mirror of
https://github.com/pfloos/quack
synced 2024-08-25 13:41:46 +02:00
11 lines
569 B
Plaintext
11 lines
569 B
Plaintext
9
|
|
Furan,^1A_1,CC3,aug-cc-pVTZ
|
|
C 0.00000000 1.09204092 -0.31777753
|
|
C 0.00000000 -1.09204092 -0.31777753
|
|
C 0.00000000 0.71623383 0.98604985
|
|
C 0.00000000 -0.71623383 0.98604985
|
|
O 0.00000000 0.00000000 -1.13214994
|
|
H 0.00000000 2.04440888 -0.81369302
|
|
H 0.00000000 -2.04440888 -0.81369302
|
|
H 0.00000000 1.37146217 1.83713421
|
|
H 0.00000000 -1.37146217 1.83713421 |