# generated using pymatgen data_LiCoCuO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.82749200 _cell_length_b 5.00246500 _cell_length_c 5.23089502 _cell_angle_alpha 67.11207463 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCoCuO4 _chemical_formula_sum 'Li1 Co1 Cu1 O4' _cell_volume 68.16275671 _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 Li Li0 1 0.50000000 0.50000000 0.00000000 1.0 Co Co1 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu2 1 0.00000000 0.50000000 0.50000000 1.0 O O3 1 0.00000000 0.76515200 0.72352900 1.0 O O4 1 0.50000000 0.25287800 0.69213400 1.0 O O5 1 0.00000000 0.23484800 0.27647100 1.0 O O6 1 0.50000000 0.74712200 0.30786600 1.0