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=-3.74666645385 stress="-2.711176163870691 0.5248367280277029 0.22847731291048176 0.5248367280277029 -3.2650940266101354 -0.10062939709763566 0.22847731291048176 -0.10062939709763566 -3.2218410361969423" pbc="F F F" Ti -0.14568130 -0.21988289 0.13572127 -3.08844176 -3.87941911 -3.26584072 Ni 1.55791531 1.23387496 0.08501927 3.56548000 3.56746832 -6.00251556 Ni 1.56603388 0.00693356 1.66501753 4.76516019 -6.39534683 4.28857427 Ti 0.22580078 1.42866320 1.68883157 -5.24219842 6.70729762 4.97978201