# generated using pymatgen data_Cu3P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.95793075 _cell_length_b 6.95793075 _cell_length_c 7.14840700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000710 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu3P _chemical_formula_sum 'Cu18 P6' _cell_volume 299.70920089 _cell_formula_units_Z 6 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 0.68277600 0.06778400 0.07922800 1.0 Cu Cu1 1 0.93221600 0.61499200 0.07922800 1.0 Cu Cu2 1 0.38500800 0.31722400 0.07922800 1.0 Cu Cu3 1 0.61499200 0.93221600 0.42077200 1.0 Cu Cu4 1 0.31722400 0.38500800 0.42077200 1.0 Cu Cu5 1 0.06778400 0.68277600 0.42077200 1.0 Cu Cu6 1 0.31722400 0.93221600 0.92077200 1.0 Cu Cu7 1 0.06778400 0.38500800 0.92077200 1.0 Cu Cu8 1 0.61499200 0.68277600 0.92077200 1.0 Cu Cu9 1 0.38500800 0.06778400 0.57922800 1.0 Cu Cu10 1 0.68277600 0.61499200 0.57922800 1.0 Cu Cu11 1 0.93221600 0.31722400 0.57922800 1.0 Cu Cu12 1 0.33333300 0.66666700 0.67332600 1.0 Cu Cu13 1 0.66666700 0.33333300 0.82667400 1.0 Cu Cu14 1 0.66666700 0.33333300 0.32667400 1.0 Cu Cu15 1 0.33333300 0.66666700 0.17332600 1.0 Cu Cu16 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu17 1 0.00000000 0.00000000 0.00000000 1.0 P P18 1 0.31965500 0.31965500 0.75000000 1.0 P P19 1 0.00000000 0.68034500 0.75000000 1.0 P P20 1 0.68034500 0.00000000 0.75000000 1.0 P P21 1 0.68034500 0.68034500 0.25000000 1.0 P P22 1 0.00000000 0.31965500 0.25000000 1.0 P P23 1 0.31965500 0.00000000 0.25000000 1.0