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=56.55118696081896 stress="-7.548709936837287 -1.4701405542533519 -0.7911253319136583 -1.4701405542533519 -9.459014532977616 0.8396885719071803 -0.7911253319136583 0.8396885719071803 -6.763484763402458" pbc="F T F" W 0.04852473 0.01848935 0.13661615 -98.58440063 -8.76657077 -82.23157423 W 1.40480033 1.28303047 0.11041876 61.39873630 23.10704760 -66.27166061 W 1.26735611 -0.16466555 1.24148635 100.86324413 7.52882377 89.44886816 W 0.08611608 1.53369179 1.52598936 -63.67757980 -21.86930060 59.05436667