data_[Y4Cd4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Cd  1.6900  1.5500  1.0900
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.2713]
_cell_length_b [8.5305]
_cell_length_c [9.3137]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.0365]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [YCdCl5]
_chemical_formula_sum '[Y4 Cd4 Cl20]'
_cell_volume [824.0902]
_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
[
  Y  Y0  4  0.0000  0.4502  0.2500  1.0
  Cd  Cd1  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  8  0.0177  0.3195  0.9607  1.0
  Cl  Cl3  8  0.2497  0.4532  0.3606  1.0
  Cl  Cl4  4  0.0000  0.1259  0.2500  1.0
]