data_[Re4Bi4I4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Bi  2.0200  1.6000  1.0350
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4815]
_cell_length_b [7.2631]
_cell_length_c [7.4517]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3288]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ReBiIO4]
_chemical_formula_sum '[Re4 Bi4 I4 O16]'
_cell_volume [599.2951]
_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
[
  Re  Re0  4  0.1320  0.5000  0.2651  1
  Bi  Bi1  4  0.2197  0.0000  0.0896  1
  I  I2  4  0.0168  0.0000  0.7473  1
  O  O3  8  0.1918  0.3246  0.1309  1
  O  O4  4  0.0252  0.5000  0.7830  1
  O  O5  4  0.2074  0.5000  0.5016  1
]