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=63.553167827482454 stress="-10.252035309336406 -0.1666153380447072 1.9665882596659334 -0.1666153380447072 -4.298239591253547 1.3553870878606142 1.9665882596659334 1.3553870878606142 -14.564031409267399" pbc="T F T" Ti 0.10031152 0.05442580 -0.14568130 -109.40402992 -49.27907115 117.03986575 Ti 1.28011711 1.63572127 0.05791531 58.70388636 31.03944069 47.83075591 Al 1.23387496 0.08501927 1.56603388 107.58670535 -23.79328185 -97.03127811 Al 0.00693356 1.66501753 1.72580078 -56.88656179 42.03291231 -67.83934355