16
Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-55.507711819582426 stress="-0.0011508386197084917 -0.00028169519985080853 -0.0006081270859214113 -0.00028169519985080853 -0.0015473447492408668 -0.0005311933929085086 -0.0006081270859214113 -0.0005311933929085086 -0.001168858591647061" pbc="F F F"
Zr      21.29326255      20.89962354      21.04210903      -7.27558411     -14.17951358     -12.09604421 
Zr      22.02011096      22.32071561      22.24190094       8.77108393      12.60932824      11.11146729 
Zr      24.37261145      21.27219963      20.93381326      -2.96234010      -4.40883102      -3.34660732 
Zr      25.63132919      22.75978669      22.22592512       9.91461054      -2.98021392       6.72440406 
Zr      20.78504734      24.19366909      21.20288723      -2.51214641       0.28648827      -2.46280671 
Zr      22.58343331      25.29585403      22.44809454      -4.32052939       6.17148246       2.46359840 
Zr      24.22094491      24.23171545      21.18190327      -6.44588669      -4.28351014     -15.30768002 
Zr      25.32183498      25.71219253      22.42485375       7.21175817       8.99348132       5.18028975 
Zr      21.11444005      20.88390571      24.16071562      -2.56146201      -3.48962390      -0.67277283 
Zr      22.28114386      22.63362859      25.32702941       5.88860365      -4.10071309       8.58166232 
Zr      24.07117031      21.04852473      24.30097596      -1.84772544      -5.13645165      -3.18984932 
Zr      25.41561068      22.63661615      25.40480033       5.86990160       0.13254629       5.20714470 
Zr      20.87719504      23.94171408      24.11041876     -14.81114053      -2.09018178      -9.75422457 
Zr      22.12234504      25.33533445      25.24148635       5.92358039       9.70182313       7.73704020 
Zr      24.08611608      24.03369179      24.02598936      -5.28847898      -3.55044002      -5.84286523 
Zr      25.22329650      25.46375436      25.40583543       4.44575537       6.32432936       5.66724348