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=12.196924295589074 stress="-1.5749625047323539 -0.0001272570466380329 0.4322970841894485 -0.0001272570466380329 -2.562016066861867 -0.9769417498447756 0.4322970841894485 -0.9769417498447756 -2.312598301614496" pbc="F T F" Cn 0.29430872 0.17035565 0.15685964 -7.60545453 -38.47984819 -38.58294648 Cn 1.41291672 1.53484224 0.27563606 20.50492409 16.47110244 -18.46911211 Cn 1.68202036 0.13951129 1.31855546 10.13360896 -8.07494294 13.92980732 Cn 0.05445852 1.27903926 1.28044779 -23.03307852 30.08368869 43.12225128