# generated using pymatgen data_Ce3Ta(ClO2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.32175197 _cell_length_b 9.32175197 _cell_length_c 5.41006100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999976 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3Ta(ClO2)3 _chemical_formula_sum 'Ce6 Ta2 Cl6 O12' _cell_volume 407.12510226 _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 Ce Ce0 1 0.58914500 0.67959100 0.75000000 1.0 Ce Ce1 1 0.09044700 0.41085500 0.75000000 1.0 Ce Ce2 1 0.41085500 0.32040900 0.25000000 1.0 Ce Ce3 1 0.32040900 0.90955300 0.75000000 1.0 Ce Ce4 1 0.90955300 0.58914500 0.25000000 1.0 Ce Ce5 1 0.67959100 0.09044700 0.25000000 1.0 Ta Ta6 1 0.66666700 0.33333300 0.75000000 1.0 Ta Ta7 1 0.33333300 0.66666700 0.25000000 1.0 Cl Cl8 1 0.94792300 0.75904900 0.75000000 1.0 Cl Cl9 1 0.24095100 0.18887500 0.75000000 1.0 Cl Cl10 1 0.05207700 0.24095100 0.25000000 1.0 Cl Cl11 1 0.18887500 0.94792300 0.25000000 1.0 Cl Cl12 1 0.81112500 0.05207700 0.75000000 1.0 Cl Cl13 1 0.75904900 0.81112500 0.25000000 1.0 O O14 1 0.63460500 0.47935400 0.98857400 1.0 O O15 1 0.84474900 0.36539500 0.51142600 1.0 O O16 1 0.47935400 0.84474900 0.01142600 1.0 O O17 1 0.52064600 0.15525100 0.51142600 1.0 O O18 1 0.47935400 0.84474900 0.48857400 1.0 O O19 1 0.15525100 0.63460500 0.48857400 1.0 O O20 1 0.36539500 0.52064600 0.48857400 1.0 O O21 1 0.15525100 0.63460500 0.01142600 1.0 O O22 1 0.52064600 0.15525100 0.98857400 1.0 O O23 1 0.63460500 0.47935400 0.51142600 1.0 O O24 1 0.84474900 0.36539500 0.98857400 1.0 O O25 1 0.36539500 0.52064600 0.01142600 1.0