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=2935.941666095263 stress="-467.70998806867874 -208.60342387775984 7.783581588639276 -208.60342387775984 -617.1539593858179 27.515448966812073 7.783581588639276 27.515448966812073 -306.01067846093224" pbc="F T F" Ti 0.28360219 0.27496406 0.28510096 -6914.82184065 -3245.73046262 -2632.03486467 Ti 1.42274589 1.66684829 0.02508307 6042.25354010 3218.45814124 -2803.20717410 Ti 1.62170918 0.06071765 1.69384051 3997.72306689 1344.56657863 2506.53564733 Ti 0.15695454 1.77053922 1.65169353 -3125.15476635 -1317.29425725 2928.70639145