data_[Ba1Bi4Rh6]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [7.8865]
_cell_length_b [7.8865]
_cell_length_c [4.3023]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Ba(Bi2Rh3)2]
_chemical_formula_sum '[Ba1 Bi4 Rh6]'
_cell_volume [231.7360]
_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  1  0.0000  0.0000  0.0000  1.0
  Bi  Bi1  3  0.3849  0.1924  0.5000  1.0
  Bi  Bi2  1  0.3333  0.6667  0.0000  1.0
  Rh  Rh3  3  0.2063  0.4127  0.5000  1.0
  Rh  Rh4  3  0.5379  0.4621  0.0000  1.0
]