# generated using pymatgen data_Fe2NiN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.21310545 _cell_length_b 3.21654862 _cell_length_c 6.95876774 _cell_angle_alpha 90.00000016 _cell_angle_beta 117.52226049 _cell_angle_gamma 120.03545055 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2NiN2 _chemical_formula_sum 'Fe2 Ni1 N2' _cell_volume 52.65056470 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Fe Fe0 1 0.85681700 0.42840900 0.14233000 1.0 Fe Fe1 1 0.14318300 0.57159100 0.85767000 1.0 Ni Ni2 1 0.00000000 0.00000000 0.50000000 1.0 N N3 1 0.40942600 0.20471300 0.80771500 1.0 N N4 1 0.59057400 0.79528700 0.19228500 1.0