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=311625.78710504225 stress="-55686.20992002567 11329.141150163123 -2126.353285493448 11329.141150163123 -51519.17414505904 -11607.174480425707 -2126.353285493448 -11607.174480425707 -33377.896418351134" pbc="T T T" Pm -0.20731043 -0.04367246 0.15558366 189450.67936358 153838.00486696 -93402.42970492 Pm 1.45037310 1.75588813 -0.04081631 60331.57787497 -173625.84304833 125593.69425658 Pm 1.34711882 0.13060584 1.37577258 445372.19306537 -459042.30595286 34356.93062603 Pm 0.28297328 1.39079621 1.65274028 -695154.45030392 478830.14413424 -66548.19517768