# generated using pymatgen data_Fe3Ni(Mo3N)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.69072900 _cell_length_b 6.68865400 _cell_length_c 6.69308720 _cell_angle_alpha 89.76106883 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe3Ni(Mo3N)2 _chemical_formula_sum 'Fe6 Ni2 Mo12 N4' _cell_volume 299.52624164 _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 0.18121400 0.31970600 0.56897800 1.0 Fe Fe1 1 0.68121400 0.68029400 0.43102200 1.0 Fe Fe2 1 0.93049400 0.43092800 0.32241100 1.0 Fe Fe3 1 0.57056400 0.92872400 0.18309000 1.0 Fe Fe4 1 0.43049400 0.56907200 0.67758900 1.0 Fe Fe5 1 0.07056400 0.07127600 0.81691000 1.0 Ni Ni6 1 0.31843600 0.81744200 0.93203500 1.0 Ni Ni7 1 0.81843600 0.18255800 0.06796500 1.0 Mo Mo8 1 0.37482100 0.95234900 0.54825800 1.0 Mo Mo9 1 0.87482100 0.04765100 0.45174200 1.0 Mo Mo10 1 0.12357300 0.45085700 0.95357400 1.0 Mo Mo11 1 0.62357300 0.54914300 0.04642600 1.0 Mo Mo12 1 0.79735100 0.37543700 0.70146500 1.0 Mo Mo13 1 0.70233300 0.87583100 0.79883700 1.0 Mo Mo14 1 0.20233300 0.12416900 0.20116300 1.0 Mo Mo15 1 0.29735100 0.62456300 0.29853500 1.0 Mo Mo16 1 0.95158100 0.79803100 0.12493600 1.0 Mo Mo17 1 0.04911100 0.70268400 0.62604600 1.0 Mo Mo18 1 0.45158100 0.20196900 0.87506400 1.0 Mo Mo19 1 0.54911100 0.29731600 0.37395400 1.0 N N20 1 0.62516200 0.12512200 0.62566600 1.0 N N21 1 0.12516200 0.87487800 0.37433400 1.0 N N22 1 0.87536100 0.62465000 0.87527000 1.0 N N23 1 0.37536100 0.37535000 0.12473000 1.0