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=56.77653452901811 stress="-151.62650900151118 -6.475668080132207 -1.6704104707992684 -6.475668080132207 -153.69653554180445 -10.467082058230602 -1.6704104707992684 -10.467082058230602 -156.02603583932253" pbc="F F F" W 0.26959405 0.17626233 -0.14597521 -44.84961137 -60.85287465 -76.68928285 W 1.70996341 1.49207130 0.15300231 60.37195026 60.94670150 -35.11863878 W 1.53848316 -0.04225341 1.41852158 37.85313445 -51.46138440 55.10906618 W -0.04210664 1.38825682 1.27041603 -53.37547334 51.36755755 56.69885546