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=-6.092276857583458 stress="-0.4436655066450793 0.17857837387193223 -0.004915755487537812 0.17857837387193223 -0.47373165650329774 0.0039846980198834986 -0.004915755487537812 0.0039846980198834986 -0.1300982166224233" free_energy=-6.092276857583458 pbc="T T F"
O       0.22580078       2.92866320       0.18883157      -3.90850068       4.53466719      -2.14297068 
O       1.49955875       1.54313966       0.25980354       4.09310576      -4.67328348      -0.58610049 
Ti       1.46667242       0.45986988       1.40295338      -0.50484248      -0.13059334       1.56695954 
Ti       0.27400154       2.03928974       1.61018303       0.32023740       0.26920964       1.16211163