2019-04-08 20:56:21 +02:00
|
|
|
Be -0.0163528296 -0.0163528296
|
|
|
|
BeH -0.0201662246 -0.0201662246
|
2019-04-02 13:36:54 +02:00
|
|
|
C -0.0555290731 -0.0154408226
|
2019-03-27 10:56:27 +01:00
|
|
|
C2H2 -0.1449749881 -0.0671603762
|
|
|
|
C2H4 -0.1513278397 -0.0737412090
|
|
|
|
C2H6 -0.1584151508 -0.0811723311
|
|
|
|
CH -0.0645167432 -0.0252034053
|
|
|
|
CH2_1A1 -0.0719888543 -0.0331095335
|
|
|
|
CH2_3B1 -0.0671338360 -0.0278347317
|
|
|
|
CH3 -0.0758564859 -0.0370715429
|
|
|
|
CH3Cl -0.4733004748 -0.1026996287
|
2019-04-02 13:36:54 +02:00
|
|
|
CH3SH -0.4492819889 -0.0880480425
|
2019-03-27 10:56:27 +01:00
|
|
|
CH4 -0.0822254875 -0.0437158999
|
|
|
|
CN -0.1500879138 -0.0703613330
|
|
|
|
CO -0.1726132269 -0.0919640581
|
|
|
|
CO2 -0.2831236534 -0.1616481462
|
|
|
|
CS -0.4329368116 -0.0703841291
|
2019-04-02 13:36:54 +02:00
|
|
|
Cl -0.3885209083 -0.0560078694
|
2019-03-27 10:56:27 +01:00
|
|
|
Cl2 -0.7871856722 -0.1227184008
|
|
|
|
ClF -0.5211913520 -0.1475015946
|
|
|
|
ClO -0.4957172706 -0.1218540945
|
2019-04-02 13:36:54 +02:00
|
|
|
F -0.1223201573 -0.0803409119
|
2019-03-27 10:56:27 +01:00
|
|
|
F2 -0.2533785738 -0.1698863231
|
2019-04-02 13:36:54 +02:00
|
|
|
H 0.0000000000 0.0000000000
|
2019-03-27 10:56:27 +01:00
|
|
|
H2CO -0.1821036470 -0.1020535445
|
|
|
|
H2O -0.1151843702 -0.0739483867
|
|
|
|
H2O2 -0.2202808130 -0.1375984600
|
|
|
|
H2S -0.3717446584 -0.0492649617
|
|
|
|
H3COH -0.1907827429 -0.1110545651
|
|
|
|
HCN -0.1580317403 -0.0784949888
|
|
|
|
HCO -0.1757336411 -0.0954157746
|
|
|
|
HCl -0.3958443424 -0.0640517843
|
|
|
|
HF -0.1336185503 -0.0921053995
|
|
|
|
HOCl -0.5036558536 -0.1302953182
|
2019-04-08 20:56:21 +02:00
|
|
|
Li -0.0132722259 -0.0132722259
|
|
|
|
Li2 -0.0276406006 -0.0276406006
|
|
|
|
LiF -0.1482158315 -0.1068506173
|
|
|
|
LiH -0.0175420213 -0.0175420213
|
2019-04-02 13:36:54 +02:00
|
|
|
Mg -0.2896236416 -0.2609346054
|
|
|
|
N -0.0668413610 -0.0241885640
|
2019-03-27 10:56:27 +01:00
|
|
|
N2 -0.1710255251 -0.0897902826
|
|
|
|
N2H4 -0.1885832595 -0.1081508455
|
|
|
|
NH -0.0791062491 -0.0377205891
|
|
|
|
NH2 -0.0893357924 -0.0487478190
|
|
|
|
NH3 -0.0977273295 -0.0575625902
|
|
|
|
NO -0.1874295428 -0.1053610308
|
2019-04-08 20:56:21 +02:00
|
|
|
Na -0.1574491136 -0.1147512576
|
|
|
|
Na2 -0.3157943517 -0.2304065706
|
|
|
|
NaCl -0.5565954746 -0.1821418638
|
2019-04-02 13:36:54 +02:00
|
|
|
O -0.0939427871 -0.0513523073
|
2019-03-27 10:56:27 +01:00
|
|
|
O2 -0.2036915694 -0.1205526547
|
|
|
|
OH -0.1056053338 -0.0639339670
|
2019-04-02 13:36:54 +02:00
|
|
|
P -0.3312195545 -0.0157751787
|
2019-03-27 10:56:27 +01:00
|
|
|
P2 -0.6883597046 -0.0595575128
|
|
|
|
PH2 -0.3449442313 -0.0310183698
|
|
|
|
PH3 -0.3499867422 -0.0366850358
|
2019-04-02 13:36:54 +02:00
|
|
|
S -0.3584611026 -0.0345136617
|
2019-03-27 10:56:27 +01:00
|
|
|
S2 -0.7311532954 -0.0845961237
|
|
|
|
SO -0.4682625281 -0.1038642151
|
|
|
|
SO2 -0.5831776854 -0.1790800416
|
2019-04-02 13:36:54 +02:00
|
|
|
Si -0.3163287916 -0.0097428029
|
2019-03-27 10:56:27 +01:00
|
|
|
Si2 -0.6427586203 -0.0306099293
|
|
|
|
Si2H6 -0.6640790687 -0.0543639312
|
2019-04-02 13:36:54 +02:00
|
|
|
SiH2_1A1 -0.3228807680 -0.0182802113
|
|
|
|
SiH2_3B1 -0.3202698623 -0.0156271327
|
2019-03-27 10:56:27 +01:00
|
|
|
SiH3 -0.3285303494 -0.0232836139
|
|
|
|
SiH4 -0.3334803690 -0.0287158979
|
|
|
|
SiO -0.4311888674 -0.0836659882
|