data_[Ba6H36Rh9Pb3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.6432]
_cell_length_b [6.6432]
_cell_length_c [16.4806]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ba2H12Rh3Pb]
_chemical_formula_sum '[Ba6 H36 Rh9 Pb3]'
_cell_volume [629.8810]
_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  0.3915  1.0
  H  H1  18  0.0382  0.5191  0.3986  1.0
  H  H2  18  0.0615  0.5308  0.8278  1.0
  Rh  Rh3  9  0.0000  0.5000  0.5000  1.0
  Pb  Pb4  3  0.0000  0.0000  0.0000  1.0
]