data_[Tl2Hg4Pb1Au2]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2933]
_cell_length_b [6.9506]
_cell_length_c [7.0616]
_cell_angle_alpha [117.9850]
_cell_angle_beta [94.5623]
_cell_angle_gamma [108.5902]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2Hg4PbAu2]
_chemical_formula_sum '[Tl2 Hg4 Pb1 Au2]'
_cell_volume [248.6652]
_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  0.2568  0.5253  0.8916  1.0
  Hg  Hg1  2  0.2248  0.0133  0.4294  1.0
  Hg  Hg2  2  0.2498  0.5223  0.3903  1.0
  Pb  Pb3  1  0.0000  0.0000  0.0000  1.0
  Au  Au4  2  0.3990  0.9726  0.7977  1.0
]