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=-5.412944744508103 stress="-8.184149798559902 0.46672932875190526 -1.5654478266006175 0.46672932875190526 -7.189496237204763 0.03416109055517236 -1.5654478266006175 0.03416109055517236 -8.352204888470148" pbc="F F F" Ni 0.04852473 0.05473499 -0.08438932 -3.33745217 -2.26742949 -3.89245738 Ni 1.63661615 1.40480033 -0.12280496 1.57385351 2.90021694 -1.80136816 Ni 1.29869006 0.11041876 1.26735611 4.14165128 -3.55856296 3.85419195 Ni -0.16466555 1.24148635 1.58611608 -2.37805262 2.92577551 1.83963359