data_[Tl2In2Bi1Pb6]
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
  Bi  2.0200  1.6000  1.0350
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.0764]
_cell_length_b [7.8268]
_cell_length_c [7.8494]
_cell_angle_alpha [108.4943]
_cell_angle_beta [95.4223]
_cell_angle_gamma [103.0848]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2In2BiPb6]
_chemical_formula_sum '[Tl2 In2 Bi1 Pb6]'
_cell_volume [339.2020]
_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  0.0429  0.6894  0.9124  1
  In  In1  2  0.1359  0.0482  0.7309  1
  Bi  Bi2  1  0.5000  0.5000  0.0000  1
  Pb  Pb3  2  0.2260  0.4090  0.5566  1
  Pb  Pb4  2  0.3181  0.7803  0.3710  1
  Pb  Pb5  2  0.4084  0.1377  0.1856  1
]