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=41.77206320944789 stress="-113.01786578064066 34.224060011468765 2.9337635002530504 34.224060011468765 -97.40624744398096 5.607730300906553 2.9337635002530504 5.607730300906553 -81.31992486052002" pbc="F F F" Mg 0.23171545 0.18190327 -0.17816502 -22.60501775 -20.47616375 -26.93249301 Mg 1.71219253 1.42485375 0.12990665 29.13127529 29.13828931 -23.94930153 Mg 1.28220450 0.28278197 1.56210000 60.29165299 -68.09499420 32.66084871 Mg 0.13362859 1.32702941 1.57034430 -66.81791053 59.43286864 18.22094583