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=41.209628213542864 stress="-154.95800459710168 19.18971150601383 -42.61816570099295 19.18971150601383 -126.891955921689 -21.031209595217618 -42.61816570099295 -21.031209595217618 -171.67169513285342" pbc="F F F" W 0.19178619 0.17895518 0.29140871 -71.04244646 -57.35039215 -117.29157203 W 1.61455359 1.53253581 0.14904689 29.34238825 37.48811526 -23.84834835 W 1.28091226 0.10609294 1.46603997 87.66420442 -43.97734624 88.81862822 W -0.19401975 1.32157598 1.51361598 -45.96414621 63.83962313 52.32129215