102D-03     
  4      0.692100D+04           0.696477D-03     
  5      0.226076D+04           0.253267D-02     
  6      0.817208D+03           0.823653D-02     
  7      0.319054D+03           0.243918D-01     
  8      0.132447D+03           0.657916D-01     
  9      0.578170D+02           0.152023D+00     
 10      0.267182D+02           0.301922D+00     
 11      0.123637D+02           0.500000D+00     
 12      0.546363D+01           0.540822D+00     
S   4
  1      0.594006D+02           0.631685D-02     
  2      0.189467D+02           0.512142D-01     
  3      0.742270D+01           0.216146D+00     
  4      0.272239D+01           0.500000D+00     
S   1
  1      0.131261D+01           1.0000000        
S   1
  1      0.515235D+00           1.0000000        
S   1
  1      0.209159D+00           1.0000000        
S   1
  1      0.837574D-01           1.0000000        
P   7
  1      0.379171D+03           0.215905D-03     
  2      0.897598D+02           0.188104D-02     
  3      0.286625D+02           0.105455D-01     
  4      0.103114D+02           0.447773D-01     
  5      0.445074D+01           0.109406D+00     
  6      0.200750D+01           0.273619D+00     
  7      0.943558D+00           0.500000D+00     
P   1
  1      0.445090D+00           1.0000000        
P   1
  1      0.206068D+00           1.0000000        
P   1
  1      0.944742D-01           1.0000000        
P   1
  1      0.407250D-01           1.0000000        
D   1
  1      0.840000D+01           1.0000000        
D   1
  1      0.300000D+01           1.0000000        
D   1
  1      0.120000D+01           1.0000000        
D   1
  1      0.550000D+00           1.0000000        
D   1
  1      0.250000D+00           1.0000000        
D   1
  1      0.100000D+00           1.0000000        
F   1
  1      0.210000D+01           1.0000000        
F   1
  1      0.900000D+00           1.0000000        
F   1
  1      0.400000D+00           1.0000000        
G   1
  1      0.210000D+01           1.0000000        
G   1
  1      0.900000D+00           1.0000000        
H   1
  1      0.185000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: N
data:
NITROGEN
S   12
  1      0.857271D+06           0.442448D-05     
  2      0.128455D+06           0.343751D-04     
  3      0.292622D+05           0.180530D-03     
  4      0.829780D+04           0.761488D-03     
  5      0.271094D+04           0.276668D-02     
  6      0.980292D+03           0.898437D-02     
  7      0.382847D+03           0.265339D-01     
  8      0.158978D+03           0.711280D-01     
  9      0.696308D+02           0.160579D+00     
 10      0.319728D+02           0.322493D+00     
 11      0.145060D+02           0.500000D+00     
 12      0.658672D+01           0.426567D+00     
S   4
  1      0.661063D+02           0.116808D-01     
  2      0.205880D+02           0.952102D-01     
  3      0.819692D+01           0.300172D+00     
  4      0.337474D+01           0.500000D+00     
S   1
  1      0.165218D+01           1.0000000        
S   1
  1      0.672072D+00           1.0000000        
S   1
  1      0.275511D+00           1.0000000        
S   1
  1      0.110252D+00           1.0000000        
P   7
  1      0.570352D+03           0.194221D-03     
  2      0.135139D+03           0.169656D-02     
  3      0.433118D+02           0.958423D-02     
  4      0.156814D+02           0.415265D-01     
  5      0.666430D+01           0.109770D+00     
  6      0.298248D+01           0.274246D+00     
  7      0.139060D+01           0.500000D+00     
P   1
  1      0.650502D+00           1.0000000        
P   1
  1      0.300699D+00           1.0000000        
P   1
  1      0.136515D+00           1.0000000        
P   1
  1      0.579684D-01           1.0000000        
D   1
  1      0.128000D+02           1.0000000        
D   1
  1      0.440000D+01           1.0000000        
D   1
  1      0.175000D+01           1.0000000        
D   1
  1      0.800000D+00           1.0000000        
D   1
  1      0.370000D+00           1.0000000        
D   1
  1      0.150000D+00           1.0000000        
F   1
  1      0.230000D+01           1.0000000        
F   1
  1      0.100000D+01           1.0000000        
F   1
  1      0.450000D+00           1.0000000        
G   1
  1      0.255000D+01           1.0000000        
G   1
  1      0.110000D+01           1.0000000        
H   1
  1      0.195000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: O
data:
OXYGEN
S   12
  1      0.114221D+07           0.429557D-05     
  2      0.171021D+06           0.334038D-04     
  3      0.389250D+05           0.175666D-03     
  4      0.110291D+05           0.741674D-03     
  5      0.360056D+04           0.269786D-02     
  6      0.130100D+04           0.876803D-02     
  7      0.508049D+03           0.258859D-01     
  8      0.211087D+03           0.694093D-01     
  9      0.927409D+02           0.154637D+00     
 10      0.422504D+02           0.324258D+00     
 11      0.183876D+02           0.500000D+00     
 12      0.834627D+01           0.309809D+00     
S   4
  1      0.841167D+02           0.174688D-01     
  2      0.253595D+02           0.156321D+00     
  3      0.959138D+01           0.474758D+00     
  4      0.425904D+01           0.500000D+00     
S   1
  1      0.190789D+01           1.0000000        
S   1
  1      0.832617D+00           1.0000000        
S   1
  1      0.352755D+00           1.0000000        
S   1
  1      0.144545D+00           1.0000000        
P   7
  1      0.892806D+03           0.166323D-03     
  2      0.211415D+03           0.146314D-02     
  3      0.683366D+02           0.814438D-02     
  4      0.262298D+02           0.310487D-01     
  5      0.116039D+02           0.937067D-01     
  6      0.509765D+01           0.247200D+00     
  7      0.233975D+01           0.500000D+00     
P   1
  1      0.106681D+01           1.0000000        
P   1
  1      0.470423D+00           1.0000000        
P   1
  1      0.196221D+00           1.0000000        
P   1
  1      0.770339D-01           1.0000000        
D   1
  1      0.182000D+02           1.0000000        
D   1
  1      0.600000D+01           1.0000000        
D   1
  1      0.240000D+01           1.0000000        
D   1
  1      0.110000D+01           1.0000000        
D   1
  1      0.500000D+00           1.0000000        
D   1
  1      0.200000D+00           1.0000000        
F   1
  1      0.260000D+01           1.0000000        
F   1
  1      0.115000D+01           1.0000000        
F   1
  1      0.500000D+00           1.0000000        
G   1
  1      0.305000D+01           1.0000000        
G   1
  1      0.130000D+01           1.0000000        
H   1
  1      0.205000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: F
data:
FLUORINE
S   12
  1      0.149245D+07           0.421068D-05     
  2      0.223504D+06           0.327369D-04     
  3      0.508888D+05           0.172056D-03     
  4      0.144232D+05           0.726324D-03     
  5      0.470747D+04           0.264471D-02     
  6      0.169946D+04           0.861267D-02     
  7      0.662675D+03           0.255075D-01     
  8      0.274932D+03           0.685895D-01     
  9      0.120974D+03           0.151186D+00     
 10      0.551040D+02           0.322315D+00     
 11      0.235154D+02           0.500000D+00     
 12      0.105009D+02           0.235433D+00     
S   4
  1      0.108252D+03           0.208399D-01     
  2      0.325577D+02           0.191120D+00     
  3      0.120150D+02           0.612293D+00     
  4      0.541101D+01           0.500000D+00     
S   1
  1      0.229993D+01           1.0000000        
S   1
  1      0.102395D+01           1.0000000        
S   1
  1      0.440933D+00           1.0000000        
S   1
  1      0.182580D+00           1.0000000        
P   7
  1      0.103443D+04           0.189315D-03     
  2      0.244865D+03           0.166469D-02     
  3      0.788732D+02           0.935136D-02     
  4      0.296998D+02           0.374814D-01     
  5      0.130075D+02           0.106133D+00     
  6      0.583556D+01           0.268233D+00     
  7      0.271095D+01           0.500000D+00     
P   1
  1      0.125029D+01           1.0000000        
P   1
  1      0.558399D+00           1.0000000        
P   1
  1      0.235082D+00           1.0000000        
P   1
  1      0.936416D-01           1.0000000        
D   1
  1      0.255000D+02           1.0000000        
D   1
  1      0.800000D+01           1.0000000        
D   1
  1      0.320000D+01           1.0000000        
D   1
  1      0.145000D+01           1.0000000        
D   1
  1      0.650000D+00           1.0000000        
D   1
  1      0.250000D+00           1.0000000        
F   1
  1      0.310000D+01           1.0000000        
F   1
  1      0.135000D+01           1.0000000        
F   1
  1      0.600000D+00           1.0000000        
G   1
  1      0.360000D+01           1.0000000        
G   1
  1      0.155000D+01           1.0000000        
H   1
  1      0.215000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ne
data:
NEON
S   12
  1      0.200519D+07           0.392206D-05     
  2      0.300560D+06           0.304648D-04     
  3      0.684361D+05           0.160161D-03     
  4      0.193702D+05           0.678740D-03     
  5      0.629788D+04           0.248878D-02     
  6      0.226312D+04           0.816029D-02     
  7      0.878056D+03           0.243887D-01     
  8      0.361802D+03           0.665430D-01     
  9      0.158266D+03           0.148508D+00     
 10      0.709342D+02           0.326807D+00     
 11      0.297881D+02           0.500000D+00     
 12      0.132653D+02           0.181433D+00     
S   4
  1      0.133958D+03           0.234717D-01     
  2      0.406258D+02           0.212489D+00     
  3      0.149669D+02           0.697485D+00     
  4      0.681893D+01           0.500000D+00     
S   1
  1      0.280458D+01           1.0000000        
S   1
  1      0.125646D+01           1.0000000        
S   1
  1      0.543426D+00           1.0000000        
S   1
  1      0.224780D+00           1.0000000        
P   7
  1      0.117040D+04           0.208041D-03     
  2      0.277095D+03           0.182393D-02     
  3      0.892374D+02           0.102430D-01     
  4      0.330683D+02           0.432873D-01     
  5      0.139999D+02           0.122634D+00     
  6      0.627791D+01           0.293590D+00     
  7      0.291070D+01           0.500000D+00     
P   1
  1      0.134658D+01           1.0000000        
P   1
  1      0.610297D+00           1.0000000        
P   1
  1      0.262248D+00           1.0000000        
P   1
  1      0.106987D+00           1.0000000        
D   1
  1      0.320000D+02           1.0000000        
D   1
  1      0.101000D+02           1.0000000        
D   1
  1      0.400000D+01           1.0000000        
D   1
  1      0.185000D+01           1.0000000        
D   1
  1      0.800000D+00           1.0000000        
D   1
  1      0.300000D+00           1.0000000        
F   1
  1      0.360000D+01           1.0000000        
F   1
  1      0.155000D+01           1.0000000        
F   1
  1      0.700000D+00           1.0000000        
G   1
  1      0.420000D+01           1.0000000        
G   1
  1      0.180000D+01           1.0000000        
H   1
  1      0.225000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Na
data:
SODIUM
S   14
  1      0.309540D+07           0.227025D-05     
  2      0.461567D+06           0.178244D-04     
  3      0.104174D+06           0.948168D-04     
  4      0.293413D+05           0.402743D-03     
  5      0.954303D+04           0.147166D-02     
  6      0.343837D+04           0.481068D-02     
  7      0.133857D+04           0.143535D-01     
  8      0.554005D+03           0.393045D-01     
  9      0.241002D+03           0.976387D-01     
 10      0.108870D+03           0.212894D+00     
 11      0.509387D+02           0.379976D+00     
 12      0.244419D+02           0.500000D+00     
 13      0.117734D+02           0.381755D+00     
 14      0.563030D+01           0.103793D+00     
S   5
  1      0.125807D+03          -0.578418D-02     
  2      0.391912D+02          -0.443469D-01     
  3      0.144448D+02          -0.126688D+00     
  4      0.277102D+01           0.405840D+00     
  5      0.115947D+01           0.500000D+00     
S   2
  1      0.144232D+01           0.246385D+00     
  2      0.548802D+00           0.500000D+00     
S   1
  1      0.231000D+00           1.0000000        
S   1
  1      0.952929D-01           1.0000000        
S   1
  1      0.417204D-01           1.0000000        
S   1
  1      0.175659D-01           1.0000000        
P   11
  1      0.294848D+04           0.507052D-04     
  2      0.700747D+03           0.446590D-03     
  3      0.229090D+03           0.251313D-02     
  4      0.880653D+02           0.108609D-01     
  5      0.362213D+02           0.412634D-01     
  6      0.160725D+02           0.109414D+00     
  7      0.757547D+01           0.245238D+00     
  8      0.366221D+01           0.404554D+00     
  9      0.176584D+01           0.500000D+00     
 10      0.842395D+00           0.449375D+00     
 11      0.390140D+00           0.258119D+00     
P   1
  1      0.172619D+00           1.0000000        
P   1
  1      0.807000D-01           1.0000000        
P   1
  1      0.367000D-01           1.0000000        
P   1
  1      0.167000D-01           1.0000000        
D   1
  1      0.235000D+01           1.0000000        
D   1
  1      0.560000D+00           1.0000000        
D   1
  1      0.140000D+00           1.0000000        
F   1
  1      0.108000D+01           1.0000000        
F   1
  1      0.240000D+00           1.0000000        
G   1
  1      0.300000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Mg
data:
MAGNESIUM
S   14
  1      0.368901D+07           0.226101D-05     
  2      0.551274D+06           0.176931D-04     
  3      0.124720D+06           0.938399D-04     
  4      0.351973D+05           0.397641D-03     
  5      0.114689D+05           0.144898D-02     
  6      0.414218D+04           0.471921D-02     
  7      0.161749D+04           0.140154D-01     
  8      0.672134D+03           0.381692D-01     
  9      0.293772D+03           0.944709D-01     
 10      0.133336D+03           0.206035D+00     
 11      0.625579D+02           0.372727D+00     
 12      0.299620D+02           0.500000D+00     
 13      0.144193D+02           0.388575D+00     
 14      0.691028D+01           0.109201D+00     
S   5
  1      0.148908D+03          -0.595860D-02     
  2      0.465525D+02          -0.450480D-01     
  3      0.173493D+02          -0.126530D+00     
  4      0.341836D+01           0.384595D+00     
  5      0.148605D+01           0.500000D+00     
S   2
  1      0.190567D+01           0.223489D+00     
  2      0.738987D+00           0.500000D+00     
S   1
  1      0.321000D+00           1.0000000        
S   1
  1      0.146716D+00           1.0000000        
S   1
  1      0.636243D-01           1.0000000        
S   1
  1      0.270158D-01           1.0000000        
P   11
  1      0.426751D+04           0.379409D-04     
  2      0.101507D+04           0.335092D-03     
  3      0.330816D+03           0.192364D-02     
  4      0.125804D+03           0.867583D-02     
  5      0.516334D+02           0.328146D-01     
  6      0.234596D+02           0.879875D-01     
  7      0.111649D+02           0.207457D+00     
  8      0.546781D+01           0.369119D+00     
  9      0.266860D+01           0.500000D+00     
 10      0.127921D+01           0.479144D+00     
 11      0.604098D+00           0.272213D+00     
P   1
  1      0.273645D+00           1.0000000        
P   1
  1      0.122500D+00           1.0000000        
P   1
  1      0.557000D-01           1.0000000        
P   1
  1      0.253000D-01           1.0000000        
D   1
  1      0.336000D+01           1.0000000        
D   1
  1      0.800000D+00           1.0000000        
D   1
  1      0.200000D+00           1.0000000        
F   1
  1      0.135000D+01           1.0000000        
F   1
  1      0.300000D+00           1.0000000        
G   1
  1      0.350000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Al
data:
ALUMINUM
S   14
  1      0.460419D+07           0.207976D-05     
  2      0.692204D+06           0.160628D-04     
  3      0.158264D+06           0.839363D-04     
  4      0.450147D+05           0.353142D-03     
  5      0.147211D+05           0.128546D-02     
  6      0.531831D+04           0.419733D-02     
  7      0.207243D+04           0.125513D-01     
  8      0.856162D+03           0.347288D-01     
  9      0.370184D+03           0.880830D-01     
 10      0.165994D+03           0.196483D+00     
 11      0.770254D+02           0.364559D+00     
 12      0.365340D+02           0.500000D+00     
 13      0.174965D+02           0.396915D+00     
 14      0.837377D+01           0.115587D+00     
S   5
  1      0.175124D+03          -0.576228D-02     
  2      0.548355D+02          -0.433448D-01     
  3      0.205924D+02          -0.120745D+00     
  4      0.408624D+01           0.366112D+00     
  5      0.179460D+01           0.500000D+00     
S   2
  1      0.239937D+01           0.223032D+00     
  2      0.923145D+00           0.500000D+00     
S   1
  1      0.450567D+00           1.0000000        
S   1
