data_[Ir4Os2Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ir  2.2000  1.3500  0.7650
  Os  2.2000  1.3000  0.6730
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8997]
_cell_length_b [4.4489]
_cell_length_c [8.1561]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.1390]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ir2OsRh6]
_chemical_formula_sum '[Ir4 Os2 Rh12]'
_cell_volume [269.1234]
_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
[
  Ir  Ir0  4  0.2021  0.5000  0.8998  1
  Os  Os1  2  0.0000  0.0000  0.5000  1
  Rh  Rh2  4  0.0030  0.0000  0.8232  1
  Rh  Rh3  4  0.1882  0.5000  0.5635  1
  Rh  Rh4  4  0.1894  0.5000  0.2306  1
]