data_[Cd2Re4Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Re  1.9000  1.3500  0.7125
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.4122]
_cell_length_b [2.9633]
_cell_length_c [8.7656]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.8159]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CdRe2Cl]
_chemical_formula_sum '[Cd2 Re4 Cl2]'
_cell_volume [161.0217]
_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
[
  Cd  Cd0  2  0.0105  0.5000  0.5217  1
  Re  Re1  2  0.0542  0.0000  0.9741  1
  Re  Re2  2  0.2554  0.0000  0.7932  1
  Cl  Cl3  2  0.1798  0.5000  0.2111  1
]