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=3.1883575625333744 stress="-57.83399301749186 12.333568226311943 -9.193841486196384 12.333568226311943 -59.50783214093508 -6.172698046664976 -9.193841486196384 -6.172698046664976 -51.90979962037686" pbc="F F F" Zr -0.03568003 0.04396501 0.07236142 -20.24756834 -16.45720381 -22.19668547 Zr 1.58250455 1.49067673 -0.09461738 12.09437032 12.96283434 -8.31182289 Zr 1.28229695 0.02031036 1.68745344 29.95533928 -26.54615095 16.59118181 Zr 0.02015752 1.37970777 1.77711528 -21.80214126 30.04052042 13.91732654