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=55.442176141023275 stress="-7.401182049226263 -1.4551240166903237 -0.7890452813087455 -1.4551240166903237 -9.160727066338096 0.8304104612836207 -0.7890452813087455 0.8304104612836207 -6.622600718114601" pbc="F T F" W 0.04852473 0.01848935 0.13661615 -96.78255079 -8.68247756 -80.65704173 W 1.40480033 1.28303047 0.11041876 60.02872478 22.86072353 -64.80027648 W 1.26735611 -0.16466555 1.24148635 99.07791149 7.46324720 87.80884277 W 0.08611608 1.53369179 1.52598936 -62.32408547 -21.64149317 57.64847545