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:Z:I:1:forces:R:3 energy=97.0403482351 pbc="F T F" Sr -0.09481051 0.04044737 0.10459395 38 -35.85929228 -11.08657882 -27.53820826 Sr 1.22286420 1.26954570 -0.02208018 38 24.60666299 16.89914436 -42.90881333 Sr 1.65488783 0.35379734 1.20245745 38 39.63882766 -13.67963276 33.26659078 Sr -0.10954388 1.33528874 1.48844065 38 -28.38619837 7.86706722 37.18043081