# generated using pymatgen data_Li(CuO)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 18.61831555 _cell_length_b 18.61831555 _cell_length_c 18.61831555 _cell_angle_alpha 167.77204647 _cell_angle_beta 167.77204647 _cell_angle_gamma 17.32607766 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li(CuO)3 _chemical_formula_sum 'Li4 Cu12 O12' _cell_volume 289.50174361 _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 Li Li0 1 0.81102400 0.81102400 0.00000000 1.0 Li Li1 1 0.56066500 0.56066500 0.00000000 1.0 Li Li2 1 0.43933500 0.43933500 0.00000000 1.0 Li Li3 1 0.18897600 0.18897600 0.00000000 1.0 Cu Cu4 1 0.62492000 0.12492000 0.50000000 1.0 Cu Cu5 1 0.12492000 0.62492000 0.50000000 1.0 Cu Cu6 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu7 1 0.37508000 0.87508000 0.50000000 1.0 Cu Cu8 1 0.25000000 0.75000000 0.50000000 1.0 Cu Cu9 1 0.07285800 0.07285800 0.00000000 1.0 Cu Cu10 1 0.92714200 0.92714200 0.00000000 1.0 Cu Cu11 1 0.67662900 0.67662900 0.00000000 1.0 Cu Cu12 1 0.32337100 0.32337100 0.00000000 1.0 Cu Cu13 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu14 1 0.75000000 0.25000000 0.50000000 1.0 Cu Cu15 1 0.87508000 0.37508000 0.50000000 1.0 O O16 1 0.32443200 0.82443200 0.50000000 1.0 O O17 1 0.42559200 0.92559200 0.50000000 1.0 O O18 1 0.57440800 0.07440800 0.50000000 1.0 O O19 1 0.17556800 0.67556800 0.50000000 1.0 O O20 1 0.00000000 0.00000000 0.00000000 1.0 O O21 1 0.75367500 0.75367500 0.00000000 1.0 O O22 1 0.50000000 0.50000000 0.00000000 1.0 O O23 1 0.24632500 0.24632500 0.00000000 1.0 O O24 1 0.07440800 0.57440800 0.50000000 1.0 O O25 1 0.92559200 0.42559200 0.50000000 1.0 O O26 1 0.67556800 0.17556800 0.50000000 1.0 O O27 1 0.82443200 0.32443200 0.50000000 1.0