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=2.8117241370153367 stress="-12.070356093092943 0.6222408101120467 -0.48158382355405305 0.6222408101120467 -10.387908414904429 -0.28268538624613626 -0.48158382355405305 -0.28268538624613626 -11.297356102871113" pbc="F F F" Al 0.19178619 0.17895518 0.29140871 -4.35726421 -4.25641013 -6.42172104 Al 1.61455359 1.53253581 0.14904689 3.36871879 3.74101628 -2.71325102 Al 1.28091226 0.10609294 1.46603997 5.19267292 -3.89576929 5.33328679 Al -0.19401975 1.32157598 1.51361598 -4.20412750 4.41116314 3.80168527