data_[In12Bi4Pb2]
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 [Amm2]
_cell_length_a [3.3374]
_cell_length_b [16.9358]
_cell_length_c [9.4367]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [In6Bi2Pb]
_chemical_formula_sum '[In12 Bi4 Pb2]'
_cell_volume [533.3783]
_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  4  0.0000  0.1556  0.8491  1.0
  In  In1  4  0.5000  0.1770  0.1770  1.0
  In  In2  2  0.0000  0.0000  0.3114  1.0
  In  In3  2  0.5000  0.0000  0.6354  1.0
  Bi  Bi4  4  0.0000  0.1676  0.5033  1.0
  Pb  Pb5  2  0.5000  0.0000  0.9945  1.0
]