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=6.689210560794804 stress="-33.03543253039688 2.35840307811812 -1.8834841015645836 2.35840307811812 -57.565330751351176 -27.148608004949928 -1.8834841015645836 -27.148608004949928 -49.45879043455382" pbc="F F F" Ni 0.13102478 0.09995250 0.26120756 -9.41574750 -37.41782039 -33.68290659 Ni 1.51193751 1.63197526 -0.03568003 10.45061836 5.20366422 -9.03733417 Ni 1.54396501 0.07236142 1.70379337 14.33663093 -9.96454972 7.48412824 Ni 0.23854596 1.26922180 1.28229695 -15.37150179 42.17870589 35.23611251