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=91.9455027718162 pbc="T T F" Zr -0.29657041 -0.09914834 -0.00206453 40 69.00511539 28.10181418 -81.64025879 Zr 1.78187239 1.51001192 -0.01546661 40 -46.15155865 -28.82325205 -65.49917394 Zr 1.60170120 -0.12206635 1.21904386 40 -43.37415904 33.75571020 82.09687456 Zr 0.00082602 1.74624097 1.64302402 40 20.52060230 -33.03427234 65.04255817