data_[Ba16H2Rh4]
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 [14.9555]
_cell_length_b [9.2043]
_cell_length_c [7.5596]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.3469]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba8HRh2]
_chemical_formula_sum '[Ba16 H2 Rh4]'
_cell_volume [1039.7430]
_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  0.1340  0.2372  0.8297  1.0
  Ba  Ba1  4  0.1227  0.5000  0.3100  1.0
  Ba  Ba2  4  0.1251  0.0000  0.2879  1.0
  H  H3  2  0.0000  0.0000  0.0000  1.0
  Rh  Rh4  4  0.2381  0.5000  0.0018  1.0
]