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=61.44686708409101 stress="-3.6764241437279566 -0.5166259254359514 0.9036782974365934 -0.5166259254359514 -7.784842019189177 1.0471497303648005 0.9036782974365934 1.0471497303648005 -7.409827008281931" pbc="F T T"
Zr       0.22094491       0.23171545       0.18190327     -34.40211318      -8.02768514      -8.49567089 
Zr       1.32183498       1.71219253      -0.07514625      29.33654960     -36.93886146      30.36818342 
Zr       1.62990665      -0.21779550       1.78278197      43.22712550      39.39084739     -39.10283362 
Zr       0.06210000       1.63362859       1.32702941     -38.16156192       5.57569920      17.23032109