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=739.772594858651 stress="-2875.1550460923645 374.6923500422812 276.4201148247346 374.6923500422812 -3464.1869221837123 -23.85949941929448 276.4201148247346 -23.85949941929448 -2646.9953259981426" pbc="F F F" Xe -0.06254558 -0.22153142 -0.00548572 -1053.92728209 -829.20302030 -515.47458626 Xe 1.34126820 1.34140700 -0.18331863 1076.23478897 763.41333084 -1005.93318910 Xe 1.41986395 -0.25603453 1.59073906 1195.28779518 -1279.47280112 545.83799926 Xe 0.27219963 1.43381326 1.63132919 -1217.59530206 1345.26249058 975.56977610