  1      0.209107D+00           1.0000000        
S   1
  1      0.937939D-01           1.0000000        
S   1
  1      0.410663D-01           1.0000000        
P   11
  1      0.605257D+04           0.309727D-04     
  2      0.143863D+04           0.274272D-03     
  3      0.468292D+03           0.158772D-02     
  4      0.178509D+03           0.715390D-02     
  5      0.755638D+02           0.249560D-01     
  6      0.360364D+02           0.675078D-01     
  7      0.175945D+02           0.163837D+00     
  8      0.888503D+01           0.317977D+00     
  9      0.450543D+01           0.500000D+00     
 10      0.231990D+01           0.514187D+00     
 11      0.120473D+01           0.387970D+00     
P   2
  1      0.422725D+01          -0.836147D-01     
  2      0.612090D+00           0.500000D+00     
P   1
  1      0.284372D+00           1.0000000        
P   1
  1      0.124466D+00           1.0000000        
P   1
  1      0.541795D-01           1.0000000        
P   1
  1      0.221304D-01           1.0000000        
D   1
  1      0.178100D+02           1.0000000        
D   1
  1      0.509000D+01           1.0000000        
D   1
  1      0.175000D+01           1.0000000        
D   1
  1      0.630000D+00           1.0000000        
D   1
  1      0.270000D+00           1.0000000        
D   1
  1      0.110000D+00           1.0000000        
F   1
  1      0.217000D+01           1.0000000        
F   1
  1      0.510000D+00           1.0000000        
F   1
  1      0.210000D+00           1.0000000        
G   1
  1      0.114000D+01           1.0000000        
G   1
  1      0.380000D+00           1.0000000        
H   1
  1      0.690000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Si
data:
SILICON
S   14
  1      0.503074D+07           0.224702D-05     
  2      0.760810D+06           0.172367D-04     
  3      0.174376D+06           0.899084D-04     
  4      0.496607D+05           0.377855D-03     
  5      0.162485D+05           0.137495D-02     
  6      0.587159D+04           0.448728D-02     
  7      0.228998D+04           0.133689D-01     
  8      0.950411D+03           0.364990D-01     
  9      0.415066D+03           0.907621D-01     
 10      0.188328D+03           0.199174D+00     
 11      0.883134D+02           0.366205D+00     
 12      0.421693D+02           0.500000D+00     
 13      0.203040D+02           0.394821D+00     
 14      0.977137D+01           0.114576D+00     
S   5
  1      0.203644D+03          -0.551995D-02     
  2      0.638087D+02          -0.414431D-01     
  3      0.241080D+02          -0.114572D+00     
  4      0.481627D+01           0.347431D+00     
  5      0.215963D+01           0.500000D+00     
S   2
  1      0.298563D+01           0.202588D+00     
  2      0.113278D+01           0.500000D+00     
S   1
  1      0.617314D+00           1.0000000        
S   1
  1      0.272062D+00           1.0000000        
S   1
  1      0.123499D+00           1.0000000        
S   1
  1      0.546890D-01           1.0000000        
P   11
  1      0.664747D+04           0.361152D-04     
  2      0.160010D+04           0.312591D-03     
  3      0.525369D+03           0.178453D-02     
  4      0.201088D+03           0.803935D-02     
  5      0.841814D+02           0.293729D-01     
  6      0.392797D+02           0.801574D-01     
  7      0.191359D+02           0.189560D+00     
  8      0.979839D+01           0.341353D+00     
  9      0.518613D+01           0.500000D+00     
 10      0.276090D+01           0.506932D+00     
 11      0.148970D+01           0.364848D+00     
P   2
  1      0.555807D+01          -0.838600D-01     
  2      0.799727D+00           0.500000D+00     
P   1
  1      0.406173D+00           1.0000000        
P   1
  1      0.185295D+00           1.0000000        
P   1
  1      0.819091D-01           1.0000000        
P   1
  1      0.336817D-01           1.0000000        
D   1
  1      0.195200D+02           1.0000000        
D   1
  1      0.558000D+01           1.0000000        
D   1
  1      0.192000D+01           1.0000000        
D   1
  1      0.690000D+00           1.0000000        
D   1
  1      0.299000D+00           1.0000000        
D   1
  1      0.125000D+00           1.0000000        
F   1
  1      0.264000D+01           1.0000000        
F   1
  1      0.620000D+00           1.0000000        
F   1
  1      0.260000D+00           1.0000000        
G   1
  1      0.135000D+01           1.0000000        
G   1
  1      0.450000D+00           1.0000000        
H   1
  1      0.780000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: P
data:
PHOSPHOROUS
S   14
  1      0.596579D+07           0.216359D-05     
  2      0.893799D+06           0.167693D-04     
  3      0.204197D+06           0.877752D-04     
  4      0.579578D+05           0.370501D-03     
  5      0.189294D+05           0.134850D-02     
  6      0.684555D+04           0.438664D-02     
  7      0.267636D+04           0.130205D-01     
  8      0.111310D+04           0.355293D-01     
  9      0.486443D+03           0.885590D-01     
 10      0.220836D+03           0.194795D+00     
 11      0.103580D+03           0.361428D+00     
 12      0.493513D+02           0.500000D+00     
 13      0.237215D+02           0.399099D+00     
 14      0.114209D+02           0.117514D+00     
S   5
  1      0.235212D+03          -0.526172D-02     
  2      0.737031D+02          -0.395853D-01     
  3      0.279552D+02          -0.109223D+00     
  4      0.558059D+01           0.337351D+00     
  5      0.257085D+01           0.500000D+00     
S   2
  1      0.367689D+01           0.170842D+00     
  2      0.138806D+01           0.500000D+00     
S   1
  1      0.874645D+00           1.0000000        
S   1
  1      0.353267D+00           1.0000000        
S   1
  1      0.160097D+00           1.0000000        
S   1
  1      0.705043D-01           1.0000000        
P   11
  1      0.816603D+04           0.334629D-04     
  2      0.194908D+04           0.294108D-03     
  3      0.636913D+03           0.169187D-02     
  4      0.243516D+03           0.763836D-02     
  5      0.102359D+03           0.277788D-01     
  6      0.478673D+02           0.771466D-01     
  7      0.232877D+02           0.185993D+00     
  8      0.118691D+02           0.343636D+00     
  9      0.629688D+01           0.500000D+00     
 10      0.338787D+01           0.508882D+00     
 11      0.184172D+01           0.361935D+00     
P   2
  1      0.699853D+01          -0.884696D-01     
  2      0.101193D+01           0.500000D+00     
P   1
  1      0.557252D+00           1.0000000        
P   1
  1      0.260625D+00           1.0000000        
P   1
  1      0.115218D+00           1.0000000        
P   1
  1      0.472829D-01           1.0000000        
D   1
  1      0.212300D+02           1.0000000        
D   1
  1      0.607000D+01           1.0000000        
D   1
  1      0.209000D+01           1.0000000        
D   1
  1      0.750000D+00           1.0000000        
D   1
  1      0.325000D+00           1.0000000        
D   1
  1      0.135000D+00           1.0000000        
F   1
  1      0.312000D+01           1.0000000        
F   1
  1      0.730000D+00           1.0000000        
F   1
  1      0.300000D+00           1.0000000        
G   1
  1      0.155000D+01           1.0000000        
G   1
  1      0.520000D+00           1.0000000        
H   1
  1      0.870000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: S
data:
SULFUR
S   14
  1      0.687284D+07           0.213766D-05     
  2      0.102889D+07           0.166154D-04     
  3      0.234370D+06           0.872594D-04     
  4      0.664834D+05           0.367900D-03     
  5      0.217365D+05           0.133607D-02     
  6      0.787352D+04           0.433576D-02     
  7      0.308384D+04           0.128394D-01     
  8      0.128539D+04           0.349244D-01     
  9      0.563409D+03           0.868195D-01     
 10      0.256525D+03           0.191107D+00     
 11      0.120514D+03           0.357420D+00     
 12      0.574282D+02           0.500000D+00     
 13      0.276509D+02           0.405970D+00     
 14      0.133480D+02           0.124253D+00     
S   5
  1      0.268977D+03          -0.496200D-02     
  2      0.842831D+02          -0.373992D-01     
  3      0.320837D+02          -0.102925D+00     
  4      0.637002D+01           0.333568D+00     
  5      0.297987D+01           0.500000D+00     
S   2
  1      0.437556D+01           0.136497D+00     
  2      0.160544D+01           0.500000D+00     
S   1
  1      0.116444D+01           1.0000000        
S   1
  1      0.441044D+00           1.0000000        
S   1
  1      0.202230D+00           1.0000000        
S   1
  1      0.897369D-01           1.0000000        
P   11
  1      0.985719D+04           0.312349D-04     
  2      0.234395D+04           0.276828D-03     
  3      0.762509D+03           0.160936D-02     
  4      0.290587D+03           0.731206D-02     
  5      0.122289D+03           0.265997D-01     
  6      0.571707D+02           0.750849D-01     
  7      0.277603D+02           0.184001D+00     
  8      0.140822D+02           0.347602D+00     
  9      0.738735D+01           0.500000D+00     
 10      0.393879D+01           0.530510D+00     
 11      0.207934D+01           0.360771D+00     
P   2
  1      0.836706D+01          -0.416159D-01     
  2      0.109623D+01           0.500000D+00     
P   1
  1      0.556419D+00           1.0000000        
P   1
  1      0.266991D+00           1.0000000        
P   1
  1      0.119946D+00           1.0000000        
P   1
  1      0.503524D-01           1.0000000        
D   1
  1      0.229300D+02           1.0000000        
D   1
  1      0.655000D+01           1.0000000        
D   1
  1      0.226000D+01           1.0000000        
D   1
  1      0.810000D+00           1.0000000        
D   1
  1      0.351000D+00           1.0000000        
D   1
  1      0.146000D+00           1.0000000        
F   1
  1      0.359000D+01           1.0000000        
F   1
  1      0.840000D+00           1.0000000        
F   1
  1      0.350000D+00           1.0000000        
G   1
  1      0.176000D+01           1.0000000        
G   1
  1      0.590000D+00           1.0000000        
H   1
  1      0.950000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Cl
data:
CHLORINE
S   14
  1      0.786113D+07           0.210089D-05     
  2      0.118128D+07           0.162551D-04     
  3      0.269657D+06           0.851556D-04     
  4      0.766280D+05           0.358334D-03     
  5      0.250690D+05           0.130221D-02     
  6      0.907232D+04           0.423563D-02     
  7      0.354984D+04           0.125546D-01     
  8      0.147883D+04           0.341932D-01     
  9      0.647817D+03           0.851879D-01     
 10      0.294983D+03           0.187821D+00     
 11      0.138620D+03           0.353685D+00     
 12      0.659823D+02           0.500000D+00     
 13      0.317529D+02           0.410728D+00     
 14      0.153354D+02           0.128176D+00     
S   5
  1      0.305197D+03          -0.486433D-02     
  2      0.955978D+02          -0.367769D-01     
  3      0.364875D+02          -0.101007D+00     
  4      0.723853D+01           0.337156D+00     
  5      0.343701D+01           0.500000D+00     
S   2
  1      0.515644D+01           0.109136D+00     
  2      0.185666D+01           0.500000D+00     
S   1
  1      0.143848D+01           1.0000000        
S   1
  1      0.526818D+00           1.0000000        
S   1
  1      0.242705D+00           1.0000000        
S   1
  1      0.108424D+00           1.0000000        
P   11
  1      0.112554D+05           0.311531D-04     
  2      0.267067D+04           0.276761D-03     
  3      0.869208D+03           0.160568D-02     
  4      0.331736D+03           0.728522D-02     
  5      0.139610D+03           0.267078D-01     
  6      0.649826D+02           0.762551D-01     
  7      0.314460D+02           0.188634D+00     
  8      0.158630D+02           0.357979D+00     
  9      0.831474D+01           0.500000D+00     
 10      0.451098D+01           0.508552D+00     
 11      0.243001D+01           0.340072D+00     
P   2
  1      0.991047D+01          -0.371666D-01     
  2      0.130661D+01           0.500000D+00     
P   1
  1      0.639934D+00           1.0000000        
P   1
  1      0.306207D+00           1.0000000        
P   1
  1      0.138847D+00           1.0000000        
P   1
  1      0.593600D-01           1.0000000        
D   1
  1      0.246300D+02           1.0000000        
D   1
  1      0.704000D+01           1.0000000        
D   1
  1      0.243000D+01           1.0000000        
D   1
  1      0.870000D+00           1.0000000        
D   1
  1      0.377000D+00           1.0000000        
D   1
  1      0.157000D+00           1.0000000        
F   1
  1      0.406000D+01           1.0000000        
F   1
  1      0.950000D+00           1.0000000        
F   1
  1      0.390000D+00           1.0000000        
G   1
  1      0.197000D+01           1.0000000        
G   1
  1      0.660000D+00           1.0000000        
H   1
  1      0.104000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ar
data:
ARGON
S   14
  1      0.940071D+07           0.193654D-05     
  2      0.140997D+07           0.150543D-04     
  3      0.320384D+06           0.794601D-04     
  4      0.905810D+05           0.336452D-03     
  5      0.295321D+05           0.122628D-02     
  6      0.106701D+05           0.399210D-02     
  7      0.417352D+04           0.118337D-01     
  8      0.173918D+04           0.322499D-01     
  9      0.761932D+03           0.807161D-01     
 10      0.346447D+03           0.180052D+00     
 11      0.161959D+03           0.346550D+00     
 12      0.765976D+02           0.500000D+00     
 13      0.367438D+02           0.420671D+00     
 14      0.177261D+02           0.137129D+00     
S   5
  1      0.343604D+03          -0.487731D-02     
  2      0.107571D+03          -0.369879D-01     
  3      0.411529D+02          -0.101304D+00     
  4      0.818348D+01           0.344067D+00     
  5      0.394081D+01           0.500000D+00     
S   2
  1      0.603444D+01           0.978325D-01     
  2      0.218719D+01           0.500000D+00     
S   1
  1      0.173042D+01           1.0000000        
S   1
  1      0.625781D+00           1.0000000        
S   1
  1      0.288635D+00           1.0000000        
S   1
  1      0.128781D+00           1.0000000        
P   11
  1      0.133053D+05           0.285436D-04     
  2      0.316696D+04           0.252310D-03     
  3      0.103204D+04           0.146476D-02     
  4      0.394201D+03           0.665320D-02     
  5      0.166459D+03           0.243567D-01     
  6      0.773870D+02           0.713458D-01     
  7      0.372152D+02           0.180897D+00     
  8      0.186225D+02           0.353212D+00     
  9      0.967401D+01           0.500000D+00     
 10      0.525541D+01           0.500420D+00     
 11      0.284846D+01           0.331675D+00     
P   2
  1      0.116020D+02          -0.355044D-01     
  2      0.154486D+01           0.500000D+00     
P   1
  1      0.743091D+00           1.0000000        
P   1
  1      0.353963D+00           1.0000000        
P   1
  1      0.160875D+00           1.0000000        
P   1
  1      0.694865D-01           1.0000000        
D   1
  1      0.263300D+02           1.0000000        
D   1
  1      0.753000D+01           1.0000000        
D   1
  1      0.260000D+01           1.0000000        
D   1
  1      0.930000D+00           1.0000000        
D   1
  1      0.410000D+00           1.0000000        
D   1
  1      0.170000D+00           1.0000000        
F   1
  1      0.453000D+01           1.0000000        
F   1
  1      0.106000D+01           1.0000000        
F   1
  1      0.440000D+00           1.0000000        
G   1
  1      0.218000D+01           1.0000000        
G   1
  1      0.730000D+00           1.0000000        
H   1
  1      0.112000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: K
data:
POTASSIUM
S   15
  1      0.128210D+08           0.157051D-05     
  2      0.195957D+07           0.118284D-04     
  3      0.455871D+06           0.603443D-04     
  4      0.132081D+06           0.247212D-03     
  5      0.441062D+05           0.873536D-03     
  6      0.162974D+05           0.277027D-02     
  7      0.649504D+04           0.807822D-02     
  8      0.274616D+04           0.218458D-01     
  9      0.122180D+04           0.542755D-01     
 10      0.567543D+03           0.122404D+00     
 11      0.275421D+03           0.238575D+00     
 12      0.137220D+03           0.402655D+00     
 13      0.685863D+02           0.500000D+00     
 14      0.343627D+02           0.357694D+00     
 15      0.168731D+02           0.897163D-01     
S   7
  1      0.788872D+03          -0.108122D-02     
  2      0.244260D+03          -0.106862D-01     
  3      0.953115D+02          -0.452010D-01     
  4      0.423177D+02          -0.924165D-01     
  5      0.964482D+01           0.313169D+00     
  6      0.491910D+01           0.500000D+00     
  7      0.251375D+01           0.293798D+00     
S   5
  1      0.344327D+02           0.431883D-02     
  2      0.790786D+01          -0.137742D+00     
  3      0.369328D+01          -0.183543D+00     
  4      0.294033D+01          -0.277528D+00     
  5      0.120809D+01           0.500000D+00     
