data_[Tl2In12Sn2Pb4]
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
  Sn  1.9600  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.8201]
_cell_length_b [9.5034]
_cell_length_c [11.1748]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.4494]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TlIn6SnPb2]
_chemical_formula_sum '[Tl2 In12 Sn2 Pb4]'
_cell_volume [602.9169]
_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  0.5000  0.0000  0.0000  1
  In  In1  4  0.0723  0.6446  0.4644  1
  In  In2  4  0.2138  0.2064  0.4250  1
  In  In3  4  0.4953  0.1450  0.2698  1
  Sn  Sn4  2  0.0000  0.0000  0.5000  1
  Pb  Pb5  4  0.2430  0.6127  0.8357  1
]