10
1
mirror of https://github.com/pfloos/quack synced 2024-11-05 05:33:50 +01:00
QuAcK/examples/molecule.O3-RM

7 lines
222 B
Plaintext
Raw Normal View History

2019-03-19 10:18:03 +01:00
# nAt nEl nCore nRyd
3 24 6 0
# Znuc x y z
8. 0.00000 0.65550 -0.73139
8. -0.00000 -0.61386 0.00000
8. 0.00000 0.65550 0.73139