# generated using pymatgen data_Nb3ZnAuN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.07488760 _cell_length_b 7.07488760 _cell_length_c 7.07488760 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3ZnAuN _chemical_formula_sum 'Nb12 Zn4 Au4 N4' _cell_volume 354.12666808 _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 0.79417242 0.96139826 0.37321555 1.0 Nb Nb1 1 0.70582758 0.03860174 0.87321555 1.0 Nb Nb2 1 0.20582758 0.46139826 0.12678445 1.0 Nb Nb3 1 0.29417242 0.53860174 0.62678445 1.0 Nb Nb4 1 0.96139826 0.37321555 0.79417242 1.0 Nb Nb5 1 0.03860174 0.87321555 0.70582758 1.0 Nb Nb6 1 0.46139826 0.12678445 0.20582758 1.0 Nb Nb7 1 0.53860174 0.62678445 0.29417242 1.0 Nb Nb8 1 0.37321555 0.79417242 0.96139826 1.0 Nb Nb9 1 0.87321555 0.70582758 0.03860174 1.0 Nb Nb10 1 0.12678445 0.20582758 0.46139826 1.0 Nb Nb11 1 0.62678445 0.29417242 0.53860174 1.0 Zn Zn12 1 0.17983663 0.82016337 0.32016337 1.0 Zn Zn13 1 0.32016337 0.17983663 0.82016337 1.0 Zn Zn14 1 0.82016337 0.32016337 0.17983663 1.0 Zn Zn15 1 0.67983663 0.67983663 0.67983663 1.0 Au Au16 1 0.57083799 0.42916201 0.92916201 1.0 Au Au17 1 0.42916201 0.92916201 0.57083799 1.0 Au Au18 1 0.92916201 0.57083799 0.42916201 1.0 Au Au19 1 0.07083799 0.07083799 0.07083799 1.0 N N20 1 0.87458988 0.12541012 0.62541012 1.0 N N21 1 0.62541012 0.87458988 0.12541012 1.0 N N22 1 0.12541012 0.62541012 0.87458988 1.0 N N23 1 0.37458988 0.37458988 0.37458988 1.0