data_[In2Bi2Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [P2_1/m]
_cell_length_a [6.5015]
_cell_length_b [6.7501]
_cell_length_c [9.0743]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.1113]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [InBiPb4]
_chemical_formula_sum '[In2 Bi2 Pb8]'
_cell_volume [384.4590]
_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
[
  In  In0  2  0.3880  0.7500  0.6512  1.0
  Bi  Bi1  2  0.2573  0.2500  0.0017  1.0
  Pb  Pb2  4  0.0947  0.0002  0.3211  1.0
  Pb  Pb3  2  0.2459  0.7500  0.9996  1.0
  Pb  Pb4  2  0.3877  0.2500  0.6408  1.0
]