data_[Tl4Cu8Pd4Cl24]
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
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.2725]
_cell_length_b [9.3008]
_cell_length_c [7.9300]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9066]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlCu2PdCl6]
_chemical_formula_sum '[Tl4 Cu8 Pd4 Cl24]'
_cell_volume [1050.6446]
_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  0.0969  0.7500  1.0
  Cu  Cu1  8  0.2467  0.1073  0.2907  1.0
  Pd  Pd2  4  0.0000  0.2682  0.2500  1.0
  Cl  Cl3  8  0.1086  0.2820  0.5781  1.0
  Cl  Cl4  8  0.1182  0.2617  0.1637  1.0
  Cl  Cl5  8  0.2285  0.0450  0.9931  1.0
]