Krypton 256
1       0       0       0   83.80 0 Kr
end
Lennard-Jones
1 1 5.4516 3.83
end
5.99 5.99 5.99 90.0 90.0 90.0 4 4 4
Krypton 0.0 0.0 0.0
Krypton 0.0 0.5 0.5
Krypton 0.5 0.0 0.5
Krypton 0.5 0.5 0.0
end