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:Z:I:1:forces:R:3 energy=138.68776448530355 pbc="T F T" Al -0.28244114 -0.14458569 -0.10082852 13 269.48460622 -125.87082786 288.76633055 Al 1.76235339 1.32502509 0.21005355 13 -40.37319356 90.65666148 -41.75501582 Ti 1.71211731 0.19091591 1.79594673 22 -282.70552014 -3.30626528 -322.45298620 Ti 0.15710459 1.30677202 1.35687199 22 53.59410748 38.52043165 75.44167147