4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=770.7854600011578 stress="-705.2769100485084 -24.794324590928902 48.01329009471214 -24.794324590928902 -917.9599971190581 233.01205777228435 48.01329009471214 233.01205777228435 -730.3710220640882" pbc="F T F" user01 0.08004885 0.13417175 0.33595892 -3022.15710648 -1069.06882754 -1794.95045745 user01 0.63813862 0.46439497 0.41657831 3270.43280996 4419.92953742 -3563.86067453 user01 0.56425730 -0.01155935 0.78277713 1702.88248027 -5548.14812994 3140.28602086 user01 0.21813893 0.51716069 0.94410236 -1951.15818375 2197.28742005 2218.52511112