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=-0.43518977155601324 stress="3.484800908231158 -1.3101704207677933 -0.9987211376548122 -1.3101704207677933 3.6402930462203504 -0.8531462894016395 -0.9987211376548122 -0.8531462894016395 3.997331035976757" pbc="F F F" Ni -0.29779682 -0.28244114 0.09664331 0.43106008 0.44663216 0.32100412 Ni 1.39917148 1.76235339 -0.15161904 -0.93556163 -0.94459303 2.18328040 Ni 1.71005355 0.21211731 1.44968690 -1.55343782 1.85095904 -0.86226423 Ni 0.29594673 1.65710459 1.49042854 2.05793937 -1.35299816 -1.64202030