mirror of
https://github.com/pfloos/quack
synced 2024-11-05 13:43:51 +01:00
10 lines
299 B
Plaintext
10 lines
299 B
Plaintext
# nAt nEla nElb nCore nRyd
|
|
6 13 13 0 0
|
|
# Znuc x y z
|
|
C 0.00000000 0.00000000 1.29447700
|
|
C 0.00000000 0.00000000 -1.29447700
|
|
C 0.00000000 0.00000000 3.58448429
|
|
C 0.00000000 0.00000000 -3.58448429
|
|
H 0.00000000 0.00000000 5.58943003
|
|
H 0.00000000 0.00000000 -5.58943003
|