data_[Tl4Sb2Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.6905]
_cell_length_b [5.3624]
_cell_length_c [7.2238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7430]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tl2SbPb]
_chemical_formula_sum '[Tl4 Sb2 Pb2]'
_cell_volume [253.7476]
_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  0.0970  0.7500  0.8512  1.0
  Tl  Tl1  2  0.3963  0.2500  0.1214  1.0
  Sb  Sb2  2  0.2022  0.7500  0.3442  1.0
  Pb  Pb3  2  0.2959  0.2500  0.6081  1.0
]