4
1
mirror of https://github.com/pfloos/quack synced 2024-12-23 12:56:38 +01:00
quack/examples/molecule.BN

6 lines
157 B
Plaintext
Raw Normal View History

2019-03-19 10:18:03 +01:00
# nAt nEl nCore nRyd
2 12 0 0
# Znuc x y z
5. 0. 0. 0.
7. 0. 0. 2.420738991