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=35.0982373491715 stress="-2.768335525632119 -0.07754685265973692 -0.602278982198961 -0.07754685265973692 -2.8001112516753297 0.48561914907032294 -0.602278982198961 0.48561914907032294 -3.5230911647528393" pbc="F F T" Mg 0.24122900 0.02201293 -0.18365652 -21.74276042 -35.10933566 12.26251094 Mg 1.42534241 1.48566276 -0.18556893 29.62546465 28.97599107 12.31232735 Mg 1.54376171 0.19273990 1.30538954 25.61924188 -20.84257211 -1.96951457 Mg 0.05332204 1.38436473 1.73110688 -33.50194611 26.97591670 -22.60532371