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=-4.6520818538 stress="-1.9365002618638334 0.7877585031393292 0.716215240671869 0.7877585031393292 -1.870197178380793 0.44106389099552346 0.716215240671869 0.44106389099552346 -2.2757670291874326" pbc="F F F"
Ti      -0.29779682      -0.28244114      -0.14458569      -1.21388051      -1.25769019      -0.97968577 
Ti       1.39917148       1.76235339      -0.15161904       4.01306693       3.23386004      -8.44542280 
Ti       1.71005355       0.21211731       1.44968690       5.60049081      -6.81017199       2.75962838 
Ti       0.29594673       1.65710459       1.49042854      -8.39967723       4.83400214       6.66548018