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:Z:I:1:forces:R:3 energy=48807.407285864305 pbc="F T F" W -0.13580710 0.09435532 0.00205728 74 -49173.14525565 -34857.24389265 -10974.06057692 W 1.20267844 1.29312450 -0.06838890 74 46652.47805905 38556.36684138 -24796.56875810 W 1.22617775 0.01525336 1.48891107 74 152894.79317016 -182270.22641966 -14246.23222353 W 0.29895143 1.30524937 1.69711922 74 -150374.12597356 178571.10347093 50016.86155856