S   1
  1      0.590120D+00           1.0000000        
S   1
  1      0.259492D+00           1.0000000        
S   1
  1      0.709000D-01           1.0000000        
S   1
  1      0.445033D-01           1.0000000        
S   1
  1      0.172552D-01           1.0000000        
P   12
  1      0.127445D+05           0.412196D-04     
  2      0.305643D+04           0.357825D-03     
  3      0.100716D+04           0.202111D-02     
  4      0.390147D+03           0.889463D-02     
  5      0.165958D+03           0.323737D-01     
  6      0.776642D+02           0.901145D-01     
  7      0.381623D+02           0.216319D+00     
  8      0.193723D+02           0.411398D+00     
  9      0.100316D+02           0.565143D+00     
 10      0.552471D+01           0.500000D+00     
 11      0.315065D+01           0.310121D+00     
 12      0.179534D+01           0.100865D+00     
P   5
  1      0.364778D+02          -0.351350D-02     
  2      0.123437D+02          -0.227038D-01     
  3      0.476348D+01          -0.479189D-02     
  4      0.190481D+01           0.227861D+00     
  5      0.948232D+00           0.500000D+00     
P   1
  1      0.468975D+00           1.0000000        
P   1
  1      0.224799D+00           1.0000000        
P   1
  1      0.103311D+00           1.0000000        
P   1
  1      0.325000D-01           1.0000000        
D   4
  1      0.383422D+02           0.995255D-02     
  2      0.112463D+02           0.617254D-01     
  3      0.419852D+01           0.200335D+00     
  4      0.162153D+01           0.500000D+00     
D   1
  1      0.633268D+00           1.0000000        
D   1
  1      0.236198D+00           1.0000000        
D   1
  1      0.856178D-01           1.0000000        
D   1
  1      0.296926D-01           1.0000000        
F   1
  1      0.128000D+01           1.0000000        
F   1
  1      0.320000D+00           1.0000000        
G   1
  1      0.480000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ca
data:
CALCIUM
S   15
  1      0.151968D+08           0.142215D-05     
  2      0.234308D+07           0.105752D-04     
  3      0.549724D+06           0.533493D-04     
  4      0.160386D+06           0.216892D-03     
  5      0.537853D+05           0.764165D-03     
  6      0.199210D+05           0.241674D-02     
  7      0.797122D+04           0.699643D-02     
  8      0.338539D+04           0.189142D-01     
  9      0.150224D+04           0.479719D-01     
 10      0.689897D+03           0.111415D+00     
 11      0.329820D+03           0.225005D+00     
 12      0.161595D+03           0.392082D+00     
 13      0.798624D+02           0.500000D+00     
 14      0.397393D+02           0.371825D+00     
 15      0.194029D+02           0.989867D-01     
S   7
  1      0.883227D+03          -0.110104D-02     
  2      0.273144D+03          -0.109627D-01     
  3      0.106186D+03          -0.470331D-01     
  4      0.470628D+02          -0.958797D-01     
  5      0.108530D+02           0.318709D+00     
  6      0.566503D+01           0.500000D+00     
  7      0.296993D+01           0.319345D+00     
S   5
  1      0.358188D+02           0.540875D-02     
  2      0.949917D+01          -0.124738D+00     
  3      0.484255D+01          -0.145986D+00     
  4      0.352052D+01          -0.362541D+00     
  5      0.141155D+01           0.500000D+00     
S   1
  1      0.717918D+00           1.0000000        
S   1
  1      0.326506D+00           1.0000000        
S   1
  1      0.894855D-01           1.0000000        
S   1
  1      0.443010D-01           1.0000000        
S   1
  1      0.200225D-01           1.0000000        
P   12
  1      0.153250D+05           0.359268D-04     
  2      0.366674D+04           0.313178D-03     
  3      0.120769D+04           0.177155D-02     
  4      0.468172D+03           0.781082D-02     
  5      0.200062D+03           0.282481D-01     
  6      0.939446D+02           0.804757D-01     
  7      0.460062D+02           0.197978D+00     
  8      0.233317D+02           0.386539D+00     
  9      0.121312D+02           0.543172D+00     
 10      0.674301D+01           0.500000D+00     
 11      0.386758D+01           0.331114D+00     
 12      0.220835D+01           0.116101D+00     
P   5
  1      0.429495D+02          -0.349510D-02     
  2      0.146237D+02          -0.234035D-01     
  3      0.560660D+01          -0.959169D-02     
  4      0.233691D+01           0.210892D+00     
  5      0.118677D+01           0.500000D+00     
P   1
  1      0.594101D+00           1.0000000        
P   1
  1      0.293390D+00           1.0000000        
P   1
  1      0.140251D+00           1.0000000        
P   1
  1      0.447000D-01           1.0000000        
D   4
  1      0.504049D+02           0.845973D-02     
  2      0.148347D+02           0.554888D-01     
  3      0.551603D+01           0.194869D+00     
  4      0.214182D+01           0.500000D+00     
D   1
  1      0.855031D+00           1.0000000        
D   1
  1      0.328499D+00           1.0000000        
D   1
  1      0.121643D+00           1.0000000        
D   1
  1      0.423087D-01           1.0000000        
F   1
  1      0.160000D+01           1.0000000        
F   1
  1      0.400000D+00           1.0000000        
G   1
  1      0.600000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Sc
data:
SCANDIUM
S   15
  1      0.216236D+08           0.100334D-05     
  2      0.329770D+07           0.775959D-05     
  3      0.738369D+06           0.420080D-04     
  4      0.206907D+06           0.178495D-03     
  5      0.676652D+05           0.640805D-03     
  6      0.248698D+05           0.201429D-02     
  7      0.100053D+05           0.574531D-02     
  8      0.427733D+04           0.155275D-01     
  9      0.189363D+04           0.402406D-01     
 10      0.859495D+03           0.967467D-01     
 11      0.402003D+03           0.207080D+00     
 12      0.191117D+03           0.379840D+00     
 13      0.921270D+02           0.500000D+00     
 14      0.450584D+02           0.378137D+00     
 15      0.217893D+02           0.101354D+00     
S   7
  1      0.975071D+03          -0.110590D-02     
  2      0.301881D+03          -0.109919D-01     
  3      0.117466D+03          -0.472161D-01     
  4      0.521702D+02          -0.960457D-01     
  5      0.120018D+02           0.329846D+00     
  6      0.624623D+01           0.500000D+00     
  7      0.333427D+01           0.303482D+00     
S   5
  1      0.379746D+02           0.670964D-02     
  2      0.115336D+02          -0.103622D+00     
  3      0.590403D+01          -0.228738D+00     
  4      0.367761D+01          -0.378910D+00     
  5      0.176346D+01           0.500000D+00     
S   1
  1      0.854280D+00           1.0000000        
S   1
  1      0.387062D+00           1.0000000        
S   1
  1      0.113344D+00           1.0000000        
S   1
  1      0.552145D-01           1.0000000        
S   1
  1      0.239420D-01           1.0000000        
P   12
  1      0.189287D+05           0.297035D-04     
  2      0.445525D+04           0.267084D-03     
  3      0.144936D+04           0.154549D-02     
  4      0.556757D+03           0.692428D-02     
  5      0.237955D+03           0.248325D-01     
  6      0.112668D+03           0.705741D-01     
  7      0.558308D+02           0.172901D+00     
  8      0.287249D+02           0.343191D+00     
  9      0.152894D+02           0.487560D+00     
 10      0.870247D+01           0.500000D+00     
 11      0.497112D+01           0.381319D+00     
 12      0.278430D+01           0.150394D+00     
P   5
  1      0.492356D+02          -0.362850D-02     
  2      0.169146D+02          -0.245352D-01     
  3      0.659857D+01          -0.128823D-01     
  4      0.278843D+01           0.205339D+00     
  5      0.143494D+01           0.500000D+00     
P   1
  1      0.729957D+00           1.0000000        
P   1
  1      0.364123D+00           1.0000000        
P   1
  1      0.172671D+00           1.0000000        
P   1
  1      0.520000D-01           1.0000000        
D   8
  1      0.266105D+03           0.349102D-03     
  2      0.756332D+02           0.343892D-02     
  3      0.282227D+02           0.190907D-01     
  4      0.116535D+02           0.719631D-01     
  5      0.559691D+01           0.144956D+00     
  6      0.295590D+01           0.275272D+00     
  7      0.160727D+01           0.396229D+00     
  8      0.867952D+00           0.500000D+00     
D   1
  1      0.446101D+00           1.0000000        
D   1
  1      0.216353D+00           1.0000000        
D   1
  1      0.975345D-01           1.0000000        
D   1
  1      0.396888D-01           1.0000000        
F   1
  1      0.108910D+02           1.0000000        
F   1
  1      0.340300D+01           1.0000000        
F   1
  1      0.126100D+01           1.0000000        
F   1
  1      0.525000D+00           1.0000000        
F   1
  1      0.219000D+00           1.0000000        
G   1
  1      0.588200D+01           1.0000000        
G   1
  1      0.147100D+01           1.0000000        
G   1
  1      0.368000D+00           1.0000000        
H   1
  1      0.317700D+01           1.0000000        
H   1
  1      0.706000D+00           1.0000000        
I   1
  1      0.160900D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ti
data:
TITANIUM
S   15
  1      0.199171D+08           0.125852D-05     
  2      0.308482D+07           0.934950D-05     
  3      0.719530D+06           0.477171D-04     
  4      0.208491D+06           0.195575D-03     
  5      0.695992D+05           0.691707D-03     
  6      0.257031D+05           0.219701D-02     
  7      0.102302D+05           0.643487D-02     
  8      0.431264D+04           0.175557D-01     
  9      0.190978D+04           0.442847D-01     
 10      0.881460D+03           0.102250D+00     
 11      0.421825D+03           0.211508D+00     
 12      0.204296D+03           0.382717D+00     
 13      0.994497D+02           0.500000D+00     
 14      0.489485D+02           0.373328D+00     
 15      0.238192D+02           0.986684D-01     
S   7
  1      0.107722D+04          -0.110654D-02     
  2      0.333467D+03          -0.110300D-01     
  3      0.129623D+03          -0.477196D-01     
  4      0.575566D+02          -0.970327D-01     
  5      0.132706D+02           0.335859D+00     
  6      0.691003D+01           0.500000D+00     
  7      0.370153D+01           0.292784D+00     
S   5
  1      0.427394D+02           0.620134D-02     
  2      0.132732D+02          -0.839810D-01     
  3      0.658875D+01          -0.252728D+00     
  4      0.386563D+01          -0.316382D+00     
  5      0.199275D+01           0.500000D+00     
S   1
  1      0.948798D+00           1.0000000        
S   1
  1      0.431452D+00           1.0000000        
S   1
  1      0.128992D+00           1.0000000        
S   1
  1      0.604171D-01           1.0000000        
S   1
  1      0.256470D-01           1.0000000        
P   12
  1      0.235666D+05           0.232519D-04     
  2      0.555650D+04           0.208311D-03     
  3      0.181342D+04           0.119849D-02     
  4      0.701424D+03           0.530063D-02     
  5      0.304403D+03           0.185850D-01     
  6      0.144520D+03           0.557014D-01     
  7      0.709186D+02           0.142432D+00     
  8      0.363170D+02           0.292417D+00     
  9      0.196227D+02           0.424047D+00     
 10      0.112103D+02           0.500000D+00     
 11      0.627701D+01           0.422426D+00     
 12      0.344141D+01           0.180992D+00     
P   5
  1      0.556258D+02          -0.381736D-02     
  2      0.192658D+02          -0.259518D-01     
  3      0.733651D+01          -0.177482D-01     
  4      0.335640D+01           0.190589D+00     
  5      0.174408D+01           0.500000D+00     
P   1
  1      0.888776D+00           1.0000000        
P   1
  1      0.440707D+00           1.0000000        
P   1
  1      0.206855D+00           1.0000000        
P   1
  1      0.610000D-01           1.0000000        
D   8
  1      0.320890D+03           0.301133D-03     
  2      0.934750D+02           0.291639D-02     
  3      0.349659D+02           0.167291D-01     
  4      0.146188D+02           0.625346D-01     
  5      0.713617D+01           0.132902D+00     
  6      0.370309D+01           0.268599D+00     
  7      0.197787D+01           0.399411D+00     
  8      0.104726D+01           0.500000D+00     
D   1
  1      0.530085D+00           1.0000000        
D   1
  1      0.254313D+00           1.0000000        
D   1
  1      0.115672D+00           1.0000000        
D   1
  1      0.487713D-01           1.0000000        
F   1
  1      0.119800D+02           1.0000000        
F   1
  1      0.374400D+01           1.0000000        
F   1
  1      0.138700D+01           1.0000000        
F   1
  1      0.578000D+00           1.0000000        
F   1
  1      0.241000D+00           1.0000000        
G   1
  1      0.647100D+01           1.0000000        
G   1
  1      0.161800D+01           1.0000000        
G   1
  1      0.404000D+00           1.0000000        
H   1
  1      0.349400D+01           1.0000000        
H   1
  1      0.776000D+00           1.0000000        
I   1
  1      0.177000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: V
data:
VANADIUM
S   15
  1      0.188874D+08           0.151508D-05     
  2      0.295561D+07           0.111022D-04     
  3      0.693626D+06           0.563176D-04     
  4      0.201814D+06           0.229685D-03     
  5      0.676508D+05           0.806830D-03     
  6      0.251383D+05           0.253412D-02     
  7      0.100906D+05           0.732234D-02     
  8      0.429227D+04           0.197087D-01     
  9      0.192051D+04           0.487058D-01     
 10      0.898968D+03           0.109336D+00     
 11      0.438560D+03           0.217802D+00     
 12      0.216915D+03           0.385333D+00     
 13      0.107022D+03           0.500000D+00     
 14      0.530842D+02           0.370796D+00     
 15      0.259830D+02           0.972489D-01     
S   7
  1      0.118040D+04          -0.111353D-02     
  2      0.365537D+03          -0.111089D-01     
  3      0.142025D+03          -0.482603D-01     
  4      0.631026D+02          -0.976976D-01     
  5      0.146458D+02           0.338303D+00     
  6      0.763345D+01           0.500000D+00     
  7      0.408931D+01           0.285059D+00     
S   5
  1      0.492793D+02           0.555320D-02     
  2      0.145741D+02          -0.802429D-01     
  3      0.708769D+01          -0.270415D+00     
  4      0.409100D+01          -0.252553D+00     
  5      0.218237D+01           0.500000D+00     
S   1
  1      0.104246D+01           1.0000000        
S   1
  1      0.475536D+00           1.0000000        
S   1
  1      0.145067D+00           1.0000000        
S   1
  1      0.658175D-01           1.0000000        
S   1
  1      0.273181D-01           1.0000000        
P   12
  1      0.285672D+05           0.190788D-04     
  2      0.675689D+04           0.169978D-03     
  3      0.221136D+04           0.973982D-03     
  4      0.860075D+03           0.425840D-02     
  5      0.377149D+03           0.148010D-01     
  6      0.178733D+03           0.460530D-01     
  7      0.875758D+02           0.119679D+00     
  8      0.449660D+02           0.251802D+00     
  9      0.244711D+02           0.384851D+00     
 10      0.138085D+02           0.500000D+00     
 11      0.762464D+01           0.444897D+00     
 12      0.414783D+01           0.203535D+00     
P   5
  1      0.631090D+02          -0.401763D-02     
  2      0.220592D+02          -0.274233D-01     
  3      0.875942D+01          -0.214976D-01     
  4      0.397549D+01           0.176795D+00     
  5      0.211281D+01           0.500000D+00     
P   1
  1      0.108510D+01           1.0000000        
P   1
  1      0.534609D+00           1.0000000        
P   1
  1      0.246282D+00           1.0000000        
P   1
  1      0.690000D-01           1.0000000        
D   8
  1      0.377838D+03           0.278128D-03     
  2      0.110659D+03           0.270623D-02     
  3      0.416049D+02           0.155757D-01     
  4      0.177218D+02           0.567333D-01     
  5      0.878498D+01           0.126934D+00     
  6      0.449084D+01           0.269000D+00     
  7      0.236764D+01           0.405329D+00     
  8      0.124680D+01           0.500000D+00     
D   1
  1      0.631193D+00           1.0000000        
D   1
  1      0.303059D+00           1.0000000        
D   1
  1      0.137985D+00           1.0000000        
D   1
  1      0.581480D-01           1.0000000        
F   1
  1      0.131780D+02           1.0000000        
F   1
  1      0.411800D+01           1.0000000        
F   1
  1      0.152500D+01           1.0000000        
F   1
  1      0.636000D+00           1.0000000        
F   1
  1      0.265000D+00           1.0000000        
G   1
  1      0.711800D+01           1.0000000        
G   1
  1      0.177900D+01           1.0000000        
G   1
  1      0.445000D+00           1.0000000        
H   1
  1      0.384400D+01           1.0000000        
H   1
  1      0.854000D+00           1.0000000        
I   1
  1      0.194700D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Cr
data:
CHROMIUM
S   15
  1      0.184573D+08           0.175834D-05     
  2      0.290458D+07           0.127610D-04     
