data_[Cd4Cu4Sn4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.4120]
_cell_length_b [11.3770]
_cell_length_c [9.4248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.2453]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CdCuSnCl5]
_chemical_formula_sum '[Cd4 Cu4 Sn4 Cl20]'
_cell_volume [834.8513]
_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
[
  Cd  Cd0  4  0.0000  0.0000  0.0000  1.0
  Cu  Cu1  4  0.0000  0.3150  0.7500  1.0
  Sn  Sn2  4  0.0000  0.3678  0.2500  1.0
  Cl  Cl3  8  0.1407  0.1957  0.6392  1.0
  Cl  Cl4  8  0.1647  0.4410  0.9460  1.0
  Cl  Cl5  4  0.0000  0.1047  0.2500  1.0
]