# generated using pymatgen data_Nb8Co2NiAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.19536205 _cell_length_b 6.19536205 _cell_length_c 5.01601521 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8Co2NiAs _chemical_formula_sum 'Nb8 Co2 Ni1 As1' _cell_volume 192.52725852 _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 Nb Nb0 1 0.66522889 0.15143364 0.49552797 1.0 Nb Nb1 1 0.33477111 0.84856636 0.49552797 1.0 Nb Nb2 1 0.84856636 0.66522889 0.49552797 1.0 Nb Nb3 1 0.15143364 0.33477111 0.49552797 1.0 Nb Nb4 1 0.33477111 0.15143364 0.00447203 1.0 Nb Nb5 1 0.66522889 0.84856636 0.00447203 1.0 Nb Nb6 1 0.15143364 0.66522889 0.00447203 1.0 Nb Nb7 1 0.84856636 0.33477111 0.00447203 1.0 Co Co8 1 0.00000000 0.00000000 0.25000000 1.0 Co Co9 1 0.00000000 0.00000000 0.75000000 1.0 Ni Ni10 1 0.50000000 0.50000000 0.25000000 1.0 As As11 1 0.50000000 0.50000000 0.75000000 1.0