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=29.905534599112407 stress="-1.704705894810532 0.034089963651160494 0.114380960178942 0.034089963651160494 -2.1707609941807466 0.030994162935401647 0.114380960178942 0.030994162935401647 -3.2064609262808226" free_energy=29.905534599112407 pbc="F F T" Mg 0.26111147 0.22232616 2.97927008 -17.15749358 -25.70950296 -5.43145751 Mg 1.22147108 1.69736496 2.82128623 18.25233237 22.78170920 -10.57771107 Mg 1.63856038 0.27820060 1.28858747 19.42444766 -15.42074065 5.76421457 Mg 0.17621204 1.63215382 1.21035018 -20.51928644 18.34853440 10.24495401