mirror of
https://github.com/pfloos/quack
synced 2024-11-14 10:03:53 +01:00
7 lines
346 B
Plaintext
7 lines
346 B
Plaintext
|
5
|
||
|
Cyanoformaldehyde,^1A^\prime,CC3,aug-cc-pVTZ
|
||
|
C -0.48452250 0.00000000 -0.64836291
|
||
|
C -0.00577977 0.00000000 0.73832485
|
||
|
N 0.33957439 0.00000000 1.84587767
|
||
|
O 0.26900027 0.00000000 -1.58931955
|
||
|
H -1.57272638 0.00000000 -0.75442506
|