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=551.4126219034316 stress="-54.27037370582393 -0.27602505413197304 1.9955211919870395 -0.27602505413197304 -50.933897265118794 -0.5035752219023168 1.9955211919870395 -0.5035752219023168 -166.7729783401146" pbc="F F T" Tb 0.21813893 0.19410236 -0.16903503 -592.19375393 -593.93511068 272.98566761 Tb 1.38201197 1.43300593 -0.27997518 533.25993748 645.47219313 169.25226184 Tb 1.27696427 0.22586561 1.79391194 681.77971537 -600.31344213 -269.15103712 Tb 0.02103145 1.27761356 1.68220204 -622.84589893 548.77635967 -173.08689232