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=15.05820378543227 stress="-80.6506394126527 1.159375430812383 -1.5848647860373646 1.159375430812383 -80.24866016252165 6.709911725442652 -1.5848647860373646 6.709911725442652 -79.5258165637248" pbc="F F F" Zr -0.06141927 -0.24794580 0.15488783 -25.38611413 -24.34960955 -26.51591348 Zr 1.55988540 1.20245745 0.16431082 25.86326971 27.88101768 -32.41351301 Zr 1.31425730 -0.01155935 1.53277713 27.35866325 -32.87309950 39.89084661 Zr -0.10028026 1.37366136 1.46097674 -27.83581883 29.34169136 19.03857988