data_[Ti2Cd2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  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 [5.3506]
_cell_length_b [5.6555]
_cell_length_c [5.7882]
_cell_angle_alpha [118.5380]
_cell_angle_beta [101.9202]
_cell_angle_gamma [102.8481]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TiCdO3]
_chemical_formula_sum '[Ti2 Cd2 O6]'
_cell_volume [139.6572]
_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
[
  Ti  Ti0  2  0.2965  0.0747  0.1377  1.0
  Cd  Cd1  2  0.0075  0.6746  0.3474  1.0
  O  O2  2  0.1097  0.2779  0.0597  1.0
  O  O3  2  0.2778  0.1132  0.4598  1.0
  O  O4  2  0.3193  0.7617  0.7852  1.0
]