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=7.72644364982 stress="-6.5102053674580995 0.09706834568057053 1.8073843982522142 0.09706834568057053 -4.208462060919636 0.33962836783816786 1.8073843982522142 0.33962836783816786 -7.1317629657672015" pbc="F F F" Ti -0.14801295 -0.02432459 0.06329927 -6.57229260 -4.27304390 -6.76965711 Ti 1.43745442 1.27846858 -0.00548572 9.30891552 6.05046380 -10.94640752 Ti 1.34126820 -0.15859300 1.31668137 6.42411591 -6.91260456 6.73400389 Ti -0.08013605 1.24396547 1.59073906 -9.16073884 5.13518465 10.98206075