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:Z:I:1:forces:R:3 energy=55.06649830659867 pbc="T T T" Ti -0.14459490 0.11115480 0.11044915 22 -17.40761930 -18.43525246 -19.91787157 Ti 0.95960170 0.56143450 -0.16166483 22 20.12419875 11.57750310 -19.13255548 Ti 0.53829595 -0.16490224 0.89041416 22 14.18834362 -21.67582265 23.42836942 Ti -0.22187219 0.76878885 0.57834452 22 -16.90492308 28.53357201 15.62205763