data_[Fe6Ir2Rh10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [5.7957]
_cell_length_b [5.7957]
_cell_length_c [7.5921]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Fe3IrRh5]
_chemical_formula_sum '[Fe6 Ir2 Rh10]'
_cell_volume [255.0169]
_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
[
  Fe  Fe0  4  0.1167  0.3833  0.5000  1
  Fe  Fe1  2  0.0000  0.0000  0.0000  1
  Ir  Ir2  2  0.0000  0.5000  0.0000  1
  Rh  Rh3  8  0.2428  0.7428  0.2242  1
  Rh  Rh4  2  0.0000  0.0000  0.5000  1
]