  3      0.686473D+06           0.641708D-04     
  4      0.200428D+06           0.261369D-03     
  5      0.672506D+05           0.917071D-03     
  6      0.250588D+05           0.285975D-02     
  7      0.101108D+05           0.819284D-02     
  8      0.432102D+04           0.219162D-01     
  9      0.194410D+04           0.533412D-01     
 10      0.919522D+03           0.116969D+00     
 11      0.454883D+03           0.226278D+00     
 12      0.228775D+03           0.390747D+00     
 13      0.114402D+03           0.500000D+00     
 14      0.573780D+02           0.367381D+00     
 15      0.283561D+02           0.971485D-01     
S   7
  1      0.129428D+04          -0.111164D-02     
  2      0.400872D+03          -0.111070D-01     
  3      0.155643D+03          -0.486186D-01     
  4      0.690686D+02          -0.987334D-01     
  5      0.160680D+02           0.342495D+00     
  6      0.838046D+01           0.500000D+00     
  7      0.449542D+01           0.278630D+00     
S   5
  1      0.553605D+02           0.494352D-02     
  2      0.159876D+02          -0.740793D-01     
  3      0.758968D+01          -0.280410D+00     
  4      0.408928D+01          -0.201686D+00     
  5      0.238868D+01           0.500000D+00     
S   1
  1      0.113286D+01           1.0000000        
S   1
  1      0.518019D+00           1.0000000        
S   1
  1      0.160829D+00           1.0000000        
S   1
  1      0.711599D-01           1.0000000        
S   1
  1      0.290601D-01           1.0000000        
P   12
  1      0.337556D+05           0.164563D-04     
  2      0.806126D+04           0.144159D-03     
  3      0.266374D+04           0.812583D-03     
  4      0.104168D+04           0.355540D-02     
  5      0.455244D+03           0.127089D-01     
  6      0.212841D+03           0.408435D-01     
  7      0.104279D+03           0.105733D+00     
  8      0.539137D+02           0.225605D+00     
  9      0.293743D+02           0.366178D+00     
 10      0.163657D+02           0.500000D+00     
 11      0.901367D+01           0.456553D+00     
 12      0.494040D+01           0.222382D+00     
P   5
  1      0.720436D+02          -0.420685D-02     
  2      0.254513D+02          -0.288137D-01     
  3      0.107645D+02          -0.254245D-01     
  4      0.469424D+01           0.156271D+00     
  5      0.258200D+01           0.500000D+00     
P   1
  1      0.132833D+01           1.0000000        
P   1
  1      0.644468D+00           1.0000000        
P   1
  1      0.290194D+00           1.0000000        
P   1
  1      0.770000D-01           1.0000000        
D   8
  1      0.435329D+03           0.284461D-03     
  2      0.126740D+03           0.281950D-02     
  3      0.476621D+02           0.162361D-01     
  4      0.206550D+02           0.569326D-01     
  5      0.104847D+02           0.127463D+00     
  6      0.540122D+01           0.275670D+00     
  7      0.287023D+01           0.414223D+00     
  8      0.155339D+01           0.500000D+00     
D   1
  1      0.806228D+00           1.0000000        
D   1
  1      0.384444D+00           1.0000000        
D   1
  1      0.168839D+00           1.0000000        
D   1
  1      0.673057D-01           1.0000000        
F   1
  1      0.144960D+02           1.0000000        
F   1
  1      0.453000D+01           1.0000000        
F   1
  1      0.167800D+01           1.0000000        
F   1
  1      0.699000D+00           1.0000000        
F   1
  1      0.291000D+00           1.0000000        
G   1
  1      0.782900D+01           1.0000000        
G   1
  1      0.195700D+01           1.0000000        
G   1
  1      0.489000D+00           1.0000000        
H   1
  1      0.422800D+01           1.0000000        
H   1
  1      0.940000D+00           1.0000000        
I   1
  1      0.214200D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Mn
data:
MANGANESE
S   15
  1      0.185706D+08           0.196174D-05     
  2      0.292689D+07           0.141503D-04     
  3      0.695583D+06           0.706748D-04     
  4      0.203517D+06           0.287788D-03     
  5      0.682177D+05           0.101460D-02     
  6      0.253041D+05           0.318675D-02     
  7      0.101884D+05           0.909271D-02     
  8      0.437251D+04           0.240018D-01     
  9      0.197991D+04           0.578436D-01     
 10      0.940856D+03           0.125511D+00     
 11      0.469866D+03           0.235019D+00     
 12      0.240372D+03           0.394732D+00     
 13      0.121790D+03           0.500000D+00     
 14      0.615943D+02           0.363896D+00     
 15      0.306268D+02           0.952275D-01     
S   7
  1      0.139479D+04          -0.113446D-02     
  2      0.432222D+03          -0.113125D-01     
  3      0.167944D+03          -0.492836D-01     
  4      0.748318D+02          -0.984415D-01     
  5      0.176380D+02           0.340449D+00     
  6      0.919868D+01           0.500000D+00     
  7      0.491608D+01           0.272625D+00     
S   5
  1      0.629115D+02           0.453058D-02     
  2      0.173108D+02          -0.728127D-01     
  3      0.820556D+01          -0.280706D+00     
  4      0.426201D+01          -0.165660D+00     
  5      0.256870D+01           0.500000D+00     
S   1
  1      0.122371D+01           1.0000000        
S   1
  1      0.560232D+00           1.0000000        
S   1
  1      0.175186D+00           1.0000000        
S   1
  1      0.760602D-01           1.0000000        
S   1
  1      0.306617D-01           1.0000000        
P   12
  1      0.388916D+05           0.149443D-04     
  2      0.928399D+04           0.130745D-03     
  3      0.305938D+04           0.743093D-03     
  4      0.119516D+04           0.324623D-02     
  5      0.523541D+03           0.116100D-01     
  6      0.244534D+03           0.376802D-01     
  7      0.120044D+03           0.978838D-01     
  8      0.623125D+02           0.210442D+00     
  9      0.339856D+02           0.354589D+00     
 10      0.187921D+02           0.500000D+00     
 11      0.103158D+02           0.464404D+00     
 12      0.567316D+01           0.231456D+00     
P   5
  1      0.806566D+02          -0.429677D-02     
  2      0.287812D+02          -0.293167D-01     
  3      0.124365D+02          -0.289181D-01     
  4      0.547677D+01           0.137852D+00     
  5      0.303696D+01           0.500000D+00     
P   1
  1      0.155001D+01           1.0000000        
P   1
  1      0.743132D+00           1.0000000        
P   1
  1      0.330193D+00           1.0000000        
P   1
  1      0.860000D-01           1.0000000        
D   8
  1      0.491188D+03           0.248162D-03     
  2      0.146212D+03           0.238857D-02     
  3      0.554983D+02           0.137807D-01     
  4      0.241571D+02           0.495565D-01     
  5      0.120395D+02           0.120387D+00     
  6      0.604969D+01           0.267440D+00     
  7      0.310507D+01           0.418498D+00     
  8      0.159016D+01           0.500000D+00     
D   1
  1      0.796968D+00           1.0000000        
D   1
  1      0.384494D+00           1.0000000        
D   1
  1      0.176955D+00           1.0000000        
D   1
  1      0.752196D-01           1.0000000        
F   1
  1      0.159450D+02           1.0000000        
F   1
  1      0.498300D+01           1.0000000        
F   1
  1      0.184600D+01           1.0000000        
F   1
  1      0.769000D+00           1.0000000        
F   1
  1      0.320000D+00           1.0000000        
G   1
  1      0.861200D+01           1.0000000        
G   1
  1      0.215300D+01           1.0000000        
G   1
  1      0.538000D+00           1.0000000        
H   1
  1      0.465100D+01           1.0000000        
H   1
  1      0.103300D+01           1.0000000        
I   1
  1      0.235600D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Fe
data:
IRON
S   15
  1      0.192457D+08           0.210715D-05     
  2      0.302444D+07           0.152725D-04     
  3      0.718594D+06           0.760475D-04     
  4      0.211055D+06           0.307703D-03     
  5      0.709433D+05           0.108352D-02     
  6      0.262661D+05           0.343323D-02     
  7      0.104999D+05           0.990840D-02     
  8      0.448558D+04           0.260913D-01     
  9      0.203423D+04           0.622545D-01     
 10      0.968387D+03           0.134886D+00     
 11      0.483792D+03           0.248337D+00     
 12      0.250601D+03           0.400349D+00     
 13      0.128944D+03           0.500000D+00     
 14      0.658323D+02           0.360956D+00     
 15      0.329477D+02           0.934712D-01     
S   7
  1      0.150635D+04          -0.114556D-02     
  2      0.467008D+03          -0.114096D-01     
  3      0.181560D+03          -0.496710D-01     
  4      0.810517D+02          -0.985510D-01     
  5      0.192461D+02           0.340809D+00     
  6      0.100443D+02           0.500000D+00     
  7      0.537553D+01           0.268101D+00     
S   5
  1      0.682697D+02           0.498959D-02     
  2      0.193110D+02          -0.729537D-01     
  3      0.922467D+01          -0.291403D+00     
  4      0.510523D+01          -0.149678D+00     
  5      0.275490D+01           0.500000D+00     
S   1
  1      0.135479D+01           1.0000000        
S   1
  1      0.622735D+00           1.0000000        
S   1
  1      0.183343D+00           1.0000000        
S   1
  1      0.792769D-01           1.0000000        
S   1
  1      0.321960D-01           1.0000000        
P   12
  1      0.436964D+05           0.142851D-04     
  2      0.102125D+05           0.129685D-03     
  3      0.332912D+04           0.746293D-03     
  4      0.129722D+04           0.325123D-02     
  5      0.571526D+03           0.113911D-01     
  6      0.270272D+03           0.361894D-01     
  7      0.133798D+03           0.945343D-01     
  8      0.692919D+02           0.207911D+00     
  9      0.376452D+02           0.352027D+00     
 10      0.208209D+02           0.500000D+00     
 11      0.113518D+02           0.473937D+00     
 12      0.614748D+01           0.230267D+00     
P   5
  1      0.916047D+02          -0.390179D-02     
  2      0.330467D+02          -0.265498D-01     
  3      0.151385D+02          -0.276222D-01     
  4      0.569588D+01           0.164585D+00     
  5      0.318952D+01           0.500000D+00     
P   1
  1      0.164622D+01           1.0000000        
P   1
  1      0.797358D+00           1.0000000        
P   1
  1      0.358452D+00           1.0000000        
P   1
  1      0.960000D-01           1.0000000        
D   8
  1      0.542429D+03           0.267132D-03     
  2      0.163506D+03           0.252300D-02     
  3      0.625202D+02           0.144801D-01     
  4      0.274431D+02           0.519673D-01     
  5      0.136592D+02           0.130656D+00     
  6      0.686481D+01           0.284212D+00     
  7      0.359488D+01           0.424863D+00     
  8      0.191627D+01           0.500000D+00     
D   1
  1      0.987591D+00           1.0000000        
D   1
  1      0.470375D+00           1.0000000        
D   1
  1      0.206073D+00           1.0000000        
D   1
  1      0.813558D-01           1.0000000        
F   1
  1      0.175400D+02           1.0000000        
F   1
  1      0.548100D+01           1.0000000        
F   1
  1      0.203000D+01           1.0000000        
F   1
  1      0.846000D+00           1.0000000        
F   1
  1      0.352000D+00           1.0000000        
G   1
  1      0.947400D+01           1.0000000        
G   1
  1      0.236800D+01           1.0000000        
G   1
  1      0.592000D+00           1.0000000        
H   1
  1      0.511600D+01           1.0000000        
H   1
  1      0.113700D+01           1.0000000        
I   1
  1      0.259200D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Co
data:
COBALT
S   15
  1      0.205496D+08           0.218687D-05     
  2      0.320607D+07           0.160353D-04     
  3      0.755437D+06           0.807816D-04     
  4      0.220231D+06           0.329637D-03     
  5      0.736649D+05           0.116499D-02     
  6      0.272445D+05           0.368093D-02     
  7      0.109062D+05           0.106039D-01     
  8      0.465026D+04           0.281331D-01     
  9      0.209874D+04           0.673386D-01     
 10      0.996959D+03           0.145269D+00     
 11      0.497369D+03           0.264548D+00     
 12      0.259779D+03           0.409239D+00     
 13      0.135822D+03           0.500000D+00     
 14      0.700954D+02           0.359194D+00     
 15      0.352619D+02           0.917726D-01     
S   7
  1      0.164597D+04          -0.112744D-02     
  2      0.510253D+03          -0.112723D-01     
  3      0.198145D+03          -0.496487D-01     
  4      0.881339D+02          -0.999818D-01     
  5      0.208335D+02           0.347007D+00     
  6      0.108860D+02           0.500000D+00     
  7      0.586320D+01           0.264723D+00     
S   5
  1      0.745017D+02           0.501061D-02     
  2      0.212333D+02          -0.703134D-01     
  3      0.101861D+02          -0.292176D+00     
  4      0.559195D+01          -0.143521D+00     
  5      0.299602D+01           0.500000D+00     
S   1
  1      0.148275D+01           1.0000000        
S   1
  1      0.682807D+00           1.0000000        
S   1
  1      0.192829D+00           1.0000000        
S   1
  1      0.826733D-01           1.0000000        
S   1
  1      0.337107D-01           1.0000000        
P   12
  1      0.478569D+05           0.142656D-04     
  2      0.109949D+05           0.133550D-03     
  3      0.355161D+04           0.775882D-03     
  4      0.138163D+04           0.336906D-02     
  5      0.610716D+03           0.116757D-01     
  6      0.290309D+03           0.368361D-01     
  7      0.143856D+03           0.967969D-01     
  8      0.742488D+02           0.215124D+00     
  9      0.401382D+02           0.361821D+00     
 10      0.223012D+02           0.500000D+00     
 11      0.122262D+02           0.471057D+00     
 12      0.659391D+01           0.226693D+00     
P   5
  1      0.104960D+03          -0.332109D-02     
  2      0.385078D+02          -0.222979D-01     
  3      0.185552D+02          -0.270214D-01     
  4      0.583067D+01           0.203987D+00     
  5      0.321898D+01           0.500000D+00     
P   1
  1      0.168631D+01           1.0000000        
P   1
  1      0.830154D+00           1.0000000        
P   1
  1      0.379726D+00           1.0000000        
P   1
  1      0.105000D+00           1.0000000        
D   8
  1      0.586036D+03           0.263838D-03     
  2      0.177882D+03           0.246226D-02     
  3      0.683303D+02           0.140842D-01     
  4      0.299851D+02           0.513778D-01     
  5      0.147888D+02           0.131719D+00     
  6      0.736406D+01           0.288294D+00     
  7      0.377541D+01           0.434110D+00     
  8      0.194621D+01           0.500000D+00     
D   1
  1      0.980631D+00           1.0000000        
D   1
  1      0.468173D+00           1.0000000        
D   1
  1      0.209296D+00           1.0000000        
D   1
  1      0.853651D-01           1.0000000        
F   1
  1      0.192940D+02           1.0000000        
F   1
  1      0.602900D+01           1.0000000        
F   1
  1      0.223300D+01           1.0000000        
F   1
  1      0.930000D+00           1.0000000        
F   1
  1      0.388000D+00           1.0000000        
G   1
  1      0.104210D+02           1.0000000        
G   1
  1      0.260500D+01           1.0000000        
G   1
  1      0.651000D+00           1.0000000        
H   1
  1      0.562700D+01           1.0000000        
H   1
  1      0.125100D+01           1.0000000        
I   1
  1      0.285100D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ni
data:
NICKEL
S   15
  1      0.226045D+08           0.219086D-05     
  2      0.348523D+07           0.162319D-04     
  3      0.821666D+06           0.814234D-04     
  4      0.239480D+06           0.333630D-03     
  5      0.796578D+05           0.119423D-02     
  6      0.291311D+05           0.385015D-02     
  7      0.114991D+05           0.112832D-01     
  8      0.485951D+04           0.300259D-01     
  9      0.218266D+04           0.721476D-01     
 10      0.103004D+04           0.156927D+00     
 11      0.510109D+03           0.284004D+00     
 12      0.267583D+03           0.420858D+00     
 13      0.141926D+03           0.500000D+00     
 14      0.741847D+02           0.354104D+00     
 15      0.377044D+02           0.901069D-01     
S   7
  1      0.176505D+04          -0.113666D-02     
  2      0.547730D+03          -0.113487D-01     
  3      0.212790D+03          -0.499457D-01     
  4      0.948156D+02          -0.998019D-01     
  5      0.226056D+02           0.345495D+00     
  6      0.118134D+02           0.500000D+00     
  7      0.636556D+01           0.260542D+00     
S   5
  1      0.841327D+02           0.499565D-02     
  2      0.228770D+02          -0.720132D-01     
  3      0.112777D+02          -0.287812D+00     
  4      0.636136D+01          -0.153742D+00     
  5      0.328630D+01           0.500000D+00     
S   1
  1      0.162758D+01           1.0000000        
S   1
  1      0.747227D+00           1.0000000        
S   1
  1      0.204487D+00           1.0000000        
S   1
