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=718.961956045068 stress="-113.687603202558 58.98054574121428 -19.444759076514824 58.98054574121428 -120.31425598113641 -19.441450258994 -19.444759076514824 -19.441450258994 -88.76105294801401" pbc="T F F" Ar 0.15839933 0.09073906 0.27219963 -370.80113396 -1095.50844705 -1413.95152425 Ar 1.43381326 1.63132919 0.25978669 340.27904211 289.29388779 -417.27398315 Ar 1.22592512 0.18365717 1.70288723 1936.24705137 -1646.48941946 934.25001042 Ar 0.08343331 1.29585403 1.44809454 -1905.72495952 2452.70397872 896.97549697