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=7.579212545978636 stress="-23.229300247435646 9.213507945463503 0.8359243551127058 9.213507945463503 -19.597228872643974 0.6896483597452949 0.8359243551127058 0.6896483597452949 -14.690352553875329" pbc="F F F" Mg 0.23171545 0.18190327 -0.17816502 -3.81735251 -3.55186839 -4.87995261 Mg 1.71219253 1.42485375 0.12990665 5.13689818 4.87280235 -4.30698730 Mg 1.28220450 0.28278197 1.56210000 13.49045368 -14.41536968 5.60832738 Mg 0.13362859 1.32702941 1.57034430 -14.80999935 13.09443573 3.57861253