data_[Ba6Bi3Pd18Au3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [7.1652]
_cell_length_b [7.1652]
_cell_length_c [16.3380]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Ba2BiPd6Au]
_chemical_formula_sum '[Ba6 Bi3 Pd18 Au3]'
_cell_volume [726.4107]
_cell_formula_units_Z [3]
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
[
  Ba  Ba0  6  0.0000  0.0000  0.3032  1.0
  Bi  Bi1  3  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  18  0.0413  0.2504  0.1330  1.0
  Au  Au3  3  -0.0000  0.0000  0.5000  1.0
]