data_[Cd1Bi2Ir1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
  Ir  2.2000  1.3500  0.7650
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.9332]
_cell_length_b [6.9829]
_cell_length_c [4.9598]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2981]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CdBi2IrO8]
_chemical_formula_sum '[Cd1 Bi2 Ir1 O8]'
_cell_volume [170.8512]
_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
[
  Cd  Cd0  1  0.0000  0.5000  0.0000  1.0
  Bi  Bi1  2  0.5000  0.2490  0.5000  1.0
  Ir  Ir2  1  0.0000  0.0000  0.0000  1.0
  O  O3  4  0.2013  0.2118  0.8356  1.0
  O  O4  2  0.2514  0.0000  0.2983  1.0
  O  O5  2  0.2988  0.5000  0.3229  1.0
]