mirror of
https://github.com/pfloos/quack
synced 2024-11-05 13:43:51 +01:00
8 lines
307 B
Plaintext
8 lines
307 B
Plaintext
6
|
|
Nitrosomethane,^1A^\prime,CC3,aug-cc-pVTZ
|
|
C -0.94419297 0.00000000 -0.56740524
|
|
N -0.00286683 0.00000000 0.57183096
|
|
O 1.15791903 0.00000000 0.22993880
|
|
H -0.40928669 0.00000000 -1.51564611
|
|
H -1.57415127 0.88267715 -0.45733920
|
|
H -1.57415127 -0.88267715 -0.45733920 |