data_[Tl2Cd2O3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.3645]
_cell_length_b [5.8587]
_cell_length_c [7.5234]
_cell_angle_alpha [88.9900]
_cell_angle_beta [78.0696]
_cell_angle_gamma [73.5281]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2Cd2O3]
_chemical_formula_sum '[Tl2 Cd2 O3]'
_cell_volume [139.0089]
_cell_formula_units_Z [1]
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
[
  Tl  Tl0  2  0.2777  0.7599  0.6608  1
  Cd  Cd1  2  0.4047  0.2670  0.9177  1
  O  O2  2  0.1604  0.4981  0.1941  1
  O  O3  1  0.0000  0.0000  0.0000  1
]