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=0.28084811667150444 stress="-7.923702697454353 0.2979495373518558 -0.22929580903204183 0.2979495373518558 -7.202662901855312 -0.21963107467379128 -0.22929580903204183 -0.21963107467379128 -7.689337189994482" pbc="F F F" Mg -0.17769156 -0.08950840 -0.27713580 -2.26734832 -2.16653599 -2.35376178 Mg 1.43858073 1.25205420 0.15488783 2.98132924 2.45318719 -2.27325688 Mg 1.55988540 -0.29754255 1.66431082 1.77547239 -2.44340467 2.25749728 Mg -0.18574270 1.48844065 1.53277713 -2.48945330 2.15675348 2.36952138