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=10.67273148800452 stress="-1.338607359291194 0.0752303710185132 0.17224837433396853 0.0752303710185132 -2.437272034423119 -0.5067039762032173 0.17224837433396853 -0.5067039762032173 -2.711125059073533" free_energy=10.67273148800452 pbc="T F T"
Ti       2.91852158       0.19178619       0.17895518      11.56033570     -23.98558499     -19.07377025 
Ti       1.79140871       1.61455359       0.09583508      -9.80731625      23.18830860      -4.76171538 
Ti       1.64904689       0.10609294       1.46603997     -11.43813014     -26.25624913       5.32567411 
Ti       2.80598025       1.32157598       1.51361598       9.68511069      27.05352552      18.50981152