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=15319.113243952263 stress="-2556.833863712269 1122.2974121242264 549.7617370770844 1122.2974121242264 -2233.1011636538174 371.09040817630876 549.7617370770844 371.09040817630876 -2043.036122813157" free_energy=15319.113243952263 pbc="F T T"
Xe       0.23171545       0.18190327      -0.17816502  -20059.16993665  -15895.94028305   26912.01889592
Xe       1.62780321       1.32965408       0.00710170    8247.72129887    9261.04613294    3290.63456741
Xe       1.28220450       0.28278197       1.56210000   51088.06381996  -37072.40143408  -19502.46813179
Xe       0.13362859       1.32702941       1.57034430  -39276.61518218   43707.29558419  -10700.18533154