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=-3.3005985856757896 stress="-9.784636596361796 -1.2359885130850718 1.4154947380883578 -1.2359885130850718 -8.55083045260878 -0.7041552405862577 1.4154947380883578 -0.7041552405862577 -8.647370285439834" pbc="F F F" Ni -0.03487808 0.22586561 0.29391194 -3.52454407 -5.78449158 -3.30590274 Ni 1.22614529 1.52103145 -0.22238644 3.90837416 2.84806952 -3.59123777 Ni 1.68220204 0.11446132 1.52558823 2.94866819 -1.53351330 1.62220871 Ni 0.02724172 1.27538150 1.20296332 -3.33249828 4.46993535 5.27493179