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=-7.110606574103261 stress="-39.69982860777825 -2.4223613674861406 0.21877253380523243 -2.4223613674861406 -37.944150451253726 5.8085732225773015 0.21877253380523243 5.8085732225773015 -43.868946802485304" pbc="F F F"
Zr      -0.15344509      -0.12758765      -0.17769156     -13.06092230     -12.86195498      -9.57181108 
Zr       1.41049160       1.22286420      -0.06141927      15.97174753      15.59488043     -17.85957683 
Zr       1.25205420       0.15488783       1.55988540       9.22922954     -14.43011024      20.43452151 
Zr      -0.29754255       1.66431082       1.31425730     -12.14005477      11.69718479       6.99686640