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=137.5217204827294 stress="-16.418561427696304 2.5693550440073682 -1.142097902907848 2.5693550440073682 -14.768931818102276 -1.158195646284816 -1.142097902907848 -1.158195646284816 -22.214608151425068" pbc="F F T" W 0.26235339 0.21005355 0.21211731 -121.72421320 -199.87559980 -138.42364285 W 1.44968690 1.79594673 0.21042663 82.32610609 117.48119712 -44.03253868 W 1.49042854 0.24122900 1.52201293 244.81428896 -131.92478986 85.02396870 W 0.04376171 1.22051529 1.57710464 -205.41618185 214.31919255 97.43221282