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=31.656424254715635 stress="-2.967289341982879 -0.02497241150005372 0.060699491658517166 -0.02497241150005372 -2.5428038845133067 -0.12815417909938698 0.060699491658517166 -0.12815417909938698 -3.493090012708311" pbc="T F T" Al 0.03848316 0.19178619 0.17895518 10.97761440 -25.12238240 -10.88304945 Al 1.79140871 1.61455359 0.03253581 -15.43618052 24.62707424 -2.94882519 Al 1.64904689 0.10609294 1.46603997 -14.47910545 -27.19701648 6.55826148 Al -0.19401975 1.32157598 1.51361598 18.93767158 27.69232465 7.27361317