mirror of
https://github.com/pfloos/quack
synced 2024-11-09 07:33:55 +01:00
5 lines
218 B
Plaintext
5 lines
218 B
Plaintext
|
3
|
||
|
|
\ce{HCCl},^1A^\prime,CC3,aug-cc-pVTZ
|
||
|
|
H -0.99521495 0.00000000 -0.07579894
|
||
|
|
Cl 1.20948440 0.00000000 -0.22892822
|
||
|
|
C -0.21426945 0.00000000 0.69937099
|