# generated using pymatgen data_Nb4Co2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.23057020 _cell_length_b 8.23057020 _cell_length_c 8.23057020 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Co2N _chemical_formula_sum 'Nb16 Co8 N4' _cell_volume 394.25278709 _cell_formula_units_Z 4 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 Nb Nb0 1 0.12500000 0.62500000 0.62500000 1.0 Nb Nb1 1 0.62500000 0.12500000 0.62500000 1.0 Nb Nb2 1 0.62500000 0.62500000 0.12500000 1.0 Nb Nb3 1 0.62500000 0.62500000 0.62500000 1.0 Nb Nb4 1 0.81399700 0.81399700 0.18600300 1.0 Nb Nb5 1 0.18600300 0.18600300 0.81399700 1.0 Nb Nb6 1 0.81399700 0.18600300 0.81399700 1.0 Nb Nb7 1 0.18600300 0.81399700 0.18600300 1.0 Nb Nb8 1 0.18600300 0.81399700 0.81399700 1.0 Nb Nb9 1 0.81399700 0.18600300 0.18600300 1.0 Nb Nb10 1 0.43600300 0.43600300 0.06399700 1.0 Nb Nb11 1 0.06399700 0.06399700 0.43600300 1.0 Nb Nb12 1 0.43600300 0.06399700 0.43600300 1.0 Nb Nb13 1 0.06399700 0.43600300 0.06399700 1.0 Nb Nb14 1 0.06399700 0.43600300 0.43600300 1.0 Nb Nb15 1 0.43600300 0.06399700 0.06399700 1.0 Co Co16 1 0.73631400 0.42122900 0.42122900 1.0 Co Co17 1 0.42122900 0.73631400 0.42122900 1.0 Co Co18 1 0.42122900 0.42122900 0.73631400 1.0 Co Co19 1 0.42122900 0.42122900 0.42122900 1.0 Co Co20 1 0.51368600 0.82877100 0.82877100 1.0 Co Co21 1 0.82877100 0.51368600 0.82877100 1.0 Co Co22 1 0.82877100 0.82877100 0.51368600 1.0 Co Co23 1 0.82877100 0.82877100 0.82877100 1.0 N N24 1 0.62500000 0.12500000 0.12500000 1.0 N N25 1 0.12500000 0.62500000 0.12500000 1.0 N N26 1 0.12500000 0.12500000 0.62500000 1.0 N N27 1 0.12500000 0.12500000 0.12500000 1.0