10
0
mirror of https://github.com/LCPQ/QUESTDB_website.git synced 2024-12-30 16:15:50 +01:00
QUESTDB_website/data/structures/QUEST1/thioformaldehyde.xyz

13 lines
562 B
Plaintext
Raw Normal View History

4
Thioformaldehyde,^1A_1,CC3,aug-cc-pVTZ
C 0.00000000 0.00000000 -1.10427274
S 0.00000000 0.00000000 0.51463116
H 0.00000000 0.91895736 -1.67756323
H 0.00000000 -0.91895736 -1.67756323
4
Thioformaldehyde,^1A_1,CC3,aug-cc-pVTZ
C 0.00000000 0.00000000 -1.16554829
S 0.00000000 0.00000000 0.54355587
H 0.00000000 0.93470789 -1.70347110
H 0.00000000 -0.93470789 -1.70347110