data_[Y16Cd4Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Cd  1.6900  1.5500  1.0900
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8625]
_cell_length_b [12.9648]
_cell_length_c [6.1073]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2574]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y4CdIr]
_chemical_formula_sum '[Y16 Cd4 Ir4]'
_cell_volume [670.1407]
_cell_formula_units_Z [4]
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
[
  Y  Y0  8  0.1058  0.1724  0.5474  1.0
  Y  Y1  8  0.2173  0.4215  0.8892  1.0
  Cd  Cd2  4  0.0000  0.3764  0.2500  1.0
  Ir  Ir3  4  0.0000  0.0004  0.7500  1.0
]