data_[Ba12Na2Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Na  0.9300  1.8000  1.1600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9775]
_cell_length_b [6.2490]
_cell_length_c [10.8870]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.4988]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba6NaRh2]
_chemical_formula_sum '[Ba12 Na2 Rh4]'
_cell_volume [919.7112]
_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  4  0.0098  0.0000  0.1833  1.0
  Ba  Ba1  4  0.1774  0.5000  0.6179  1.0
  Ba  Ba2  4  0.1905  0.5000  0.0732  1.0
  Na  Na3  2  0.0000  0.0000  0.5000  1.0
  Rh  Rh4  4  0.1761  0.0000  0.0997  1.0
]