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=1233.1333202075994 stress="-7189.57454965953 2922.834022038859 414.30166065530466 2922.834022038859 -5063.283570006146 -375.5716717491305 414.30166065530466 -375.5716717491305 -3210.331817648604" pbc="F F F" Md -0.06578038 -0.18214339 0.19871175 -1062.05731297 -1220.34072822 -720.25765224 Md 1.48154581 1.20791012 -0.19211375 693.69147891 1071.97644273 -1093.31236853 Md 1.67661605 0.10576935 1.60770732 3995.63590633 -3058.60569591 566.20916955 Md 0.16739062 1.20664120 1.79027304 -3627.27007227 3206.96998140 1247.36085122