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=4.055429007672753 stress="-11.820155641474132 -0.16276390726350654 -0.05721345565053948 -0.16276390726350654 -11.610535810252427 -0.7284341182156338 -0.05721345565053948 -0.7284341182156338 -11.679516288698117" pbc="F F F" Mg 0.26959405 0.17626233 -0.14597521 -3.34171763 -4.47803126 -5.70254628 Mg 1.70996341 1.49207130 0.15300231 4.58895649 4.49462299 -2.67680779 Mg 1.53848316 -0.04225341 1.41852158 3.05050566 -3.99618230 4.12798805 Mg -0.04210664 1.38825682 1.27041603 -4.29774452 3.97959057 4.25136602