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=-3.2312277526227033 stress="-0.521180424873612 0.13621629946100977 -0.04908164068007892 0.13621629946100977 -0.6229401609126087 0.13926901157061358 -0.04908164068007892 0.13926901157061358 -0.8090612177585966" pbc="T F T" Ni -0.08147842 0.19178619 0.17895518 2.34248703 -5.25230165 0.57815576 Ni 1.79140871 1.61455359 0.09583508 -3.27915663 7.55401695 0.01761439 Ni 1.58650132 0.10609294 1.46603997 0.05808610 -7.13480108 2.56048777 Ni -0.19401975 1.32157598 1.51361598 0.87858349 4.83308578 -3.15625792