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=90.18469690402209 stress="-15.735452610660836 4.478947202372338 -0.21104703058955887 4.478947202372338 -11.43174587516603 0.7498717274606755 -0.21104703058955887 0.7498717274606755 -7.283320765374648" pbc="T F F" Ti -0.25956104 0.21547056 0.01635763 38.49469302 -99.13388851 -56.56002774 Al 1.36828723 1.42773702 0.04797327 -54.48936355 143.29345087 -76.70662155 Ti 1.65944719 0.25900491 1.38008494 74.07961243 -187.21782552 63.29930364 Al 0.25685297 1.21574623 1.62784938 -58.08494190 143.05826315 69.96734565