srDFT_G2/Data/data_last/G2_CIPSI_VDZ_PBE_new.dat

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Be -14.6613711695
BeH -15.2440216707
C -37.8361146193
C2H2 -77.3337845276
C2H4 -78.5910416515
C2H6 -79.8344982648
CH -38.4751804915
CH2_1A1 -39.1342918521
CH2_3B1 -39.1449061165
CH3 -39.8370779798
CH3Cl -500.037850678
CH4 -40.5208787054
CN -92.7200694872
CO -113.329130159
CO2 -188.611753688
CS -436.127825436
Cl -460.06088725
Cl2 -920.216921623
ClF -559.902240503
ClO -535.232199676
F -99.7422016591
F2 -199.550099721
H -0.49980981
H2CO -114.516342609
H2O -76.4474591847
H2O2 -151.578279321
H2S -399.308392517
H3COH -115.741287917
H3CSH -438.618436197
HCN -93.4346348191
HCO -113.858884399
HCl -460.73407717
HF -100.471804859
HOCl -535.899863442
Li -7.4791371169
Li2 -14.9984290693
LiF -107.445525166
LiH -8.0739851794
N -54.5811364841
N2 -109.547028303
N2H4 -111.88249767
NH -55.2196354688
NH2 -55.8831333485
NH3 -56.5713476663
NO -129.906003972
Na -162.14822431
Na2 -324.326422743
NaCl -622.368493718
O -75.0673947822
O2 -150.334195815
OH -75.7432137126
P -341.153212569
P2 -682.502250364
PH2 -342.402592215
PH3 -343.043610188
S -398.012509338
S2 -796.195921827
SO -473.279840836
SO2 -548.556210058
Si -289.25007179
Si2 -578.619404919
Si2H6 -582.361857504
SiH2_1A1 -290.498164427
SiH2_3B1 -290.462725651
SiH3 -291.115844584
SiH4 -291.771664284
SiO -364.626649585