data_[Ba16H4Rh2]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5073]
_cell_length_b [9.2746]
_cell_length_c [7.4347]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.6290]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba8H2Rh]
_chemical_formula_sum '[Ba16 H4 Rh2]'
_cell_volume [1068.8589]
_cell_formula_units_Z [2]
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  8  0.0923  0.2249  0.7705  1.0
  Ba  Ba1  4  0.1580  0.0000  0.2706  1.0
  Ba  Ba2  4  0.1638  0.5000  0.2770  1.0
  H  H3  4  0.1736  0.0000  0.6335  1.0
  Rh  Rh4  2  0.0000  0.0000  0.0000  1.0
]