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=96.9529484396 pbc="F T F" Sr -0.09481051 0.04044737 0.10459395 38 -35.85907205 -11.08558821 -27.53804490 Sr 1.22286420 1.26954570 -0.02208018 38 24.60659002 16.89862420 -42.90870048 Sr 1.65488783 0.35379734 1.20245745 38 39.63854949 -13.67970267 33.26643904 Sr -0.10954388 1.33528874 1.48844065 38 -28.38606746 7.86666667 37.18030635