data_[Ba4Sb8Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sb  2.0500  1.4500  0.8300
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.6697]
_cell_length_b [4.2722]
_cell_length_c [8.3941]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6437]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaSb2Rh3]
_chemical_formula_sum '[Ba4 Sb8 Rh12]'
_cell_volume [547.6121]
_cell_formula_units_Z [4]
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  0.1511  0.0000  0.0632  1.0
  Sb  Sb1  4  0.0272  0.5000  0.2074  1.0
  Sb  Sb2  4  0.1861  0.0000  0.6634  1.0
  Rh  Rh3  4  0.0413  0.0000  0.3869  1.0
  Rh  Rh4  4  0.0834  0.5000  0.6463  1.0
  Rh  Rh5  4  0.1859  0.5000  0.4497  1.0
]