  1      0.866468D-01           1.0000000        
S   1
  1      0.352366D-01           1.0000000        
P   12
  1      0.510862D+05           0.145663D-04     
  2      0.119182D+05           0.132908D-03     
  3      0.386859D+04           0.773381D-03     
  4      0.149475D+04           0.344493D-02     
  5      0.649286D+03           0.124408D-01     
  6      0.303371D+03           0.399970D-01     
  7      0.148806D+03           0.105083D+00     
  8      0.765799D+02           0.231376D+00     
  9      0.412660D+02           0.381195D+00     
 10      0.231192D+02           0.500000D+00     
 11      0.127891D+02           0.460163D+00     
 12      0.689828D+01           0.211392D+00     
P   5
  1      0.119262D+03          -0.280547D-02     
  2      0.443601D+02          -0.186957D-01     
  3      0.216479D+02          -0.267984D-01     
  4      0.615618D+01           0.221229D+00     
  5      0.329528D+01           0.500000D+00     
P   1
  1      0.171617D+01           1.0000000        
P   1
  1      0.852964D+00           1.0000000        
P   1
  1      0.396586D+00           1.0000000        
P   1
  1      0.115000D+00           1.0000000        
D   8
  1      0.619736D+03           0.275732D-03     
  2      0.188040D+03           0.257032D-02     
  3      0.722598D+02           0.147041D-01     
  4      0.315336D+02           0.545355D-01     
  5      0.154737D+02           0.136871D+00     
  6      0.774043D+01           0.294152D+00     
  7      0.392820D+01           0.441023D+00     
  8      0.197449D+01           0.500000D+00     
D   1
  1      0.971624D+00           1.0000000        
D   1
  1      0.461751D+00           1.0000000        
D   1
  1      0.208723D+00           1.0000000        
D   1
  1      0.869191D-01           1.0000000        
F   1
  1      0.212230D+02           1.0000000        
F   1
  1      0.663200D+01           1.0000000        
F   1
  1      0.245600D+01           1.0000000        
F   1
  1      0.102300D+01           1.0000000        
F   1
  1      0.426000D+00           1.0000000        
G   1
  1      0.114630D+02           1.0000000        
G   1
  1      0.286600D+01           1.0000000        
G   1
  1      0.716000D+00           1.0000000        
H   1
  1      0.619000D+01           1.0000000        
H   1
  1      0.137600D+01           1.0000000        
I   1
  1      0.313600D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Cu
data:
COPPER
S   15
  1      0.256111D+08           0.211418D-05     
  2      0.388611D+07           0.160459D-04     
  3      0.900618D+06           0.824480D-04     
  4      0.258574D+06           0.343350D-03     
  5      0.852131D+05           0.123868D-02     
  6      0.309973D+05           0.400950D-02     
  7      0.121964D+05           0.117902D-01     
  8      0.513313D+04           0.316136D-01     
  9      0.228938D+04           0.768955D-01     
 10      0.106952D+04           0.169364D+00     
 11      0.523482D+03           0.307663D+00     
 12      0.273834D+03           0.437748D+00     
 13      0.147140D+03           0.500000D+00     
 14      0.777576D+02           0.349196D+00     
 15      0.396919D+02           0.856354D-01     
S   7
  1      0.188923D+04          -0.114973D-02     
  2      0.586940D+03          -0.114234D-01     
  3      0.228495D+03          -0.501121D-01     
  4      0.101982D+03          -0.100040D+00     
  5      0.243964D+02           0.347340D+00     
  6      0.127560D+02           0.500000D+00     
  7      0.691793D+01           0.257316D+00     
S   5
  1      0.942983D+02           0.490567D-02     
  2      0.245710D+02          -0.722470D-01     
  3      0.123549D+02          -0.286782D+00     
  4      0.666157D+01          -0.180329D+00     
  5      0.371875D+01           0.500000D+00     
S   1
  1      0.179241D+01           1.0000000        
S   1
  1      0.815833D+00           1.0000000        
S   1
  1      0.219506D+00           1.0000000        
S   1
  1      0.920536D-01           1.0000000        
S   1
  1      0.371695D-01           1.0000000        
P   12
  1      0.531070D+05           0.155697D-04     
  2      0.125631D+05           0.139506D-03     
  3      0.408436D+04           0.817710D-03     
  4      0.156046D+04           0.376647D-02     
  5      0.664863D+03           0.140942D-01     
  6      0.306232D+03           0.457335D-01     
  7      0.148640D+03           0.120172D+00     
  8      0.762992D+02           0.258189D+00     
  9      0.410098D+02           0.413331D+00     
 10      0.231630D+02           0.500000D+00     
 11      0.130403D+02           0.434124D+00     
 12      0.715043D+01           0.187897D+00     
P   5
  1      0.133802D+03          -0.252674D-02     
  2      0.501926D+02          -0.169774D-01     
  3      0.243410D+02          -0.275489D-01     
  4      0.664748D+01           0.226210D+00     
  5      0.350949D+01           0.500000D+00     
P   1
  1      0.181603D+01           1.0000000        
P   1
  1      0.903634D+00           1.0000000        
P   1
  1      0.422277D+00           1.0000000        
P   1
  1      0.127000D+00           1.0000000        
D   8
  1      0.641904D+03           0.315158D-03     
  2      0.196087D+03           0.289240D-02     
  3      0.755527D+02           0.165093D-01     
  4      0.327362D+02           0.626001D-01     
  5      0.158964D+02           0.153887D+00     
  6      0.804568D+01           0.311478D+00     
  7      0.415375D+01           0.445895D+00     
  8      0.212279D+01           0.500000D+00     
D   1
  1      0.105070D+01           1.0000000        
D   1
  1      0.494072D+00           1.0000000        
D   1
  1      0.217365D+00           1.0000000        
D   1
  1      0.871381D-01           1.0000000        
F   1
  1      0.233460D+02           1.0000000        
F   1
  1      0.729500D+01           1.0000000        
F   1
  1      0.270200D+01           1.0000000        
F   1
  1      0.112600D+01           1.0000000        
F   1
  1      0.469000D+00           1.0000000        
G   1
  1      0.126090D+02           1.0000000        
G   1
  1      0.315200D+01           1.0000000        
G   1
  1      0.788000D+00           1.0000000        
H   1
  1      0.680900D+01           1.0000000        
H   1
  1      0.151300D+01           1.0000000        
I   1
  1      0.345000D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Zn
data:
ZINC
S   15
  1      0.298846D+08           0.197606D-05     
  2      0.444103D+07           0.154954D-04     
  3      0.100850D+07           0.815541D-04     
  4      0.285707D+06           0.344357D-03     
  5      0.932377D+05           0.125601D-02     
  6      0.336396D+05           0.410920D-02     
  7      0.131122D+05           0.122701D-01     
  8      0.544719D+04           0.336182D-01     
  9      0.239116D+04           0.834048D-01     
 10      0.110230D+04           0.184852D+00     
 11      0.534666D+03           0.333989D+00     
 12      0.279950D+03           0.454940D+00     
 13      0.152902D+03           0.500000D+00     
 14      0.819997D+02           0.347730D+00     
 15      0.422250D+02           0.850688D-01     
S   7
  1      0.203667D+04          -0.113510D-02     
  2      0.632194D+03          -0.113330D-01     
  3      0.245709D+03          -0.501037D-01     
  4      0.109467D+03          -0.100282D+00     
  5      0.263134D+02           0.345369D+00     
  6      0.137626D+02           0.500000D+00     
  7      0.744532D+01           0.253740D+00     
S   5
  1      0.999249D+02           0.510897D-02     
  2      0.279777D+02          -0.582307D-01     
  3      0.142912D+02          -0.265808D+00     
  4      0.774378D+01          -0.207162D+00     
  5      0.401172D+01           0.500000D+00     
S   1
  1      0.192590D+01           1.0000000        
S   1
  1      0.874163D+00           1.0000000        
S   1
  1      0.230815D+00           1.0000000        
S   1
  1      0.951386D-01           1.0000000        
S   1
  1      0.380407D-01           1.0000000        
P   12
  1      0.539553D+05           0.183250D-04     
  2      0.123443D+05           0.173174D-03     
  3      0.394773D+04           0.103389D-02     
  4      0.150075D+04           0.475235D-02     
  5      0.638896D+03           0.176500D-01     
  6      0.295786D+03           0.558156D-01     
  7      0.143621D+03           0.145510D+00     
  8      0.737255D+02           0.302644D+00     
  9      0.394821D+02           0.468070D+00     
 10      0.224753D+02           0.500000D+00     
 11      0.130682D+02           0.400287D+00     
 12      0.734135D+01           0.167480D+00     
P   5
  1      0.150514D+03          -0.221475D-02     
  2      0.568231D+02          -0.151133D-01     
  3      0.273055D+02          -0.277596D-01     
  4      0.712040D+01           0.231158D+00     
  5      0.368647D+01           0.500000D+00     
P   1
  1      0.188317D+01           1.0000000        
P   1
  1      0.935559D+00           1.0000000        
P   1
  1      0.440409D+00           1.0000000        
P   1
  1      0.139000D+00           1.0000000        
D   8
  1      0.649649D+03           0.361818D-03     
  2      0.199853D+03           0.324451D-02     
  3      0.775800D+02           0.181699D-01     
  4      0.335213D+02           0.698837D-01     
  5      0.160073D+02           0.172631D+00     
  6      0.802652D+01           0.338737D+00     
  7      0.407077D+01           0.467311D+00     
  8      0.203678D+01           0.500000D+00     
D   1
  1      0.989938D+00           1.0000000        
D   1
  1      0.460936D+00           1.0000000        
D   1
  1      0.202541D+00           1.0000000        
D   1
  1      0.815699D-01           1.0000000        
F   1
  1      0.256800D+02           1.0000000        
F   1
  1      0.802500D+01           1.0000000        
F   1
  1      0.297200D+01           1.0000000        
F   1
  1      0.123800D+01           1.0000000        
F   1
  1      0.516000D+00           1.0000000        
G   1
  1      0.138700D+02           1.0000000        
G   1
  1      0.346800D+01           1.0000000        
G   1
  1      0.867000D+00           1.0000000        
H   1
  1      0.749000D+01           1.0000000        
H   1
  1      0.166400D+01           1.0000000        
I   1
  1      0.379500D+01           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ga
data:
GALLIUM
S   15
  1      0.317897D+08           0.191727D-05     
  2      0.479180D+07           0.147612D-04     
  3      0.109755D+07           0.770084D-04     
  4      0.312559D+06           0.323408D-03     
  5      0.102497D+06           0.117067D-02     
  6      0.372460D+05           0.378205D-02     
  7      0.146845D+05           0.110700D-01     
  8      0.619546D+04           0.296946D-01     
  9      0.275759D+04           0.732585D-01     
 10      0.127579D+04           0.165506D+00     
 11      0.615885D+03           0.308258D+00     
 12      0.318181D+03           0.442335D+00     
 13      0.170733D+03           0.500000D+00     
 14      0.907581D+02           0.355371D+00     
 15      0.465457D+02           0.918630D-01     
S   7
  1      0.218261D+04          -0.113285D-02     
  2      0.677389D+03          -0.113365D-01     
  3      0.263003D+03          -0.503713D-01     
  4      0.117076D+03          -0.100778D+00     
  5      0.283393D+02           0.343442D+00     
  6      0.148891D+02           0.500000D+00     
  7      0.809862D+01           0.256983D+00     
S   5
  1      0.108697D+03           0.506683D-02     
  2      0.291845D+02          -0.665570D-01     
  3      0.147842D+02          -0.290103D+00     
  4      0.765786D+01          -0.202516D+00     
  5      0.446234D+01           0.500000D+00     
S   1
  1      0.214440D+01           1.0000000        
S   1
  1      0.993379D+00           1.0000000        
S   1
  1      0.296961D+00           1.0000000        
S   1
  1      0.131876D+00           1.0000000        
S   1
  1      0.548687D-01           1.0000000        
P   12
  1      0.780161D+05           0.104417D-04     
  2      0.155608D+05           0.120711D-03     
  3      0.470851D+04           0.773983D-03     
  4      0.173820D+04           0.371178D-02     
  5      0.726979D+03           0.141588D-01     
  6      0.333145D+03           0.453571D-01     
  7      0.162036D+03           0.117324D+00     
  8      0.835964D+02           0.248738D+00     
  9      0.441915D+02           0.418850D+00     
 10      0.237275D+02           0.500000D+00     
 11      0.126016D+02           0.360826D+00     
 12      0.645261D+01           0.101315D+00     
P   6
  1      0.169133D+03          -0.146991D-02     
  2      0.642394D+02          -0.102062D-01     
  3      0.305479D+02          -0.211265D-01     
  4      0.753507D+01           0.186182D+00     
  5      0.369293D+01           0.469512D+00     
  6      0.182601D+01           0.500000D+00     
P   3
  1      0.318733D+01          -0.224581D+00     
  2      0.159559D+01          -0.308838D+00     
  3      0.912830D+00           0.500000D+00     
P   1
  1      0.376150D+00           1.0000000        
P   1
  1      0.159539D+00           1.0000000        
P   1
  1      0.656630D-01           1.0000000        
P   1
  1      0.252439D-01           1.0000000        
D   9
  1      0.658119D+03           0.756416D-03     
  2      0.198378D+03           0.701018D-02     
  3      0.765621D+02           0.387230D-01     
  4      0.329397D+02           0.148698D+00     
  5      0.154239D+02           0.365386D+00     
  6      0.768320D+01           0.666860D+00     
  7      0.388095D+01           0.846397D+00     
  8      0.201063D+01           0.761803D+00     
  9      0.116818D+01           0.500000D+00     
D   1
  1      0.680386D+00           1.0000000        
D   1
  1      0.332083D+00           1.0000000        
D   1
  1      0.142641D+00           1.0000000        
D   1
  1      0.560000D-01           1.0000000        
F   1
  1      0.525000D+01           1.0000000        
F   1
  1      0.155000D+01           1.0000000        
F   1
  1      0.450000D+00           1.0000000        
F   1
  1      0.182000D+00           1.0000000        
G   1
  1      0.140000D+01           1.0000000        
G   1
  1      0.350000D+00           1.0000000        
H   1
  1      0.520000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Ge
data:
GERMANIUM
S   15
  1      0.399802D+08           0.150863D-05     
  2      0.579509D+07           0.122129D-04     
  3      0.129950D+07           0.649459D-04     
  4      0.366380D+06           0.274960D-03     
  5      0.119455D+06           0.100090D-02     
  6      0.432428D+05           0.324673D-02     
  7      0.170013D+05           0.953503D-02     
  8      0.716493D+04           0.255940D-01     
  9      0.319318D+04           0.631592D-01     
 10      0.148133D+04           0.143124D+00     
 11      0.717138D+03           0.272362D+00     
 12      0.365680D+03           0.421042D+00     
 13      0.190511D+03           0.500000D+00     
 14      0.989576D+02           0.356218D+00     
 15      0.501180D+02           0.909788D-01     
S   7
  1      0.233168D+04          -0.113520D-02     
  2      0.723450D+03          -0.113727D-01     
  3      0.280893D+03          -0.506303D-01     
  4      0.125028D+03          -0.101366D+00     
  5      0.304084D+02           0.342876D+00     
  6      0.160379D+02           0.500000D+00     
  7      0.875708D+01           0.259577D+00     
S   5
  1      0.118962D+03           0.522300D-02     
  2      0.306527D+02          -0.749830D-01     
  3      0.157093D+02          -0.305702D+00     
  4      0.837045D+01          -0.189758D+00     
  5      0.476419D+01           0.500000D+00     
S   1
  1      0.235287D+01           1.0000000        
S   1
  1      0.111276D+01           1.0000000        
S   1
  1      0.364622D+00           1.0000000        
S   1
  1      0.167446D+00           1.0000000        
S   1
  1      0.705201D-01           1.0000000        
P   12
  1      0.806017D+05           0.105297D-04     
  2      0.170742D+05           0.111289D-03     
  3      0.531641D+04           0.684965D-03     
  4      0.199385D+04           0.323081D-02     
  5      0.838546D+03           0.124170D-01     
  6      0.381777D+03           0.410365D-01     
  7      0.184076D+03           0.109033D+00     
  8      0.938999D+02           0.239265D+00     
  9      0.491825D+02           0.411195D+00     
 10      0.262863D+02           0.500000D+00     
 11      0.139348D+02           0.369392D+00     
 12      0.713061D+01           0.107585D+00     
P   6
  1      0.179565D+03          -0.151115D-02     
  2      0.681262D+02          -0.105524D-01     
  3      0.323564D+02          -0.211412D-01     
  4      0.828487D+01           0.176333D+00     
  5      0.413085D+01           0.448945D+00     
  6      0.205889D+01           0.500000D+00     
P   3
  1      0.367763D+01          -0.190203D+00     
  2      0.184307D+01          -0.315563D+00     
  3      0.103952D+01           0.500000D+00     
P   1
  1      0.436406D+00           1.0000000        
P   1
  1      0.195914D+00           1.0000000        
P   1
  1      0.850052D-01           1.0000000        
P   1
  1      0.342488D-01           1.0000000        
D   9
