data_[Tl4Pd8Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.8673]
_cell_length_b [4.4924]
_cell_length_c [11.2314]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.9058]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TlPd2Pb3]
_chemical_formula_sum '[Tl4 Pd8 Pb12]'
_cell_volume [607.6048]
_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  0.1474  0.0000  0.7378  1
  Pd  Pd1  4  0.2207  0.0000  0.0513  1
  Pd  Pd2  4  0.2231  0.0000  0.5554  1
  Pb  Pb3  4  0.0749  0.5000  0.9309  1
  Pb  Pb4  4  0.0758  0.5000  0.4314  1
  Pb  Pb5  4  0.1489  0.0000  0.2411  1
]