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=-3.67716786332 stress="-2.8239754758584845 0.5292546830347827 0.7146647376453731 0.5292546830347827 -2.5456090839915992 0.22670155176672843 0.7146647376453731 0.22670155176672843 -3.451900172002723" pbc="F F F" Ni -0.28678287 0.21736445 -0.21395222 -2.17663460 -3.03523295 -2.74551274 Ti 1.70384132 1.29224623 -0.26785036 4.04896945 3.51469729 -6.63752823 Ni 1.50041025 0.25551247 1.35444624 3.15804506 -6.07776579 4.96162393 Ti -0.00811119 1.56482696 1.34620060 -5.03037991 5.59830145 4.42141703