data_[Pr4Bi12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pbcm]
_cell_length_a [13.3941]
_cell_length_b [6.6163]
_cell_length_c [6.3761]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [57]
_chemical_formula_structural [PrBi3Pd]
_chemical_formula_sum '[Pr4 Bi12 Pd4]'
_cell_volume [565.0475]
_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
[
  Pr  Pr0  4  0.3022  0.0078  0.7500  1.0
  Bi  Bi1  4  0.0540  0.6052  0.2500  1.0
  Bi  Bi2  4  0.2364  0.5103  0.7500  1.0
  Bi  Bi3  4  0.4993  0.2500  0.0000  1.0
  Pd  Pd4  4  0.1078  0.2500  0.0000  1.0
]