data_[Ba8Ga8Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7249]
_cell_length_b [4.4355]
_cell_length_c [11.8399]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.7399]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Ga2Rh]
_chemical_formula_sum '[Ba8 Ga8 Rh4]'
_cell_volume [591.4572]
_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  0.0070  0.0000  0.6602  1.0
  Ba  Ba1  4  0.1924  0.0000  0.1171  1.0
  Ga  Ga2  4  0.0006  0.5000  0.8757  1.0
  Ga  Ga3  4  0.2043  0.5000  0.5579  1.0
  Rh  Rh4  4  0.1998  0.5000  0.3372  1.0
]