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=22.502766034070646 stress="-3.27906954085734 -0.3208167976302819 -0.009026734596248897 -0.3208167976302819 -3.7492970279271445 0.389098799479971 -0.009026734596248897 0.389098799479971 -1.9742664839218478" free_energy=22.502766034070646 pbc="T T F"
Ti       2.79224623       2.73214964       0.00041025       9.96514245       7.41998651     -20.92233600 
Ti       1.75551247       1.35444624       0.06482696     -10.05180695       0.53178506     -20.54196460 
Ti       1.34620060       0.13857413       1.20575425      -3.88286546      -3.13190169      18.00481287 
Ti       2.96963223       1.65586213       1.40395547       3.96952996      -4.81986988      23.45948772