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=641352.4470408446 stress="-99394.89530258914 -3935.288611944288 -6354.731409461134 -3935.288611944288 -105581.37702392721 -5907.309886132945 -6354.731409461134 -5907.309886132945 -82197.35278827585" pbc="T T T" Ra 0.38902621 -0.21260705 0.28459835 -527229.53918739 -164149.83671787 -329555.81034785 Ra 1.59828530 1.07797761 0.18609842 -25589.70094648 426724.84721137 -463543.37287665 Ra 1.61855837 -0.19257660 1.73459763 -481636.99412655 553155.35271417 212531.97480194 Ra -0.26937607 1.54355566 1.44877855 1034456.23426042 -815730.36320767 580567.20842257