mirror of
https://github.com/pfloos/quack
synced 2024-12-23 12:56:38 +01:00
8 lines
341 B
Plaintext
8 lines
341 B
Plaintext
|
5
|
||
|
|
Methanimine,^1A^\prime,CC3,aug-cc-pVTZ
|
||
|
|
C 0.05660421 0.00000000 0.58786894
|
||
|
|
N 0.05696070 0.00000000 -0.68622506
|
||
|
|
H -0.84213766 0.00000000 1.20280208
|
||
|
|
H 1.00795114 0.00000000 1.10806523
|
||
|
|
H -0.89936939 0.00000000 -1.03833820
|