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=29.3613504819 stress="-26.304141334224912 -2.2293533589953776 0.2830769730386249 -2.2293533589953776 -24.828483977154093 3.164521544582778 0.2830769730386249 3.164521544582778 -25.944355382658017" pbc="F F F"
Ti      -0.13934333       0.17089611      -0.02988876     -49.70841391     -36.88305549     -12.37116953 
Ti       1.20220318       1.21755886      -0.14458569      44.78697420      44.33000287     -52.61013165 
Ti       1.39917148       0.26235339       1.34838096      31.74616917     -40.72883402      39.35969017 
Ti       0.21005355       1.71211731       1.44968690     -26.82472946      33.28188663      25.62161101