# generated using pymatgen data_CuSnO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96325100 _cell_length_b 7.96325100 _cell_length_c 6.40254600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CuSnO6 _chemical_formula_sum 'Cu4 Sn4 O24' _cell_volume 406.00699596 _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 Cu Cu0 1 0.75000000 0.25000000 0.75000000 1.0 Cu Cu1 1 0.75000000 0.75000000 0.25000000 1.0 Cu Cu2 1 0.25000000 0.25000000 0.25000000 1.0 Cu Cu3 1 0.25000000 0.75000000 0.75000000 1.0 Sn Sn4 1 0.25000000 0.75000000 0.25000000 1.0 Sn Sn5 1 0.25000000 0.25000000 0.75000000 1.0 Sn Sn6 1 0.75000000 0.75000000 0.75000000 1.0 Sn Sn7 1 0.75000000 0.25000000 0.25000000 1.0 O O8 1 0.77532600 0.49541000 0.89054400 1.0 O O9 1 0.72467400 0.99541000 0.39054400 1.0 O O10 1 0.27532600 0.00459000 0.39054400 1.0 O O11 1 0.22467400 0.50459000 0.89054400 1.0 O O12 1 0.72467400 0.00459000 0.60945600 1.0 O O13 1 0.77532600 0.50459000 0.10945600 1.0 O O14 1 0.22467400 0.49541000 0.10945600 1.0 O O15 1 0.27532600 0.99541000 0.60945600 1.0 O O16 1 0.49541000 0.77532600 0.89054400 1.0 O O17 1 0.99541000 0.72467400 0.39054400 1.0 O O18 1 0.00459000 0.27532600 0.39054400 1.0 O O19 1 0.50459000 0.22467400 0.89054400 1.0 O O20 1 0.00459000 0.72467400 0.60945600 1.0 O O21 1 0.50459000 0.77532600 0.10945600 1.0 O O22 1 0.49541000 0.22467400 0.10945600 1.0 O O23 1 0.99541000 0.27532600 0.60945600 1.0 O O24 1 0.66238200 0.33761800 0.51492700 1.0 O O25 1 0.83761800 0.83761800 0.01492700 1.0 O O26 1 0.16238200 0.16238200 0.01492700 1.0 O O27 1 0.33761800 0.66238200 0.51492700 1.0 O O28 1 0.83761800 0.16238200 0.98507300 1.0 O O29 1 0.66238200 0.66238200 0.48507300 1.0 O O30 1 0.33761800 0.33761800 0.48507300 1.0 O O31 1 0.16238200 0.83761800 0.98507300 1.0