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=-0.903067965944 stress="-7.043799838979971 0.03960290343578769 -0.6736149163729669 0.03960290343578769 -6.355756791230293 0.3286942368487958 -0.6736149163729669 0.3286942368487958 -4.953777269101039" pbc="F F F" Ti -0.14459490 0.11115480 0.11044915 -15.85751821 -13.53456455 -12.17804920 Ti 1.70960170 1.31143450 -0.16166483 12.78526951 9.83516724 -6.99651493 Ti 1.28829595 -0.16490224 1.64041416 11.82094603 -12.04023174 12.18821744 Ti -0.22187219 1.51878885 1.32834452 -8.74869733 15.73962906 6.98634670