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=16.885936123859974 stress="-1.4944311412212092 0.16338147253271082 0.48780523546349464 0.16338147253271082 -1.1790235004215053 0.30939937237769494 0.48780523546349464 0.30939937237769494 -2.1148050921816224" pbc="F F T" Mg 0.29874826 0.05835534 -0.25354363 -15.40333197 -11.04429564 11.08705034 Mg 1.48193431 1.42001865 0.20070203 13.01880676 10.62469548 -6.35942702 Mg 1.20342959 0.28187239 1.51001192 23.06905624 -15.33918024 -5.97054631 Mg 0.10170120 1.37793365 1.21986988 -20.68453103 15.75878040 1.24292298