data_[Ni4Ir14Rh4]
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 [C2/m]
_cell_length_a [9.3455]
_cell_length_b [7.7149]
_cell_length_c [4.6303]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.1853]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni2Ir7Rh2]
_chemical_formula_sum '[Ni4 Ir14 Rh4]'
_cell_volume [329.5635]
_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  4  0.2408  0.0000  0.2536  1
  Ir  Ir1  8  0.2339  0.1761  0.7447  1
  Ir  Ir2  4  0.0385  0.5000  0.2690  1
  Ir  Ir3  2  0.0000  0.0000  0.5000  1
  Rh  Rh4  4  0.0000  0.1808  0.0000  1
]