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=116.33950441376474 stress="-544.522987623129 -178.09730792115408 28.634639327187415 -178.09730792115408 -490.05674899686375 40.61268264062582 28.634639327187415 40.61268264062582 -446.80711372915925" pbc="F F F" Mg 0.28815009 -0.03675154 0.16749490 -324.33856035 -266.82747805 -107.82303370 Mg 1.37167697 1.21206650 0.11604511 349.25625072 278.90924177 -257.81785336 Mg 1.52082391 0.01941426 1.40957514 126.64156870 -96.18638349 211.62647976 Mg 0.22225699 1.71288174 1.27573778 -151.55925908 84.10461977 154.01440730