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=4.73501097618 stress="-3.270800402181399 -0.13689055519056842 0.3838463787350635 -0.13689055519056842 -3.2348717086138192 -0.11203002318192995 0.3838463787350635 -0.11203002318192995 -3.190368640770849" pbc="F F F" Mg 0.21182891 -0.20698176 -0.26758015 -4.26050449 -6.23893368 -5.47208827 Mg 1.57255377 1.51129231 0.01258782 7.60848079 6.16062902 -5.68197238 Mg 1.66911338 -0.19545900 1.62365747 4.09664981 -4.43606278 4.93057132 Mg -0.04411261 1.45297513 1.34681875 -7.44462611 4.51436744 6.22348933