data_[Ba4As8Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  As  2.1800  1.1500  0.6600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.1996]
_cell_length_b [7.0150]
_cell_length_c [7.8630]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.6981]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ba(AsRh)2]
_chemical_formula_sum '[Ba4 As8 Rh8]'
_cell_volume [454.0130]
_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  0.0000  0.1154  0.7500  1
  As  As1  8  0.1841  0.3558  0.5885  1
  Rh  Rh2  8  0.1114  0.3941  0.2125  1
]