mirror of
https://github.com/pfloos/quack
synced 2024-11-14 18:13:59 +01:00
8 lines
398 B
Plaintext
8 lines
398 B
Plaintext
6
|
|
Formamide,^1A^\prime,CC3,aug-cc-pVTZ
|
|
C 0.00096902 0.00000000 0.41970790
|
|
O 1.20026470 0.00000000 0.23240841
|
|
N -0.93604058 0.00000000 -0.56208803
|
|
H -0.44521509 0.00000000 1.42281192
|
|
H -0.64165073 0.00000000 -1.52189729
|
|
H -1.91365033 0.00000000 -0.34413091 |