# generated using pymatgen data_Cu11PdN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.41219000 _cell_length_b 7.41219000 _cell_length_c 7.79618300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu11PdN4 _chemical_formula_sum 'Cu22 Pd2 N8' _cell_volume 428.32666453 _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 Cu Cu0 1 0.50000000 0.50000000 0.76900200 1.0 Cu Cu1 1 0.50000000 0.50000000 0.23099800 1.0 Cu Cu2 1 0.50000000 0.24624100 0.50000000 1.0 Cu Cu3 1 0.50000000 0.75375900 0.50000000 1.0 Cu Cu4 1 0.75375900 0.50000000 0.50000000 1.0 Cu Cu5 1 0.24624100 0.50000000 0.50000000 1.0 Cu Cu6 1 0.00000000 0.26267100 0.00000000 1.0 Cu Cu7 1 0.00000000 0.73732900 0.00000000 1.0 Cu Cu8 1 0.73732900 0.00000000 0.00000000 1.0 Cu Cu9 1 0.26267100 0.00000000 0.00000000 1.0 Cu Cu10 1 0.00000000 0.25554000 0.50000000 1.0 Cu Cu11 1 0.00000000 0.74446000 0.50000000 1.0 Cu Cu12 1 0.74446000 0.00000000 0.50000000 1.0 Cu Cu13 1 0.25554000 0.00000000 0.50000000 1.0 Cu Cu14 1 0.25497600 0.25497600 0.75590400 1.0 Cu Cu15 1 0.74502400 0.74502400 0.75590400 1.0 Cu Cu16 1 0.74502400 0.25497600 0.75590400 1.0 Cu Cu17 1 0.25497600 0.74502400 0.75590400 1.0 Cu Cu18 1 0.74502400 0.74502400 0.24409600 1.0 Cu Cu19 1 0.25497600 0.25497600 0.24409600 1.0 Cu Cu20 1 0.25497600 0.74502400 0.24409600 1.0 Cu Cu21 1 0.74502400 0.25497600 0.24409600 1.0 Pd Pd22 1 0.00000000 0.00000000 0.75140500 1.0 Pd Pd23 1 0.00000000 0.00000000 0.24859500 1.0 N N24 1 0.00000000 0.00000000 0.00000000 1.0 N N25 1 0.00000000 0.00000000 0.50000000 1.0 N N26 1 0.50000000 0.50000000 0.00000000 1.0 N N27 1 0.50000000 0.50000000 0.50000000 1.0 N N28 1 0.50000000 0.00000000 0.50000000 1.0 N N29 1 0.00000000 0.50000000 0.50000000 1.0 N N30 1 0.50000000 0.00000000 0.00000000 1.0 N N31 1 0.00000000 0.50000000 0.00000000 1.0