  1      0.763872D+03           0.564657D-03     
  2      0.233678D+03           0.507676D-02     
  3      0.917026D+02           0.277850D-01     
  4      0.401249D+02           0.106402D+00     
  5      0.192684D+02           0.266234D+00     
  6      0.973719D+01           0.515817D+00     
  7      0.503657D+01           0.690197D+00     
  8      0.267280D+01           0.668470D+00     
  9      0.152733D+01           0.500000D+00     
D   1
  1      0.862814D+00           1.0000000        
D   1
  1      0.423482D+00           1.0000000        
D   1
  1      0.179751D+00           1.0000000        
D   1
  1      0.730000D-01           1.0000000        
F   1
  1      0.578000D+01           1.0000000        
F   1
  1      0.170000D+01           1.0000000        
F   1
  1      0.500000D+00           1.0000000        
F   1
  1      0.200000D+00           1.0000000        
G   1
  1      0.154000D+01           1.0000000        
G   1
  1      0.380000D+00           1.0000000        
H   1
  1      0.520000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: As
data:
ARSENIC
S   15
  1      0.488573D+08           0.122103D-05     
  2      0.698839D+07           0.100820D-04     
  3      0.154884D+07           0.543088D-04     
  4      0.433701D+06           0.231549D-03     
  5      0.140707D+06           0.847023D-03     
  6      0.508672D+05           0.274175D-02     
  7      0.200250D+05           0.804428D-02     
  8      0.843190D+04           0.217424D-01     
  9      0.374743D+04           0.541277D-01     
 10      0.173583D+04           0.123463D+00     
 11      0.839174D+03           0.242024D+00     
 12      0.419834D+03           0.403397D+00     
 13      0.212131D+03           0.500000D+00     
 14      0.108030D+03           0.357174D+00     
 15      0.543921D+02           0.927460D-01     
S   7
  1      0.249386D+04          -0.112362D-02     
  2      0.773719D+03          -0.112830D-01     
  3      0.300147D+03          -0.505152D-01     
  4      0.133418D+03          -0.101579D+00     
  5      0.324717D+02           0.343904D+00     
  6      0.171296D+02           0.500000D+00     
  7      0.939110D+01           0.256211D+00     
S   5
  1      0.129335D+03           0.552361D-02     
  2      0.323807D+02          -0.833571D-01     
  3      0.168764D+02          -0.320060D+00     
  4      0.929535D+01          -0.197693D+00     
  5      0.516293D+01           0.500000D+00     
S   1
  1      0.259789D+01           1.0000000        
S   1
  1      0.124588D+01           1.0000000        
S   1
  1      0.441757D+00           1.0000000        
S   1
  1      0.206779D+00           1.0000000        
S   1
  1      0.870709D-01           1.0000000        
P   12
  1      0.832005D+05           0.104350D-04     
  2      0.185181D+05           0.104194D-03     
  3      0.578181D+04           0.650084D-03     
  4      0.216048D+04           0.307532D-02     
  5      0.913162D+03           0.115813D-01     
  6      0.421469D+03           0.373116D-01     
  7      0.205702D+03           0.992825D-01     
  8      0.104640D+03           0.227165D+00     
  9      0.539783D+02           0.407014D+00     
 10      0.283573D+02           0.500000D+00     
 11      0.149011D+02           0.360824D+00     
 12      0.762995D+01           0.102217D+00     
P   6
  1      0.197940D+03          -0.145767D-02     
  2      0.748396D+02          -0.105079D-01     
  3      0.351041D+02          -0.222421D-01     
  4      0.896247D+01           0.178101D+00     
  5      0.453478D+01           0.449595D+00     
  6      0.226309D+01           0.500000D+00     
P   3
  1      0.437217D+01          -0.169938D+00     
  2      0.207197D+01          -0.320429D+00     
  3      0.115525D+01           0.500000D+00     
P   1
  1      0.497292D+00           1.0000000        
P   1
  1      0.229438D+00           1.0000000        
P   1
  1      0.102573D+00           1.0000000        
P   1
  1      0.427279D-01           1.0000000        
D   9
  1      0.934789D+03           0.376688D-03     
  2      0.286704D+03           0.346055D-02     
  3      0.112209D+03           0.194037D-01     
  4      0.498721D+02           0.727976D-01     
  5      0.246435D+02           0.187375D+00     
  6      0.126228D+02           0.385968D+00     
  7      0.667789D+01           0.556888D+00     
  8      0.359202D+01           0.602498D+00     
  9      0.199659D+01           0.500000D+00     
D   1
  1      0.113139D+01           1.0000000        
D   1
  1      0.607561D+00           1.0000000        
D   1
  1      0.288290D+00           1.0000000        
D   1
  1      0.800000D-01           1.0000000        
F   1
  1      0.636000D+01           1.0000000        
F   1
  1      0.187000D+01           1.0000000        
F   1
  1      0.550000D+00           1.0000000        
F   1
  1      0.220000D+00           1.0000000        
G   1
  1      0.169000D+01           1.0000000        
G   1
  1      0.420000D+00           1.0000000        
H   1
  1      0.630000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Se
data:
SELENIUM
S   15
  1      0.586003D+08           0.102085D-05     
  2      0.836151D+07           0.842435D-05     
  3      0.185983D+07           0.451900D-04     
  4      0.521131D+06           0.192612D-03     
  5      0.169361D+06           0.703273D-03     
  6      0.610539D+05           0.230211D-02     
  7      0.238471D+05           0.684171D-02     
  8      0.998070D+04           0.185985D-01     
  9      0.441764D+04           0.467919D-01     
 10      0.203611D+04           0.108257D+00     
 11      0.977766D+03           0.219132D+00     
 12      0.481082D+03           0.385280D+00     
 13      0.237999D+03           0.500000D+00     
 14      0.118883D+03           0.369585D+00     
 15      0.589644D+02           0.974788D-01     
S   7
  1      0.266398D+04          -0.111442D-02     
  2      0.825731D+03          -0.112341D-01     
  3      0.319887D+03          -0.506055D-01     
  4      0.141997D+03          -0.102026D+00     
  5      0.346509D+02           0.343874D+00     
  6      0.183144D+02           0.500000D+00     
  7      0.100655D+02           0.256077D+00     
S   5
  1      0.139409D+03           0.561152D-02     
  2      0.344735D+02          -0.851190D-01     
  3      0.180735D+02          -0.326145D+00     
  4      0.987224D+01          -0.202483D+00     
  5      0.557495D+01           0.500000D+00     
S   1
  1      0.283165D+01           1.0000000        
S   1
  1      0.137636D+01           1.0000000        
S   1
  1      0.495754D+00           1.0000000        
S   1
  1      0.232898D+00           1.0000000        
S   1
  1      0.998422D-01           1.0000000        
P   12
  1      0.865060D+05           0.108416D-04     
  2      0.198571D+05           0.100222D-03     
  3      0.646765D+04           0.579215D-03     
  4      0.248508D+04           0.266043D-02     
  5      0.105575D+04           0.102809D-01     
  6      0.478067D+03           0.351650D-01     
  7      0.228327D+03           0.970482D-01     
  8      0.114725D+03           0.223746D+00     
  9      0.592358D+02           0.399419D+00     
 10      0.313078D+02           0.500000D+00     
 11      0.164911D+02           0.376290D+00     
 12      0.842866D+01           0.112003D+00     
P   6
  1      0.203314D+03          -0.158905D-02     
  2      0.771979D+02          -0.111729D-01     
  3      0.365496D+02          -0.218251D-01     
  4      0.981521D+01           0.168674D+00     
  5      0.504045D+01           0.435098D+00     
  6      0.252696D+01           0.500000D+00     
P   3
  1      0.511062D+01          -0.154666D+00     
  2      0.237203D+01          -0.324170D+00     
  3      0.129228D+01           0.500000D+00     
P   1
  1      0.575821D+00           1.0000000        
P   1
  1      0.265678D+00           1.0000000        
P   1
  1      0.116489D+00           1.0000000        
P   1
  1      0.481708D-01           1.0000000        
D   9
  1      0.117658D+04           0.231147D-03     
  2      0.363018D+03           0.217600D-02     
  3      0.141643D+03           0.124495D-01     
  4      0.642490D+02           0.458197D-01     
  5      0.320407D+02           0.130635D+00     
  6      0.162388D+02           0.290458D+00     
  7      0.857006D+01           0.456851D+00     
  8      0.460195D+01           0.533740D+00     
  9      0.248413D+01           0.500000D+00     
D   1
  1      0.129869D+01           1.0000000        
D   1
  1      0.643805D+00           1.0000000        
D   1
  1      0.286774D+00           1.0000000        
D   1
  1      0.105000D+00           1.0000000        
F   1
  1      0.699000D+01           1.0000000        
F   1
  1      0.206000D+01           1.0000000        
F   1
  1      0.610000D+00           1.0000000        
F   1
  1      0.242000D+00           1.0000000        
G   1
  1      0.186000D+01           1.0000000        
G   1
  1      0.460000D+00           1.0000000        
H   1
  1      0.700000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Br
data:
BROMINE
S   15
  1      0.682602D+08           0.884918D-06     
  2      0.997266D+07           0.707959D-05     
  3      0.224640D+07           0.375906D-04     
  4      0.631907D+06           0.160165D-03     
  5      0.205314D+06           0.585951D-03     
  6      0.740388D+05           0.191451D-02     
  7      0.289187D+05           0.571792D-02     
  8      0.120313D+05           0.158098D-01     
  9      0.527192D+04           0.405856D-01     
 10      0.240406D+04           0.959567D-01     
 11      0.113712D+04           0.203111D+00     
 12      0.546811D+03           0.373704D+00     
 13      0.265678D+03           0.500000D+00     
 14      0.131215D+03           0.383653D+00     
 15      0.645067D+02           0.106637D+00     
S   7
  1      0.282346D+04          -0.111094D-02     
  2      0.876196D+03          -0.111687D-01     
  3      0.339866D+03          -0.502879D-01     
  4      0.150964D+03          -0.101617D+00     
  5      0.367442D+02           0.346816D+00     
  6      0.193363D+02           0.500000D+00     
  7      0.106306D+02           0.245813D+00     
S   5
  1      0.149337D+03           0.587962D-02     
  2      0.370419D+02          -0.846224D-01     
  3      0.196627D+02          -0.330433D+00     
  4      0.107491D+02          -0.226285D+00     
  5      0.606527D+01           0.500000D+00     
S   1
  1      0.310054D+01           1.0000000        
S   1
  1      0.152321D+01           1.0000000        
S   1
  1      0.558613D+00           1.0000000        
S   1
  1      0.261398D+00           1.0000000        
S   1
  1      0.112860D+00           1.0000000        
P   12
  1      0.898137D+05           0.108672D-04     
  2      0.210558D+05           0.992105D-04     
  3      0.678087D+04           0.591112D-03     
  4      0.258685D+04           0.271427D-02     
  5      0.110691D+04           0.101851D-01     
  6      0.509663D+03           0.336990D-01     
  7      0.247021D+03           0.920415D-01     
  8      0.124536D+03           0.216774D+00     
  9      0.637600D+02           0.398305D+00     
 10      0.333079D+02           0.500000D+00     
 11      0.174562D+02           0.366900D+00     
 12      0.894689D+01           0.106115D+00     
P   6
  1      0.226864D+03          -0.146990D-02     
  2      0.858138D+02          -0.108018D-01     
  3      0.399917D+02          -0.231515D-01     
  4      0.104840D+02           0.174739D+00     
  5      0.545491D+01           0.432568D+00     
  6      0.277767D+01           0.500000D+00     
P   3
  1      0.595424D+01          -0.141728D+00     
  2      0.274479D+01          -0.323889D+00     
  3      0.141676D+01           0.500000D+00     
P   1
  1      0.656931D+00           1.0000000        
P   1
  1      0.305858D+00           1.0000000        
P   1
  1      0.134891D+00           1.0000000        
P   1
  1      0.566613D-01           1.0000000        
D   9
  1      0.156314D+04           0.132796D-03     
  2      0.478617D+03           0.126961D-02     
  3      0.190571D+03           0.703232D-02     
  4      0.873226D+02           0.281208D-01     
  5      0.420742D+02           0.938136D-01     
  6      0.210134D+02           0.218020D+00     
  7      0.110566D+02           0.379951D+00     
  8      0.586471D+01           0.494469D+00     
  9      0.305986D+01           0.500000D+00     
D   1
  1      0.153322D+01           1.0000000        
D   1
  1      0.732465D+00           1.0000000        
D   1
  1      0.303998D+00           1.0000000        
D   1
  1      0.114000D+00           1.0000000        
F   1
  1      0.769000D+01           1.0000000        
F   1
  1      0.226000D+01           1.0000000        
F   1
  1      0.670000D+00           1.0000000        
F   1
  1      0.266000D+00           1.0000000        
G   1
  1      0.204000D+01           1.0000000        
G   1
  1      0.510000D+00           1.0000000        
H   1
  1      0.770000D+00           1.0000000        


name: pcseg-4
description: Polarized Valence Pentuble Zeta, DFT Optimized
elt: Kr
data:
KRYPTON
S   15
  1      0.745495D+08           0.832023D-06     
  2      0.112786D+08           0.636259D-05     
  3      0.259798D+07           0.329276D-04     
  4      0.743639D+06           0.137539D-03     
  5      0.244330D+06           0.498898D-03     
  6      0.885110D+05           0.163010D-02     
  7      0.345639D+05           0.489124D-02     
  8      0.143358D+05           0.136488D-01     
  9      0.623465D+04           0.357553D-01     
 10      0.280809D+04           0.868998D-01     
 11      0.130516D+04           0.191277D+00     
 12      0.616031D+03           0.362931D+00     
 13      0.295621D+03           0.500000D+00     
 14      0.144652D+03           0.400218D+00     
 15      0.704554D+02           0.117399D+00     
S   7
  1      0.299760D+04          -0.110109D-02     
  2      0.930631D+03          -0.110786D-01     
  3      0.360895D+03          -0.500731D-01     
  4      0.160199D+03          -0.101514D+00     
  5      0.389667D+02           0.348003D+00     
  6      0.204636D+02           0.500000D+00     
  7      0.112472D+02           0.239475D+00     
S   5
  1      0.156380D+03           0.606989D-02     
  2      0.402802D+02          -0.786955D-01     
  3      0.213913D+02          -0.333637D+00     
  4      0.114669D+02          -0.249594D+00     
  5      0.659198D+01           0.500000D+00     
S   1
  1      0.338065D+01           1.0000000        
S   1
  1      0.167925D+01           1.0000000        
S   1
  1      0.631112D+00           1.0000000        
S   1
  1      0.294684D+00           1.0000000        
S   1
  1      0.127405D+00           1.0000000        
P   12
  1      0.917750D+05           0.115116D-04     
  2      0.219692D+05           0.100643D-03     
  3      0.722556D+04           0.577237D-03     
  4      0.279978D+04           0.259774D-02     
  5      0.120535D+04           0.977390D-02     
  6      0.553231D+03           0.328946D-01     
  7      0.266115D+03           0.916281D-01     
  8      0.133193D+03           0.217638D+00     
  9      0.680065D+02           0.399715D+00     
 10      0.355597D+02           0.500000D+00     
 11      0.187018D+02           0.367317D+00     
 12      0.962796D+01           0.107531D+00     
P   6
  1      0.245471D+03          -0.146840D-02     
  2      0.928628D+02          -0.109486D-01     
  3      0.430589D+02          -0.243357D-01     
  4      0.111577D+02           0.186443D+00     
  5      0.582826D+01           0.441981D+00     
  6      0.301814D+01           0.500000D+00     
P   3
  1      0.699642D+01          -0.129851D+00     
  2      0.323272D+01          -0.323989D+00     
  3      0.151835D+01           0.500000D+00     
P   1
  1      0.737872D+00           1.0000000        
P   1
  1      0.345461D+00           1.0000000        
P   1
  1      0.153309D+00           1.0000000        
P   1
  1      0.652856D-01           1.0000000        
D   9
  1      0.207384D+04           0.823362D-04     
  2      0.630080D+03           0.819446D-03     
  3      0.249182D+03           0.474655D-02     
  4      0.111833D+03           0.209872D-01     
  5      0.529599D+02           0.730998D-01     
  6      0.268924D+02           0.172418D+00     
  7      0.142893D+02           0.328857D+00     
  8      0.766800D+01           0.462004D+00     
  9      0.407717D+01           0.500000D+00     
D   1
  1      0.212833D+01           1.0000000        
D   1
  1      0.108714D+01           1.0000000        
D   1
  1      0.518192D+00           1.0000000        
D   1
  1      0.218000D+00           1.0000000        
F   1
  1      0.846000D+01           1.0000000        
F   1
  1      0.249000D+01           1.0000000        
F   1
  1      0.730000D+00           1.0000000        
F   1
  1      0.293000D+00           1.0000000        
G   1
  1      0.225000D+01           1.0000000        
G   1
  1      0.560000D+00           1.0000000        
H   1
  1      0.840000D+00           1.0000000        


name: s6-31G*
description: Spin-state corrected 6-31G* basis set
elt: Zn
data:
ZINC
S   6
  1  82400.940000000            0.00174333       
  2  12372.550000000            0.01335966       
