# generated using pymatgen data_Fe5CoN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.85032700 _cell_length_b 5.67582400 _cell_length_c 4.67962000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe5CoN4 _chemical_formula_sum 'Fe10 Co2 N8' _cell_volume 181.94947697 _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 0.55613400 0.49601700 0.24859300 1.0 Fe Fe1 1 0.94386600 0.49601700 0.24859300 1.0 Fe Fe2 1 0.55613400 0.00398300 0.24859300 1.0 Fe Fe3 1 0.94386600 0.00398300 0.24859300 1.0 Fe Fe4 1 0.44386600 0.50398300 0.75140700 1.0 Fe Fe5 1 0.05613400 0.50398300 0.75140700 1.0 Fe Fe6 1 0.44386600 0.99601700 0.75140700 1.0 Fe Fe7 1 0.05613400 0.99601700 0.75140700 1.0 Fe Fe8 1 0.75000000 0.75000000 0.70596600 1.0 Fe Fe9 1 0.25000000 0.25000000 0.29403400 1.0 Co Co10 1 0.75000000 0.25000000 0.70673600 1.0 Co Co11 1 0.25000000 0.75000000 0.29326400 1.0 N N12 1 0.75000000 0.99571900 0.97526500 1.0 N N13 1 0.75000000 0.50428100 0.97526500 1.0 N N14 1 0.25000000 0.00428100 0.02473500 1.0 N N15 1 0.25000000 0.49571900 0.02473500 1.0 N N16 1 0.50924300 0.75000000 0.49621400 1.0 N N17 1 0.99075700 0.75000000 0.49621400 1.0 N N18 1 0.49075700 0.25000000 0.50378600 1.0 N N19 1 0.00924300 0.25000000 0.50378600 1.0