data_[Tl2Bi10Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Bi  2.0200  1.6000  1.0350
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.9557]
_cell_length_b [12.9556]
_cell_length_c [7.4942]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.5038]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TlBi5Pb6]
_chemical_formula_sum '[Tl2 Bi10 Pb12]'
_cell_volume [845.4899]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.0000  1.0
  Bi  Bi1  4  0.0000  0.1250  0.5000  1.0
  Bi  Bi2  4  0.0000  0.2952  0.0000  1.0
  Bi  Bi3  2  0.0000  0.5000  0.5000  1.0
  Pb  Pb4  8  0.2153  0.3147  0.7067  1.0
  Pb  Pb5  4  0.1863  0.5000  0.1825  1.0
]