# generated using pymatgen data_Cu27CO _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.54242555 _cell_length_b 7.54242555 _cell_length_c 14.03961000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999603 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu27CO _chemical_formula_sum 'Cu27 C1 O1' _cell_volume 691.68404303 _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 Cu Cu0 1 0.77750600 0.88875300 0.14791000 1.0 Cu Cu1 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu2 1 0.88882300 0.11117700 0.29582000 1.0 Cu Cu3 1 0.11124700 0.88875300 0.14791000 1.0 Cu Cu4 1 0.33306600 0.99986100 0.00000000 1.0 Cu Cu5 1 0.22235500 0.11117700 0.29582000 1.0 Cu Cu6 1 0.44437500 0.88875100 0.14791000 1.0 Cu Cu7 1 0.66679500 0.99986100 0.00000000 1.0 Cu Cu8 1 0.55548500 0.11097100 0.29582000 1.0 Cu Cu9 1 0.77771300 0.22228700 0.14791000 1.0 Cu Cu10 1 0.00013900 0.33320500 0.00000000 1.0 Cu Cu11 1 0.88902900 0.44451500 0.29582000 1.0 Cu Cu12 1 0.11124700 0.22249400 0.14791000 1.0 Cu Cu13 1 0.33306600 0.33320500 0.00000000 1.0 Cu Cu14 1 0.22215500 0.44431100 0.29582000 1.0 Cu Cu15 1 0.44457500 0.22228700 0.14791000 1.0 Cu Cu16 1 0.66666700 0.33333300 0.00000000 1.0 Cu Cu17 1 0.55548500 0.44451500 0.29582000 1.0 Cu Cu18 1 0.77771300 0.55542500 0.14791000 1.0 Cu Cu19 1 0.00013900 0.66693400 0.00000000 1.0 Cu Cu20 1 0.88882300 0.77764500 0.29582000 1.0 Cu Cu21 1 0.11124900 0.55562500 0.14791000 1.0 Cu Cu22 1 0.33333300 0.66666700 0.00000000 1.0 Cu Cu23 1 0.22215500 0.77784500 0.29582000 1.0 Cu Cu24 1 0.44437500 0.55562500 0.14791000 1.0 Cu Cu25 1 0.66679500 0.66693400 0.00000000 1.0 Cu Cu26 1 0.55568900 0.77784500 0.29582000 1.0 C C27 1 0.00000000 0.00000000 0.39890600 1.0 O O28 1 0.00000000 0.00000000 0.48327600 1.0