  3   2818.351000000            0.06594365       
  4    794.571700000            0.22941510       
  5    254.723200000            0.47854530       
  6     87.138800000            0.35377530       
L   6
  1   1732.569000000            0.00236146             0.00396313       
  2    412.714900000            0.03150177             0.03113411       
  3    133.678000000            0.12727740             0.13639310       
  4     50.385850000           -0.02145928             0.35012660       
  5     20.583580000           -0.61976520             0.46231790       
  6      8.505940000           -0.45901800             0.20049950       
L   6
  1     69.364920000           -0.00444010            -0.00768926       
  2     23.620820000            0.07505253            -0.02997982       
  3     10.184710000            0.25331110             0.07082411       
  4      4.334082000           -0.28818970             0.40461410       
  5      1.810918000           -0.72670520             0.48823250       
  6      0.714841000           -0.21334390             0.17519700       
L   3
  1      2.823842000            0.04898543            -0.15867630       
  2      1.039543000            0.25927930             0.08379327       
  3      0.143264000           -1.11571100             0.98405470       
L   1
  1      0.049296000            1.00000000             1.00000000       
D   3
  1     33.707640000            0.09262648       
  2      9.061106000            0.40029800       
  3      2.738383000            0.68966080       
D   1
  1      0.730294000            1.0000000        
D   1
  1      0.208510000            1.0000000        
F   1
  1      0.80000000             1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: He
data:
HELIUM
S   1
  1      1.9850407436E+03       1.0000000        
S   1
  1      1.0160381305E+03       1.0000000        
S   1
  1      4.4689350591E+02       1.0000000        
S   1
  1      1.8608329347E+02       1.0000000        
S   1
  1      7.7386842371E+01       1.0000000        
S   1
  1      3.2064002809E+01       1.0000000        
S   1
  1      1.3209845940E+01       1.0000000        
S   1
  1      5.4594511546E+00       1.0000000        
S   1
  1      2.2575191754E+00       1.0000000        
S   1
  1      9.2805489445E-01       1.0000000        
S   1
  1      3.8475195738E-01       1.0000000        
S   1
  1      1.5920018604E-01       1.0000000        
S   1
  1      6.8678400297E-02       1.0000000        
S   1
  1      3.5049166152E-02       1.0000000        
P   1
  1      6.4291142478E+00       1.0000000        
P   1
  1      3.7097381621E+00       1.0000000        
P   1
  1      1.8379856508E+00       1.0000000        
P   1
  1      8.9669828380E-01       1.0000000        
P   1
  1      4.4670425550E-01       1.0000000        
P   1
  1      2.5873130539E-01       1.0000000        
D   1
  1      2.1752040340E+00       1.0000000        
F   1
  1      2.8183829313E+00       1.0000000        
G   1
  1      3.3496543916E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: H
data:
HYDROGEN
S   1
  1      1.9850407436E+03       1.0000000        
S   1
  1      1.0160381305E+03       1.0000000        
S   1
  1      4.4689350591E+02       1.0000000        
S   1
  1      1.8608329347E+02       1.0000000        
S   1
  1      7.7386842371E+01       1.0000000        
S   1
  1      3.2064002809E+01       1.0000000        
S   1
  1      1.3209845940E+01       1.0000000        
S   1
  1      5.4594511546E+00       1.0000000        
S   1
  1      2.2575191754E+00       1.0000000        
S   1
  1      9.2805489445E-01       1.0000000        
S   1
  1      3.8475195738E-01       1.0000000        
S   1
  1      1.5920018604E-01       1.0000000        
S   1
  1      6.8678400297E-02       1.0000000        
S   1
  1      3.5049166152E-02       1.0000000        
P   1
  1      6.4291142478E+00       1.0000000        
P   1
  1      3.7097381621E+00       1.0000000        
P   1
  1      1.8379856508E+00       1.0000000        
P   1
  1      8.9669828380E-01       1.0000000        
P   1
  1      4.4670425550E-01       1.0000000        
P   1
  1      2.5873130539E-01       1.0000000        
D   1
  1      2.1752040340E+00       1.0000000        
F   1
  1      2.8183829313E+00       1.0000000        
G   1
  1      3.3496543916E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Be
data:
BERYLLIUM
S   1
  1      4.8704863236E+03       1.0000000        
S   1
  1      2.5247465514E+03       1.0000000        
S   1
  1      1.0926827622E+03       1.0000000        
S   1
  1      4.5930571525E+02       1.0000000        
S   1
  1      1.9031632816E+02       1.0000000        
S   1
  1      7.9055079346E+01       1.0000000        
S   1
  1      3.2496185482E+01       1.0000000        
S   1
  1      1.3463154130E+01       1.0000000        
S   1
  1      5.5318236845E+00       1.0000000        
S   1
  1      2.2870181148E+00       1.0000000        
S   1
  1      9.3634760814E-01       1.0000000        
S   1
  1      3.8644902862E-01       1.0000000        
S   1
  1      1.5884319079E-01       1.0000000        
S   1
  1      6.4899858224E-02       1.0000000        
S   1
  1      2.6928684679E-02       1.0000000        
S   1
  1      1.1531290248E-02       1.0000000        
S   1
  1      5.8927201663E-03       1.0000000        
P   1
  1      1.1411126428E+01       1.0000000        
P   1
  1      6.5595316385E+00       1.0000000        
P   1
  1      3.2386540391E+00       1.0000000        
P   1
  1      1.5367454783E+00       1.0000000        
P   1
  1      7.2548542672E-01       1.0000000        
P   1
  1      3.4098183844E-01       1.0000000        
P   1
  1      1.6095071231E-01       1.0000000        
P   1
  1      7.6681585584E-02       1.0000000        
P   1
  1      3.7687475537E-02       1.0000000        
P   1
  1      2.1569433418E-02       1.0000000        
D   1
  1      5.6828890005E-01       1.0000000        
D   1
  1      3.5383574250E-01       1.0000000        
D   1
  1      1.9425423986E-01       1.0000000        
D   1
  1      1.0577023667E-01       1.0000000        
D   1
  1      6.5628977026E-02       1.0000000        
F   1
  1      2.7871294897E-01       1.0000000        
F   1
  1      2.2061555560E-01       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Li
data:
LITHIUM
S   1
  1      4.8704863236E+03       1.0000000        
S   1
  1      2.5247465514E+03       1.0000000        
S   1
  1      1.0926827622E+03       1.0000000        
S   1
  1      4.5930571525E+02       1.0000000        
S   1
  1      1.9031632816E+02       1.0000000        
S   1
  1      7.9055079346E+01       1.0000000        
S   1
  1      3.2496185482E+01       1.0000000        
S   1
  1      1.3463154130E+01       1.0000000        
S   1
  1      5.5318236845E+00       1.0000000        
S   1
  1      2.2870181148E+00       1.0000000        
S   1
  1      9.3634760814E-01       1.0000000        
S   1
  1      3.8644902862E-01       1.0000000        
S   1
  1      1.5884319079E-01       1.0000000        
S   1
  1      6.4899858224E-02       1.0000000        
S   1
  1      2.6928684679E-02       1.0000000        
S   1
  1      1.1531290248E-02       1.0000000        
S   1
  1      5.8927201663E-03       1.0000000        
P   1
  1      1.1411126428E+01       1.0000000        
P   1
  1      6.5595316385E+00       1.0000000        
P   1
  1      3.2386540391E+00       1.0000000        
P   1
  1      1.5367454783E+00       1.0000000        
P   1
  1      7.2548542672E-01       1.0000000        
P   1
  1      3.4098183844E-01       1.0000000        
P   1
  1      1.6095071231E-01       1.0000000        
P   1
  1      7.6681585584E-02       1.0000000        
P   1
  1      3.7687475537E-02       1.0000000        
P   1
  1      2.1569433418E-02       1.0000000        
D   1
  1      5.6828890005E-01       1.0000000        
D   1
  1      3.5383574250E-01       1.0000000        
D   1
  1      1.9425423986E-01       1.0000000        
D   1
  1      1.0577023667E-01       1.0000000        
D   1
  1      6.5628977026E-02       1.0000000        
F   1
  1      2.7871294897E-01       1.0000000        
F   1
  1      2.2061555560E-01       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Ne
data:
NEON
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: C
data:
CARBON
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: N
data:
NITROGEN
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: F
data:
FLUORINE
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: B
data:
BORON
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: O
data:
OXYGEN
S   1
  1      2.9359875724E+04       1.0000000        
S   1
  1      1.5219475030E+04       1.0000000        
S   1
  1      6.5868227465E+03       1.0000000        
S   1
  1      2.7687499406E+03       1.0000000        
S   1
  1      1.1472496527E+03       1.0000000        
S   1
  1      4.7655350015E+02       1.0000000        
S   1
  1      1.9589090368E+02       1.0000000        
S   1
  1      8.1157507863E+01       1.0000000        
S   1
  1      3.3346496656E+01       1.0000000        
S   1
  1      1.3786419500E+01       1.0000000        
S   1
  1      5.6444156872E+00       1.0000000        
S   1
  1      2.3295610951E+00       1.0000000        
S   1
  1      9.5752580570E-01       1.0000000        
S   1
  1      3.9122412945E-01       1.0000000        
S   1
  1      1.6232934107E-01       1.0000000        
S   1
  1      6.9512000678E-02       1.0000000        
S   1
  1      3.5522023934E-02       1.0000000        
P   1
  1      6.5083597450E+01       1.0000000        
P   1
  1      3.7174569603E+01       1.0000000        
P   1
  1      1.8294641646E+01       1.0000000        
P   1
  1      8.6340330283E+00       1.0000000        
P   1
  1      4.0715724075E+00       1.0000000        
P   1
  1      1.9104156173E+00       1.0000000        
P   1
  1      9.0900375994E-01       1.0000000        
P   1
  1      4.2415035253E-01       1.0000000        
P   1
  1      2.0142202645E-01       1.0000000        
P   1
  1      9.5133856348E-02       1.0000000        
P   1
  1      4.6745801960E-02       1.0000000        
P   1
  1      2.6671455432E-02       1.0000000        
D   1
  1      3.5803982212E+00       1.0000000        
D   1
  1      2.2057578968E+00       1.0000000        
D   1
  1      1.1968791564E+00       1.0000000        
D   1
  1      6.2550873740E-01       1.0000000        
D   1
  1      3.3756274549E-01       1.0000000        
D   1
  1      2.0835700875E-01       1.0000000        
F   1
  1      1.8627610419E+00       1.0000000        
F   1
  1      1.4744706471E+00       1.0000000        
G   1
  1      1.6788040181E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Mg
data:
MAGNESIUM
S   1
  1      2.9058192043E+04       1.0000000        
S   1
  1      1.4958609146E+04       1.0000000        
S   1
  1      6.4571806939E+03       1.0000000        
S   1
  1      2.6881742491E+03       1.0000000        
S   1
  1      1.1105032195E+03       1.0000000        
S   1
  1      4.5690128292E+02       1.0000000        
S   1
  1      1.8829144097E+02       1.0000000        
S   1
  1      7.7684298261E+01       1.0000000        
S   1
  1      3.1884071733E+01       1.0000000        
S   1
  1      1.3203466950E+01       1.0000000        
S   1
  1      5.4377650897E+00       1.0000000        
S   1
  1      2.2431675172E+00       1.0000000        
S   1
  1      9.2064495137E-01       1.0000000        
S   1
  1      3.7925016269E-01       1.0000000        
S   1
  1      1.5653376377E-01       1.0000000        
S   1
  1      6.4375470190E-02       1.0000000        
S   1
  1      2.6725823728E-02       1.0000000        
S   1
  1      1.1484610547E-02       1.0000000        
S   1
  1      5.9018238943E-03       1.0000000        
P   1
  1      9.5849462932E+01       1.0000000        
P   1
  1      5.4747473569E+01       1.0000000        
P   1
  1      2.6942757392E+01       1.0000000        
P   1
  1      1.2715453065E+01       1.0000000        
P   1
  1      5.9962577952E+00       1.0000000        
P   1
  1      2.8134939995E+00       1.0000000        
P   1
  1      1.3387016945E+00       1.0000000        
P   1
  1      6.2465175690E-01       1.0000000        
P   1
  1      2.9663684575E-01       1.0000000        
P   1
  1      1.4010487120E-01       1.0000000        
P   1
  1      6.8843152311E-02       1.0000000        
P   1
  1      3.9279400323E-02       1.0000000        
D   1
  1      2.4372211114E+00       1.0000000        
D   1
  1      1.4916054473E+00       1.0000000        
D   1
  1      8.0713941784E-01       1.0000000        
D   1
  1      4.1811625951E-01       1.0000000        
D   1
  1      2.1756271696E-01       1.0000000        
D   1
  1      1.1702356434E-01       1.0000000        
D   1
  1      7.1982311003E-02       1.0000000        
F   1
  1      2.7384196343E-01       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Na
data:
SODIUM
S   1
  1      2.9058192043E+04       1.0000000        
S   1
  1      1.4958609146E+04       1.0000000        
S   1
  1      6.4571806939E+03       1.0000000        
S   1
  1      2.6881742491E+03       1.0000000        
S   1
  1      1.1105032195E+03       1.0000000        
S   1
  1      4.5690128292E+02       1.0000000        
S   1
  1      1.8829144097E+02       1.0000000        
S   1
  1      7.7684298261E+01       1.0000000        
S   1
  1      3.1884071733E+01       1.0000000        
S   1
  1      1.3203466950E+01       1.0000000        
S   1
  1      5.4377650897E+00       1.0000000        
S   1
  1      2.2431675172E+00       1.0000000        
S   1
  1      9.2064495137E-01       1.0000000        
S   1
  1      3.7925016269E-01       1.0000000        
S   1
  1      1.5653376377E-01       1.0000000        
S   1
  1      6.4375470190E-02       1.0000000        
S   1
  1      2.6725823728E-02       1.0000000        
S   1
  1      1.1484610547E-02       1.0000000        
S   1
  1      5.9018238943E-03       1.0000000        
P   1
  1      9.5849462932E+01       1.0000000        
P   1
  1      5.4747473569E+01       1.0000000        
P   1
  1      2.6942757392E+01       1.0000000        
P   1
  1      1.2715453065E+01       1.0000000        
P   1
  1      5.9962577952E+00       1.0000000        
P   1
  1      2.8134939995E+00       1.0000000        
P   1
  1      1.3387016945E+00       1.0000000        
P   1
  1      6.2465175690E-01       1.0000000        
P   1
  1      2.9663684575E-01       1.0000000        
P   1
  1      1.4010487120E-01       1.0000000        
P   1
  1      6.8843152311E-02       1.0000000        
P   1
  1      3.9279400323E-02       1.0000000        
D   1
  1      2.4372211114E+00       1.0000000        
D   1
  1      1.4916054473E+00       1.0000000        
D   1
  1      8.0713941784E-01       1.0000000        
D   1
  1      4.1811625951E-01       1.0000000        
D   1
  1      2.1756271696E-01       1.0000000        
D   1
  1      1.1702356434E-01       1.0000000        
D   1
  1      7.1982311003E-02       1.0000000        
F   1
  1      2.7384196343E-01       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Ar
data:
ARGON
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: P
data:
PHOSPHOROUS
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Cl
data:
CHLORINE
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Al
data:
ALUMINUM
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: Si
data:
SILICON
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-ccemd-ref
description: The un-ccemd-ref basis set
elt: S
data:
SULFUR
S   1
  1      7.1477317914E+04       1.0000000        
S   1
  1      3.6795175003E+04       1.0000000        
S   1
  1      1.5883367988E+04       1.0000000        
S   1
  1      6.6123689021E+03       1.0000000        
S   1
  1      2.7316149452E+03       1.0000000        
S   1
  1      1.1238854161E+03       1.0000000        
S   1
  1      4.6315913828E+02       1.0000000        
S   1
  1      1.9108777572E+02       1.0000000        
S   1
  1      7.8428414553E+01       1.0000000        
S   1
  1      3.2477877610E+01       1.0000000        
S   1
  1      1.3375810287E+01       1.0000000        
S   1
  1      5.5177416932E+00       1.0000000        
S   1
  1      2.2646017267E+00       1.0000000        
S   1
  1      9.3287925167E-01       1.0000000        
S   1
  1      3.8504162891E-01       1.0000000        
S   1
  1      1.5835073090E-01       1.0000000        
S   1
  1      6.5740160171E-02       1.0000000        
S   1
  1      2.8249835984E-02       1.0000000        
S   1
  1      1.4517301770E-02       1.0000000        
P   1
  1      3.0107532856E+02       1.0000000        
P   1
  1      1.7260227677E+02       1.0000000        
P   1
  1      8.4513858886E+01       1.0000000        
P   1
  1      4.0119443000E+01       1.0000000        
P   1
  1      1.8867486842E+01       1.0000000        
P   1
  1      8.8645929392E+00       1.0000000        
P   1
  1      4.1640399009E+00       1.0000000        
P   1
  1      1.9540854211E+00       1.0000000        
P   1
  1      9.2119417346E-01       1.0000000        
P   1
  1      4.3106059481E-01       1.0000000        
P   1
  1      2.0210439853E-01       1.0000000        
P   1
  1      9.5749614772E-02       1.0000000        
P   1
  1      4.6806332392E-02       1.0000000        
P   1
