data_[Ba3Bi4Pd2Rh2]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.6991]
_cell_length_b [4.6991]
_cell_length_c [17.8232]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ba3Bi4(PdRh)2]
_chemical_formula_sum '[Ba3 Bi4 Pd2 Rh2]'
_cell_volume [340.8411]
_cell_formula_units_Z [1]
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  2  0.0000  0.0000  0.2767  1
  Ba  Ba1  1  0.0000  0.0000  0.0000  1
  Bi  Bi2  2  0.3333  0.6667  0.4128  1
  Bi  Bi3  2  0.3333  0.6667  0.8603  1
  Pd  Pd4  2  0.3333  0.6667  0.1417  1
  Rh  Rh5  2  0.3333  0.6667  0.5608  1
]