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=-7.475313880754134 stress="-0.3070162386276614 -0.07885065484757989 0.13603530784007364 -0.07885065484757989 -0.16750176910436776 -0.03195110628255563 0.13603530784007364 -0.03195110628255563 0.6161947466879754" free_energy=-7.475313880754134 pbc="F T T"
Ti       0.47880117       2.77493780       0.39737960      -0.61676236       0.84541547       0.29727104 
Ti       1.67378400       1.86487704       0.16162860      -0.11439370      -1.01085399      -1.14356540 
O       1.71338862       2.86129912       1.20918501       5.87999945       2.30935075      -1.44719705 
O       0.25219415       1.62370952       1.57924967      -5.14884339      -2.14391222       2.29349141