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=107.72291786810347 stress="-9.077472209290704 -1.4663215223928856 0.308418968910028 -1.4663215223928856 -14.640027279499872 -0.11031676990140543 0.308418968910028 -0.11031676990140543 -12.391992766479412" pbc="F T T"
Zr       0.18745344       0.02015752      -0.12029223     -75.48846756      33.23535223      64.01079421 
Zr       1.77711528       1.37871118      -0.24786923      75.43585806     -13.25106254      34.84708409 
Zr       1.23125112      -0.28175649       1.63616082     113.63545116      54.01465996     -63.03149386 
Zr       0.12968218       1.71980528       1.79977655    -113.58284165     -73.99894965     -35.82638444