data_[Tl6Hg2Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [5.6703]
_cell_length_b [16.4800]
_cell_length_c [3.9183]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Tl3HgPb2]
_chemical_formula_sum '[Tl6 Hg2 Pb4]'
_cell_volume [366.1562]
_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  4  0.0000  0.1567  0.0000  1.0
  Tl  Tl1  2  0.0000  0.5000  0.0000  1.0
  Hg  Hg2  2  0.0000  0.0000  0.5000  1.0
  Pb  Pb3  4  0.0000  0.3214  0.5000  1.0
]