data_[Cr4Ir6Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6081]
_cell_length_b [2.7007]
_cell_length_c [6.5878]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.5020]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cr2Ir3Rh2]
_chemical_formula_sum '[Cr4 Ir6 Rh4]'
_cell_volume [192.1498]
_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
[
  Cr  Cr0  4  0.0720  0.5000  0.7176  1.0
  Ir  Ir1  4  0.2187  0.5000  0.1439  1.0
  Ir  Ir2  2  0.0000  0.0000  0.0000  1.0
  Rh  Rh3  4  0.1307  0.0000  0.4319  1.0
]