# generated using pymatgen data_Fe2NiN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.74600300 _cell_length_b 2.80037900 _cell_length_c 11.82632900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2NiN2 _chemical_formula_sum 'Fe4 Ni2 N4' _cell_volume 90.94268583 _cell_formula_units_Z 2 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 0.75000000 0.72761600 0.06994900 1.0 Fe Fe1 1 0.75000000 0.72761600 0.43005100 1.0 Fe Fe2 1 0.25000000 0.27238400 0.93005100 1.0 Fe Fe3 1 0.25000000 0.27238400 0.56994900 1.0 Ni Ni4 1 0.75000000 0.79521200 0.75000000 1.0 Ni Ni5 1 0.25000000 0.20478800 0.25000000 1.0 N N6 1 0.75000000 0.76453700 0.59581200 1.0 N N7 1 0.75000000 0.76453700 0.90418800 1.0 N N8 1 0.25000000 0.23546300 0.40418800 1.0 N N9 1 0.25000000 0.23546300 0.09581200 1.0