data_[Tl2In2Sn2Pb6]
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/m]
_cell_length_a [7.6159]
_cell_length_b [4.9493]
_cell_length_c [10.3040]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.5917]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [TlInSnPb3]
_chemical_formula_sum '[Tl2 In2 Sn2 Pb6]'
_cell_volume [363.5770]
_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  0.1696  0.7500  0.2939  1.0
  In  In1  2  0.4972  0.2500  0.8761  1.0
  Sn  Sn2  2  0.4994  0.2500  0.3726  1.0
  Pb  Pb3  2  0.1743  0.7500  0.7946  1.0
  Pb  Pb4  2  0.1758  0.2500  0.0447  1.0
  Pb  Pb5  2  0.1821  0.2500  0.5461  1.0
]