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=700.082883639 stress="-410.1577695757542 13.962000882361528 -11.286902509803976 13.962000882361528 -774.2643078326877 111.98398386915588 -11.286902509803976 111.98398386915588 -826.31592516347" pbc="F T T" C 0.05085060 -0.06103317 -0.14047807 -513.12096098 -12.60064306 76.70692989 C 0.75041301 0.87312049 -0.00521054 507.72347540 -103.83119061 70.33369547 C 0.67749447 0.05521430 0.79094180 540.22152501 81.51696322 -61.90789704 C -0.07243575 0.68755779 0.70666942 -534.82403943 34.91487044 -85.13272832