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=6.1025260565632005 stress="-0.11224570291810639 -0.027068803531261 0.019628745536579482 -0.027068803531261 0.10157970516051308 -0.041834918227674954 0.019628745536579482 -0.041834918227674954 -0.0764517641303629" free_energy=6.1025260565632005 pbc="T F T"
Ti       2.56681392       0.22586561       0.29391194       0.05769764       1.16009122      -0.69226285 
Ti       1.22614529       1.52103145       2.77761356       0.69824789      -1.72439809       0.65485074 
Ti       1.68220204       0.23573857       1.52724172      -0.58429396       1.09659488      -0.25314415 
Ti       2.76273580       1.20296332       1.34887301      -0.17165157      -0.53228801       0.29055626