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=9.16947956183 stress="-6.0134250461693135 -0.31660472789473076 0.5654602880800917 -0.31660472789473076 -5.253201312132103 -0.38066509903751305 0.5654602880800917 -0.38066509903751305 -6.113430003027347" pbc="F F F" Mg -0.21988289 0.13572127 0.05791531 -8.43397301 -9.58094810 -7.03052204 Mg 1.23387496 1.58501927 0.06603388 11.33606344 7.47050939 -10.95472143 Mg 1.50693356 0.16501753 1.72580078 6.89342151 -6.18147194 6.79332877 Mg -0.07133680 1.68883157 1.49955875 -9.79551193 8.29191065 11.19191470