data_[Bi4Pd20Pb4]
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 [C2/c]
_cell_length_a [7.2346]
_cell_length_b [7.8877]
_cell_length_c [9.7079]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.5812]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [BiPd5Pb]
_chemical_formula_sum '[Bi4 Pd20 Pb4]'
_cell_volume [518.6134]
_cell_formula_units_Z [4]
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  4  0.0000  0.0000  0.0000  1.0
  Pd  Pd1  8  0.1111  0.3435  0.0375  1.0
  Pd  Pd2  8  0.2057  0.1835  0.3459  1.0
  Pd  Pd3  4  0.0000  0.1518  0.7500  1.0
  Pb  Pb4  4  0.0000  0.4994  0.7500  1.0
]