4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=6093.016547328536 stress="-967.8966894294389 201.57676138004723 -252.89983517387554 201.57676138004723 -913.9201737024089 -120.64933875852566 -252.89983517387554 -120.64933875852566 -845.2870856719472" free_energy=6093.016547328536 pbc="T T F"
Xe       0.18584377       0.18362810       0.19581920   -8065.50424585   -2404.51212334  -12371.02812555
Xe       1.56537167       1.72748741       0.17626233    2936.54639874    -294.61784514   -5338.30579659
Xe       1.35402479       0.20996341       1.49207130   12042.42898294   -4496.34345621   10792.73035529
Xe       0.15300231       1.53848316       1.45774659   -6913.47113583    7195.47342469    6916.60356685