data_[Tl2In2Hg1Pb4]
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 [P-1]
_cell_length_a [5.8946]
_cell_length_b [6.0431]
_cell_length_c [8.1038]
_cell_angle_alpha [81.2920]
_cell_angle_beta [73.1747]
_cell_angle_gamma [78.6506]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2In2HgPb4]
_chemical_formula_sum '[Tl2 In2 Hg1 Pb4]'
_cell_volume [269.5339]
_cell_formula_units_Z [1]
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  0.1081  0.2196  0.5620  1.0
  In  In1  2  0.2186  0.4443  0.1075  1.0
  Hg  Hg2  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb3  2  0.3339  0.6595  0.6791  1.0
  Pb  Pb4  2  0.4498  0.8915  0.2141  1.0
]