  1      2.6724135569E-02       1.0000000        
D   1
  1      2.9013754631E+00       1.0000000        
D   1
  1      1.7756728863E+00       1.0000000        
D   1
  1      9.6085434812E-01       1.0000000        
D   1
  1      4.9774402920E-01       1.0000000        
D   1
  1      2.5899625017E-01       1.0000000        
D   1
  1      1.3931001032E-01       1.0000000        
D   1
  1      8.5690916570E-02       1.0000000        
F   1
  1      7.7963362103E-01       1.0000000        
F   1
  1      5.1581017099E-01       1.0000000        
F   1
  1      3.0928737168E-01       1.0000000        
F   1
  1      2.0483371212E-01       1.0000000        
G   1
  1      1.1885022274E+00       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: He
data:
HELIUM
S   1
  1      7.6154492193E+03       1.0000000        
S   1
  1      3.9476713159E+03       1.0000000        
S   1
  1      1.7085090759E+03       1.0000000        
S   1
  1      7.1816634279E+02       1.0000000        
S   1
  1      2.9757692280E+02       1.0000000        
S   1
  1      1.2360982093E+02       1.0000000        
S   1
  1      5.0810747412E+01       1.0000000        
S   1
  1      2.1050868393E+01       1.0000000        
S   1
  1      8.6495104513E+00       1.0000000        
S   1
  1      3.5759612407E+00       1.0000000        
S   1
  1      1.4640648156E+00       1.0000000        
S   1
  1      6.0424827373E-01       1.0000000        
S   1
  1      2.4836580434E-01       1.0000000        
S   1
  1      1.0147684272E-01       1.0000000        
S   1
  1      4.2105452534E-02       1.0000000        
S   1
  1      1.8030223161E-02       1.0000000        
S   1
  1      9.2138049895E-03       1.0000000        
P   1
  1      3.2800866038E+00       1.0000000        
P   1
  1      2.0624207948E+00       1.0000000        
P   1
  1      1.2915039918E+00       1.0000000        
D   1
  1      2.9853826189E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: H
data:
HYDROGEN
S   1
  1      7.6154492193E+03       1.0000000        
S   1
  1      3.9476713159E+03       1.0000000        
S   1
  1      1.7085090759E+03       1.0000000        
S   1
  1      7.1816634279E+02       1.0000000        
S   1
  1      2.9757692280E+02       1.0000000        
S   1
  1      1.2360982093E+02       1.0000000        
S   1
  1      5.0810747412E+01       1.0000000        
S   1
  1      2.1050868393E+01       1.0000000        
S   1
  1      8.6495104513E+00       1.0000000        
S   1
  1      3.5759612407E+00       1.0000000        
S   1
  1      1.4640648156E+00       1.0000000        
S   1
  1      6.0424827373E-01       1.0000000        
S   1
  1      2.4836580434E-01       1.0000000        
S   1
  1      1.0147684272E-01       1.0000000        
S   1
  1      4.2105452534E-02       1.0000000        
S   1
  1      1.8030223161E-02       1.0000000        
S   1
  1      9.2138049895E-03       1.0000000        
P   1
  1      3.2800866038E+00       1.0000000        
P   1
  1      2.0624207948E+00       1.0000000        
P   1
  1      1.2915039918E+00       1.0000000        
D   1
  1      2.9853826189E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Be
data:
BERYLLIUM
S   1
  1      2.9000490840E+04       1.0000000        
S   1
  1      1.5088253641E+04       1.0000000        
S   1
  1      6.5670385069E+03       1.0000000        
S   1
  1      2.7475289372E+03       1.0000000        
S   1
  1      1.1341709632E+03       1.0000000        
S   1
  1      4.7133058016E+02       1.0000000        
S   1
  1      1.9489528060E+02       1.0000000        
S   1
  1      8.0499086595E+01       1.0000000        
S   1
  1      3.3195832596E+01       1.0000000        
S   1
  1      1.3704646676E+01       1.0000000        
S   1
  1      5.6609669574E+00       1.0000000        
S   1
  1      2.3107171344E+00       1.0000000        
S   1
  1      9.5040641748E-01       1.0000000        
S   1
  1      3.8981596961E-01       1.0000000        
S   1
  1      1.5945592353E-01       1.0000000        
S   1
  1      6.5534963136E-02       1.0000000        
S   1
  1      2.6880568915E-02       1.0000000        
S   1
  1      1.1021391765E-02       1.0000000        
S   1
  1      4.5446413101E-03       1.0000000        
S   1
  1      1.9371758439E-03       1.0000000        
S   1
  1      9.8085858563E-04       1.0000000        
P   1
  1      1.1787350844E+01       1.0000000        
P   1
  1      6.7757991541E+00       1.0000000        
P   1
  1      3.3454323430E+00       1.0000000        
P   1
  1      1.5874119199E+00       1.0000000        
P   1
  1      7.4940465442E-01       1.0000000        
P   1
  1      3.5222399705E-01       1.0000000        
P   1
  1      1.6625725134E-01       1.0000000        
P   1
  1      7.9209774626E-02       1.0000000        
P   1
  1      3.8930030213E-02       1.0000000        
P   1
  1      2.2280576840E-02       1.0000000        
D   1
  1      4.5795117050E-01       1.0000000        
D   1
  1      2.8513576885E-01       1.0000000        
D   1
  1      1.5653826163E-01       1.0000000        
D   1
  1      8.5234118922E-02       1.0000000        
D   1
  1      5.2886598427E-02       1.0000000        
F   1
  1      1.4330125702E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Li
data:
LITHIUM
S   1
  1      2.9000490840E+04       1.0000000        
S   1
  1      1.5088253641E+04       1.0000000        
S   1
  1      6.5670385069E+03       1.0000000        
S   1
  1      2.7475289372E+03       1.0000000        
S   1
  1      1.1341709632E+03       1.0000000        
S   1
  1      4.7133058016E+02       1.0000000        
S   1
  1      1.9489528060E+02       1.0000000        
S   1
  1      8.0499086595E+01       1.0000000        
S   1
  1      3.3195832596E+01       1.0000000        
S   1
  1      1.3704646676E+01       1.0000000        
S   1
  1      5.6609669574E+00       1.0000000        
S   1
  1      2.3107171344E+00       1.0000000        
S   1
  1      9.5040641748E-01       1.0000000        
S   1
  1      3.8981596961E-01       1.0000000        
S   1
  1      1.5945592353E-01       1.0000000        
S   1
  1      6.5534963136E-02       1.0000000        
S   1
  1      2.6880568915E-02       1.0000000        
S   1
  1      1.1021391765E-02       1.0000000        
S   1
  1      4.5446413101E-03       1.0000000        
S   1
  1      1.9371758439E-03       1.0000000        
S   1
  1      9.8085858563E-04       1.0000000        
P   1
  1      1.1787350844E+01       1.0000000        
P   1
  1      6.7757991541E+00       1.0000000        
P   1
  1      3.3454323430E+00       1.0000000        
P   1
  1      1.5874119199E+00       1.0000000        
P   1
  1      7.4940465442E-01       1.0000000        
P   1
  1      3.5222399705E-01       1.0000000        
P   1
  1      1.6625725134E-01       1.0000000        
P   1
  1      7.9209774626E-02       1.0000000        
P   1
  1      3.8930030213E-02       1.0000000        
P   1
  1      2.2280576840E-02       1.0000000        
D   1
  1      4.5795117050E-01       1.0000000        
D   1
  1      2.8513576885E-01       1.0000000        
D   1
  1      1.5653826163E-01       1.0000000        
D   1
  1      8.5234118922E-02       1.0000000        
D   1
  1      5.2886598427E-02       1.0000000        
F   1
  1      1.4330125702E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Ne
data:
NEON
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: C
data:
CARBON
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: N
data:
NITROGEN
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: F
data:
FLUORINE
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: B
data:
BORON
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: O
data:
OXYGEN
S   1
  1      1.7513812273E+05       1.0000000        
S   1
  1      9.1120127329E+04       1.0000000        
S   1
  1      3.9659287230E+04       1.0000000        
S   1
  1      1.6592721236E+04       1.0000000        
S   1
  1      6.8494210823E+03       1.0000000        
S   1
  1      2.8464329605E+03       1.0000000        
S   1
  1      1.1770005467E+03       1.0000000        
S   1
  1      4.8614552718E+02       1.0000000        
S   1
  1      2.0047439319E+02       1.0000000        
S   1
  1      8.2764326468E+01       1.0000000        
S   1
  1      3.4187391215E+01       1.0000000        
S   1
  1      1.3954752122E+01       1.0000000        
S   1
  1      5.7396406396E+00       1.0000000        
S   1
  1      2.3541545385E+00       1.0000000        
S   1
  1      9.6297718750E-01       1.0000000        
S   1
  1      3.9577503982E-01       1.0000000        
S   1
  1      1.6233561024E-01       1.0000000        
S   1
  1      6.6559765289E-02       1.0000000        
S   1
  1      2.7445740555E-02       1.0000000        
S   1
  1      1.1698882705E-02       1.0000000        
S   1
  1      5.9235456497E-03       1.0000000        
P   1
  1      1.3977475046E+02       1.0000000        
P   1
  1      8.0183058424E+01       1.0000000        
P   1
  1      3.9313001140E+01       1.0000000        
P   1
  1      1.8560511511E+01       1.0000000        
P   1
  1      8.7278598557E+00       1.0000000        
P   1
  1      4.1172476348E+00       1.0000000        
P   1
  1      1.9319740779E+00       1.0000000        
P   1
  1      9.0628559744E-01       1.0000000        
P   1
  1      4.2537088445E-01       1.0000000        
P   1
  1      2.0014403012E-01       1.0000000        
P   1
  1      9.4682925878E-02       1.0000000        
P   1
  1      4.6604956359E-02       1.0000000        
P   1
  1      2.6573021826E-02       1.0000000        
D   1
  1      1.4241291597E+00       1.0000000        
D   1
  1      9.0427956721E-01       1.0000000        
D   1
  1      5.1744476556E-01       1.0000000        
D   1
  1      3.2604856249E-01       1.0000000        
F   1
  1      8.4139514165E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Mg
data:
MAGNESIUM
S   1
  1      4.2761341468E+05       1.0000000        
S   1
  1      2.2029777026E+05       1.0000000        
S   1
  1      9.6000442500E+04       1.0000000        
S   1
  1      4.0100930638E+04       1.0000000        
S   1
  1      1.6575348799E+04       1.0000000        
S   1
  1      6.8738212019E+03       1.0000000        
S   1
  1      2.8537744671E+03       1.0000000        
S   1
  1      1.1858713116E+03       1.0000000        
S   1
  1      4.8466323343E+02       1.0000000        
S   1
  1      2.0265755539E+02       1.0000000        
S   1
  1      8.2983306829E+01       1.0000000        
S   1
  1      3.4160007319E+01       1.0000000        
S   1
  1      1.4097221111E+01       1.0000000        
S   1
  1      5.7878169798E+00       1.0000000        
S   1
  1      2.3789223865E+00       1.0000000        
S   1
  1      9.7595142158E-01       1.0000000        
S   1
  1      4.0137298800E-01       1.0000000        
S   1
  1      1.6345871157E-01       1.0000000        
S   1
  1      6.6942310379E-02       1.0000000        
S   1
  1      2.7239054922E-02       1.0000000        
S   1
  1      1.1156969227E-02       1.0000000        
S   1
  1      4.5941968512E-03       1.0000000        
S   1
  1      1.9547738029E-03       1.0000000        
S   1
  1      9.9222110190E-04       1.0000000        
P   1
  1      3.0419304809E+02       1.0000000        
P   1
  1      1.7374954800E+02       1.0000000        
P   1
  1      8.5506994448E+01       1.0000000        
P   1
  1      4.0354450692E+01       1.0000000        
P   1
  1      1.9030048579E+01       1.0000000        
P   1
  1      8.9290569743E+00       1.0000000        
P   1
  1      4.2485762203E+00       1.0000000        
P   1
  1      1.9824286554E+00       1.0000000        
P   1
  1      9.4142276360E-01       1.0000000        
P   1
  1      4.4464440923E-01       1.0000000        
P   1
  1      2.1848435767E-01       1.0000000        
P   1
  1      1.2465923278E-01       1.0000000        
D   1
  1      9.4614947276E-02       1.0000000        
D   1
  1      6.2289551446E-02       1.0000000        
D   1
  1      4.1582854883E-02       1.0000000        
F   1
  1      4.8696752517E-02       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Na
data:
SODIUM
S   1
  1      4.2761341468E+05       1.0000000        
S   1
  1      2.2029777026E+05       1.0000000        
S   1
  1      9.6000442500E+04       1.0000000        
S   1
  1      4.0100930638E+04       1.0000000        
S   1
  1      1.6575348799E+04       1.0000000        
S   1
  1      6.8738212019E+03       1.0000000        
S   1
  1      2.8537744671E+03       1.0000000        
S   1
  1      1.1858713116E+03       1.0000000        
S   1
  1      4.8466323343E+02       1.0000000        
S   1
  1      2.0265755539E+02       1.0000000        
S   1
  1      8.2983306829E+01       1.0000000        
S   1
  1      3.4160007319E+01       1.0000000        
S   1
  1      1.4097221111E+01       1.0000000        
S   1
  1      5.7878169798E+00       1.0000000        
S   1
  1      2.3789223865E+00       1.0000000        
S   1
  1      9.7595142158E-01       1.0000000        
S   1
  1      4.0137298800E-01       1.0000000        
S   1
  1      1.6345871157E-01       1.0000000        
S   1
  1      6.6942310379E-02       1.0000000        
S   1
  1      2.7239054922E-02       1.0000000        
S   1
  1      1.1156969227E-02       1.0000000        
S   1
  1      4.5941968512E-03       1.0000000        
S   1
  1      1.9547738029E-03       1.0000000        
S   1
  1      9.9222110190E-04       1.0000000        
P   1
  1      3.0419304809E+02       1.0000000        
P   1
  1      1.7374954800E+02       1.0000000        
P   1
  1      8.5506994448E+01       1.0000000        
P   1
  1      4.0354450692E+01       1.0000000        
P   1
  1      1.9030048579E+01       1.0000000        
P   1
  1      8.9290569743E+00       1.0000000        
P   1
  1      4.2485762203E+00       1.0000000        
P   1
  1      1.9824286554E+00       1.0000000        
P   1
  1      9.4142276360E-01       1.0000000        
P   1
  1      4.4464440923E-01       1.0000000        
P   1
  1      2.1848435767E-01       1.0000000        
P   1
  1      1.2465923278E-01       1.0000000        
D   1
  1      9.4614947276E-02       1.0000000        
D   1
  1      6.2289551446E-02       1.0000000        
D   1
  1      4.1582854883E-02       1.0000000        
F   1
  1      4.8696752517E-02       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Ar
data:
ARGON
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: P
data:
PHOSPHOROUS
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Cl
data:
CHLORINE
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Al
data:
ALUMINUM
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: Si
data:
SILICON
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


name: un-pcemd-ref
description: The un-pcemd-ref basis set
elt: S
data:
SULFUR
S   1
  1      4.2983781114E+05       1.0000000        
S   1
  1      2.2185757351E+05       1.0000000        
S   1
  1      9.6394265169E+04       1.0000000        
S   1
  1      4.0193673201E+04       1.0000000        
S   1
  1      1.6758953627E+04       1.0000000        
S   1
  1      6.9470538360E+03       1.0000000        
S   1
  1      2.8678456302E+03       1.0000000        
S   1
  1      1.1848161021E+03       1.0000000        
S   1
  1      4.8879244991E+02       1.0000000        
S   1
  1      2.0142024599E+02       1.0000000        
S   1
  1      8.2658639984E+01       1.0000000        
S   1
  1      3.4119272365E+01       1.0000000        
S   1
  1      1.3968188069E+01       1.0000000        
S   1
  1      5.7314971132E+00       1.0000000        
S   1
  1      2.3623566467E+00       1.0000000        
S   1
  1      9.7245247135E-01       1.0000000        
S   1
  1      3.9774565818E-01       1.0000000        
S   1
  1      1.6373605598E-01       1.0000000        
S   1
  1      6.6930148922E-02       1.0000000        
S   1
  1      2.7466017841E-02       1.0000000        
S   1
  1      1.1717815752E-02       1.0000000        
S   1
  1      5.9507041069E-03       1.0000000        
P   1
  1      6.4913573353E+02       1.0000000        
P   1
  1      3.7201356208E+02       1.0000000        
P   1
  1      1.8191869318E+02       1.0000000        
P   1
  1      8.6776458086E+01       1.0000000        
P   1
  1      4.0784714747E+01       1.0000000        
P   1
  1      1.9105284146E+01       1.0000000        
P   1
  1      8.9838658416E+00       1.0000000        
P   1
  1      4.2162590037E+00       1.0000000        
P   1
  1      1.9752726111E+00       1.0000000        
P   1
  1      9.3142844721E-01       1.0000000        
P   1
  1      4.3342550474E-01       1.0000000        
P   1
  1      2.0412340634E-01       1.0000000        
P   1
  1      9.4306264882E-02       1.0000000        
P   1
  1      4.4630617907E-02       1.0000000        
P   1
  1      2.1822166815E-02       1.0000000        
P   1
  1      1.2389207285E-02       1.0000000        
D   1
  1      9.0947927352E-01       1.0000000        
D   1
  1      5.6627232030E-01       1.0000000        
D   1
  1      3.1088097080E-01       1.0000000        
D   1
  1      1.6927277306E-01       1.0000000        
D   1
  1      1.0503142740E-01       1.0000000        
F   1
  1      3.7046740221E-01       1.0000000        
G   1
  1      2.5118864315E-01       1.0000000        


