10
1
mirror of https://github.com/pfloos/quack synced 2024-12-23 12:55:25 +01:00
QuAcK/mol/con.xyz
2020-10-12 14:30:00 +02:00

5 lines
207 B
Plaintext

3
\ce{CON},,CC3,aug-cc-pVTZ
C 0.00000000 0.00000000 -1.29152344
O 0.00000000 0.00000000 -0.10824635
N 0.00000000 0.00000000 1.23042072