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=42.41120106895175 stress="-4.214271476326405 0.10514951430012125 0.3969332665189 0.10514951430012125 -3.967556417613511 0.1660202557524665 0.3969332665189 0.1660202557524665 -4.310145145200262" pbc="T T T" Zr 0.16431082 -0.18574270 -0.01155935 -7.25986519 16.54477462 3.59094615 Zr 1.53277713 1.39971974 -0.12633864 -2.77229992 -13.73618993 9.49087826 Zr 1.46097674 -0.21780693 1.71813893 -2.34309446 19.98096715 -15.55685018 Zr -0.23283931 1.69410236 1.33096497 12.37525957 -22.78955184 2.47502578