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=253.50954748843043 stress="-672.4206642876802 -253.0382307458919 -1046.8288139161284 -253.0382307458919 -136.5340176213078 -441.26360157476284 -1046.8288139161284 -441.26360157476284 -1745.1460895289554" pbc="F F T" user01 -0.09481051 0.04044737 0.10459395 -73.88064063 -46.45208932 -62.31509533 user01 0.47286420 0.68858073 -0.24794580 2011.03125216 813.86592689 3325.89110980 user01 0.73585280 -0.05810263 0.38546338 57.32935023 -17.70574585 7.81519155 user01 0.16431082 0.56425730 0.73844065 -1994.47996176 -749.70809173 -3271.39120602