# generated using pymatgen data_CuBiO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.74372822 _cell_length_b 6.74372822 _cell_length_c 6.74372822 _cell_angle_alpha 145.77921736 _cell_angle_beta 126.81929937 _cell_angle_gamma 64.77526205 _symmetry_Int_Tables_number 1 _chemical_formula_structural CuBiO2 _chemical_formula_sum 'Cu2 Bi2 O4' _cell_volume 136.42437204 _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 0.27625400 0.00000000 0.27625400 1.0 Cu Cu1 1 0.72374600 0.00000000 0.72374600 1.0 Bi Bi2 1 0.19633200 0.69633200 0.50000000 1.0 Bi Bi3 1 0.80366800 0.30366800 0.50000000 1.0 O O4 1 0.08587900 0.83990500 0.24597400 1.0 O O5 1 0.59393200 0.83990500 0.75402600 1.0 O O6 1 0.40606800 0.16009500 0.24597400 1.0 O O7 1 0.91412100 0.16009500 0.75402600 1.0