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=-1.0064646928543182 stress="-35.246600818334194 -9.092989724586332 -5.187045106109856 -9.092989724586332 -25.835850515850787 4.274076447314533 -5.187045106109856 4.274076447314533 -36.09080020599675" pbc="F F F" Ti 0.27219963 -0.06618674 0.13132919 -17.35598594 -13.92438476 -9.84495033 Ti 1.75978669 1.22592512 -0.21495266 10.72747217 14.09104458 -11.80280554 Ti 1.68365717 0.20288723 1.58343331 11.89001908 -6.32907815 17.51059657 Ti -0.20414597 1.44809454 1.72094491 -5.26150532 6.16241834 4.13715931