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=-17.72075394387625 stress="-0.2603293046335681 -0.015518727672000325 -0.20923490782731674 -0.015518727672000325 1.279254732770656 0.1319846094858638 -0.20923490782731674 0.1319846094858638 -0.32496196279140377" free_energy=-17.72075394387625 pbc="T T T"
Ti       2.72014664       0.07165922       0.09622051      -0.93142628       0.06596612       0.25949049 
O       1.63918523       1.16441130       0.15050642      -5.06092535      -1.11286371      -3.52787186 
Ti       1.46314097       2.48812280       1.06341584       0.67525683       0.09141531      -0.95337413 
O       2.88979497       1.26509356       1.54278917       5.31709481       0.95548229       4.22175550