data_[Bi4Pd4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.9240]
_cell_length_b [4.8704]
_cell_length_c [10.3367]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4098]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Bi2Pd2Pb]
_chemical_formula_sum '[Bi4 Pd4 Pb2]'
_cell_volume [247.8876]
_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
[
  Bi  Bi0  2  0.2508  0.7500  0.9944  1
  Bi  Bi1  2  0.2511  0.7500  0.6648  1
  Pd  Pd2  2  0.2518  0.2500  0.1559  1
  Pd  Pd3  2  0.2603  0.2500  0.5097  1
  Pb  Pb4  2  0.2421  0.7500  0.3267  1
]