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=-10.004647374226336 stress="-3.5629662538519957 1.2038321783245474 1.5477140014162987 1.2038321783245474 -2.4267923580984947 0.3071293969989193 1.5477140014162987 0.3071293969989193 -2.0853474977024713" pbc="F F F" Ni -0.05174389 0.03282148 -0.22107074 0.08676527 -0.36439573 -0.26491124 Ni 1.50082602 1.74624097 0.14302402 1.32129267 0.42107539 -1.22431867 Ni 1.35498893 0.11042859 1.70947124 0.92037761 -1.24202197 0.32790700 Ni -0.14487149 1.55280714 1.41333883 -2.32843555 1.18534231 1.16132291