mirror of
https://github.com/pfloos/quack
synced 2024-11-14 18:13:59 +01:00
6 lines
278 B
Plaintext
6 lines
278 B
Plaintext
|
4
|
||
|
|
\ce{H2PO},^2A^\prime,CC3,aug-cc-pVTZ
|
||
|
|
P 0.00000000 0.46444181 -0.05297517
|
||
|
|
O 0.00000000 -1.03672337 0.03017006
|
||
|
|
H 1.10122600 1.08986752 0.57463978
|
||
|
|
H -1.10122600 1.08986752 0.57463978
|