# generated using pymatgen data_CuSnO12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.91744600 _cell_length_b 7.91744600 _cell_length_c 8.36501400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CuSnO12 _chemical_formula_sum 'Cu2 Sn2 O24' _cell_volume 524.36885908 _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 0.00000000 0.00000000 0.00000000 1.0 Cu Cu1 1 0.50000000 0.50000000 0.50000000 1.0 Sn Sn2 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn3 1 0.50000000 0.50000000 0.00000000 1.0 O O4 1 0.43565700 0.56434300 0.26426000 1.0 O O5 1 0.56434300 0.43565700 0.26426000 1.0 O O6 1 0.93565700 0.93565700 0.76426000 1.0 O O7 1 0.56434300 0.56434300 0.73574000 1.0 O O8 1 0.06434300 0.93565700 0.23574000 1.0 O O9 1 0.06434300 0.06434300 0.76426000 1.0 O O10 1 0.43565700 0.43565700 0.73574000 1.0 O O11 1 0.93565700 0.06434300 0.23574000 1.0 O O12 1 0.06120200 0.32809900 0.04655900 1.0 O O13 1 0.93879800 0.67190100 0.04655900 1.0 O O14 1 0.17190100 0.56120200 0.54655900 1.0 O O15 1 0.93879800 0.32809900 0.95344100 1.0 O O16 1 0.43879800 0.17190100 0.45344100 1.0 O O17 1 0.82809900 0.43879800 0.54655900 1.0 O O18 1 0.06120200 0.67190100 0.95344100 1.0 O O19 1 0.56120200 0.82809900 0.45344100 1.0 O O20 1 0.82809900 0.56120200 0.45344100 1.0 O O21 1 0.32809900 0.93879800 0.95344100 1.0 O O22 1 0.17190100 0.43879800 0.45344100 1.0 O O23 1 0.67190100 0.06120200 0.95344100 1.0 O O24 1 0.56120200 0.17190100 0.54655900 1.0 O O25 1 0.43879800 0.82809900 0.54655900 1.0 O O26 1 0.32809900 0.06120200 0.04655900 1.0 O O27 1 0.67190100 0.93879800 0.04655900 1.0