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=-8.646602877076887 stress="-20.25881287113824 0.3765255984164886 -1.3255621216667013 0.3765255984164886 -17.649537131365687 0.3470497160644239 -1.3255621216667013 0.3470497160644239 -18.840492280984243" pbc="F F F" V -0.14801295 -0.02432459 0.06329927 -8.18964779 -5.33590440 -7.43949728 V 1.43745442 1.27846858 -0.00548572 5.66480013 6.62749925 -5.85700967 V 1.34126820 -0.15859300 1.31668137 7.81345511 -7.59568571 6.83066359 V -0.08013605 1.24396547 1.59073906 -5.28860746 6.30409086 6.46584336