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=34.52502852793228 stress="-161.3286552962013 55.1624585779216 3.7448116967170506 55.1624585779216 -140.01694835139003 9.239440590354832 3.7448116967170506 9.239440590354832 -108.3440648925893" pbc="F F F" W 0.23171545 0.18190327 -0.17816502 -30.27732606 -27.13547743 -35.33064207 W 1.71219253 1.42485375 0.12990665 38.83942329 39.92907458 -32.58405709 W 1.28220450 0.28278197 1.56210000 89.66577572 -100.58666625 44.53922221 W 0.13362859 1.32702941 1.57034430 -98.22787295 87.79306910 23.37547695