data_[Tl1Cu2Pb1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cu  1.9000  1.3500  0.8200
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1323]
_cell_length_b [6.2308]
_cell_length_c [8.6084]
_cell_angle_alpha [82.2977]
_cell_angle_beta [81.9785]
_cell_angle_gamma [85.6512]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlCu2PbCl8]
_chemical_formula_sum '[Tl1 Cu2 Pb1 Cl8]'
_cell_volume [322.2153]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1
  Cu  Cu1  2  0.4769  0.4807  0.7273  1
  Pb  Pb2  1  0.0000  0.0000  0.5000  1
  Cl  Cl3  2  0.2365  0.7941  0.2356  1
  Cl  Cl4  2  0.2481  0.8021  0.7551  1
  Cl  Cl5  2  0.2713  0.3176  0.9505  1
  Cl  Cl6  2  0.3042  0.3416  0.4833  1
]