data_[Bi8Pd8]
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
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [5.4793]
_cell_length_b [7.1736]
_cell_length_c [9.4905]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [BiPd]
_chemical_formula_sum '[Bi8 Pd8]'
_cell_volume [373.0392]
_cell_formula_units_Z [8]
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  0.1147  0.3127  0.8360  1
  Bi  Bi1  4  0.1961  0.1217  0.4376  1
  Pd  Pd2  4  0.0342  0.9312  0.1956  1
  Pd  Pd3  4  0.1952  0.5005  0.5762  1
]