data_[Ni6Ir2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.4371]
_cell_length_b [5.2783]
_cell_length_c [5.7331]
_cell_angle_alpha [76.6772]
_cell_angle_beta [75.6326]
_cell_angle_gamma [72.8062]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ni3IrRh]
_chemical_formula_sum '[Ni6 Ir2 Rh2]'
_cell_volume [122.4562]
_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
[
  Ni  Ni0  2  0.0032  0.7461  0.4973  1.0
  Ni  Ni1  2  0.1938  0.5517  0.0995  1.0
  Ni  Ni2  2  0.1996  0.0496  0.1002  1.0
  Ir  Ir3  2  0.3987  0.3494  0.7051  1.0
  Rh  Rh4  2  0.3967  0.8498  0.7035  1.0
]