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:Z:I:1:forces:R:3 energy=57403.705963450084 pbc="F T T"
Zr       0.22824136       0.29447307      -0.23400602       40  -44964.57266719  -81756.43220887   75841.72317033 
Zr       1.54445255       1.71101299      -0.07773676       40   43134.00240273  -42720.98318393  -47167.50740760 
Zr       1.33392855      -0.13385582       1.23401044       40   49938.85420819   40943.80374815   52498.30598635 
Zr       0.14381375       1.35936760       1.44648351       40  -48108.28394373   83533.61164465  -81172.52174908