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=107.91540059335205 stress="-7.534290356797356 -1.0616827365019799 1.1263008433222041 -1.0616827365019799 -15.013470840812879 0.6723384244375665 1.1263008433222041 0.6723384244375665 -14.694293770128844" pbc="F T T"
Zr       0.22094491       0.30205975       0.18190327     -70.97121829     -12.72887558     -17.27689292 
Zr       1.32183498       1.71219253      -0.07514625      69.54484649     -33.99682505      25.39837995 
Zr       1.62990665      -0.21779550       1.78278197      81.06304490      46.88992765     -38.05380189 
Zr       0.06210000       1.68215332       1.32702941     -79.63667310      -0.16422701      29.93231486