data_[In24Pb16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [11.4114]
_cell_length_b [30.5948]
_cell_length_c [3.3847]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [In3Pb2]
_chemical_formula_sum '[In24 Pb16]'
_cell_volume [1181.6958]
_cell_formula_units_Z [8]
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
[
  In  In0  16  0.0039  0.4024  0.0951  1.0
  In  In1  8  0.0000  0.0000  0.0881  1.0
  Pb  Pb2  16  0.0022  0.3025  0.6108  1.0
]