data_[Tl4Zn4Pb4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2578]
_cell_length_b [12.3226]
_cell_length_c [10.2015]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.1944]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlZnPbCl5]
_chemical_formula_sum '[Tl4 Zn4 Pb4 Cl20]'
_cell_volume [1061.5657]
_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
[
  Tl  Tl0  4  0.0000  0.3490  0.7500  1.0
  Zn  Zn1  4  0.0000  0.3155  0.2500  1.0
  Pb  Pb2  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.1237  0.2113  0.1392  1.0
  Cl  Cl4  8  0.1702  0.4271  0.4288  1.0
  Cl  Cl5  4  0.0000  0.0984  0.7500  1.0
]