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=172367.567410386 stress="-822339.6014230411 72155.91660329634 354419.5341556292 72155.91660329634 -598427.3027802727 177894.85116312382 354419.5341556292 177894.85116312382 -654532.6589764119" pbc="F F F" Cs -0.15064474 -0.08682541 -0.13035080 -100586.01826426 -87690.70895698 -83386.17875805 Cs 1.23392932 1.37933095 0.23458553 483690.44556648 285301.33302996 -519080.23940289 Cs 1.38326566 -0.11151840 1.28436619 87904.15519378 -301994.53136937 246262.63198291 Cs -0.18843016 1.56739311 1.26090888 -471008.58249600 104383.90729640 356203.78617803