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=109.66444978122334 stress="-13.972973819293948 0.016531803793315338 -0.22590951159771927 0.016531803793315338 -8.537017356795506 -0.14931763496502035 -0.22590951159771927 -0.14931763496502035 -15.377063535348388" pbc="T F T"
Zr       0.03848316       0.19178619       0.17895518      30.62988222     -83.20805326     -30.37994913 
Zr       1.79140871       1.61455359       0.09583508     -45.85965379      86.35910370     -15.74186884 
Zr       1.64904689       0.10609294       1.46603997     -39.15712507     -91.47850835      21.12688069 
Zr      -0.19401975       1.32157598       1.51361598      54.38689663      88.32745790      24.99493728