69 lines
2.1 KiB
Plaintext
69 lines
2.1 KiB
Plaintext
Be -0.0409505664 -0.0409505664
|
|
BeH -0.0441650015 -0.0441650015
|
|
C -0.0586510391 -0.0175604631
|
|
C2H2 -0.1404666457 -0.0613522098
|
|
C2H4 -0.1465191150 -0.0674964936
|
|
C2H6 -0.1533739834 -0.0747820570
|
|
CH -0.0652336324 -0.0249798717
|
|
CH2_1A1 -0.0709010312 -0.0311620162
|
|
CH2_3B1 -0.0675839923 -0.0275516155
|
|
CH3 -0.0744335136 -0.0349007445
|
|
CH3Cl -0.3985990895 -0.0945335281
|
|
CH4 -0.0796712292 -0.0404548817
|
|
CN -0.1431716245 -0.0624800757
|
|
CO -0.1591348700 -0.0780269531
|
|
CO2 -0.2553679228 -0.1338751830
|
|
CS -0.3687817170 -0.0666043575
|
|
Cl -0.3198344649 -0.0538326715
|
|
Cl2 -0.6453363196 -0.1146544094
|
|
ClF -0.4303882260 -0.1240774620
|
|
ClO -0.4141096224 -0.1077844358
|
|
F -0.1069631387 -0.0651406712
|
|
F2 -0.2182380615 -0.1351575493
|
|
H -0.0000000000 0.0000000000
|
|
H2CO -0.1672426350 -0.0868001734
|
|
H2O -0.1025975528 -0.0614307725
|
|
H2O2 -0.1967287984 -0.1143799655
|
|
H2S -0.3085397886 -0.0476833191
|
|
H3COH -0.1753112433 -0.0951639252
|
|
H3CSH -0.3827293701 -0.0824822670
|
|
HCN -0.1489863536 -0.0688063450
|
|
HCO -0.1622441405 -0.0814407178
|
|
HCl -0.3245829419 -0.0597005137
|
|
HF -0.1144934060 -0.0729212984
|
|
HOCl -0.4195923016 -0.1135732956
|
|
Li -0.0364391521 -0.0364391521
|
|
Li2 -0.0738434748 -0.0738434748
|
|
LiF -0.1447161446 -0.1031261050
|
|
LiH -0.0366804853 -0.0366804853
|
|
Mg -0.2526270461 -0.2108258385
|
|
N -0.0686452293 -0.0265407097
|
|
N2 -0.1587026067 -0.0771897145
|
|
N2H4 -0.1746357021 -0.0938393713
|
|
NH -0.0771141815 -0.0358266616
|
|
NH2 -0.0844018494 -0.0437110598
|
|
NH3 -0.0905633692 -0.0502214297
|
|
NO -0.1713821997 -0.0894010379
|
|
Na -0.2474881495 -0.2052351517
|
|
Na2 -0.4940633562 -0.4095757745
|
|
NaCl -0.5732567769 -0.2658164251
|
|
O -0.0880853664 -0.0460236800
|
|
O2 -0.1849611710 -0.1021788691
|
|
OH -0.0959427080 -0.0544777645
|
|
P -0.2800174034 -0.0193794325
|
|
P2 -0.5773377347 -0.0590465793
|
|
PH2 -0.2909033648 -0.0325419499
|
|
PH3 -0.2946108638 -0.0375553667
|
|
S -0.2993314578 -0.0360159067
|
|
S2 -0.6073627833 -0.0826068367
|
|
SO -0.3941724525 -0.0916863345
|
|
SO2 -0.4913784017 -0.1506578982
|
|
Si -0.2700486075 -0.0124161527
|
|
Si2 -0.5467746015 -0.0333506338
|
|
Si2H6 -0.5637630765 -0.0565136569
|
|
SiH2_1A1 -0.2733515371 -0.0196519313
|
|
SiH2_3B1 -0.2710982112 -0.0174191051
|
|
SiH3 -0.2791800736 -0.0250056651
|
|
SiH4 -0.2832261904 -0.0301572610
|
|
SiO -0.3691666475 -0.0722590958
|