4
1
mirror of https://github.com/pfloos/quack synced 2024-11-14 18:13:59 +01:00
quack/mol/cyclopropenethione.xyz
2020-10-12 14:30:00 +02:00

8 lines
402 B
Plaintext

6
Cyclopropenethione,^1A_1,CC3,aug-cc-pVTZ
C 0.00000000 0.66798433 -1.51647332
C 0.00000000 -0.66798433 -1.51647332
C 0.00000000 0.00000000 -0.26053106
S 0.00000000 0.00000000 1.36433357
H 0.00000000 1.57574861 -2.09085356
H 0.00000000 -1.57574861 -2.09085356