data_[Ta4Cd4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Cd  1.6900  1.5500  1.0900
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.5190]
_cell_length_b [3.8327]
_cell_length_c [7.5981]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.3431]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TaCdO3]
_chemical_formula_sum '[Ta4 Cd4 O12]'
_cell_volume [306.2431]
_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
[
  Ta  Ta0  4  0.1335  0.0000  0.9004  1.0
  Cd  Cd1  4  0.1073  0.5000  0.4190  1.0
  O  O2  4  0.0408  0.0000  0.1614  1.0
  O  O3  4  0.1758  0.5000  0.9541  1.0
  O  O4  4  0.2013  0.0000  0.6778  1.0
]