data_[Tl2In4Hg12Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.7755]
_cell_length_b [8.6826]
_cell_length_c [11.4469]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.6938]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TlIn2Hg6Pb]
_chemical_formula_sum '[Tl2 In4 Hg12 Pb2]'
_cell_volume [577.0595]
_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  0.5000  1.0
  In  In1  4  0.3993  0.1691  0.2532  1.0
  Hg  Hg2  4  0.0047  0.1749  0.7700  1.0
  Hg  Hg3  4  0.1405  0.6468  0.5274  1.0
  Hg  Hg4  4  0.4781  0.1419  0.5687  1.0
  Pb  Pb5  2  0.5000  0.0000  0.0000  1.0
]