data_[Pr10Cd2In4Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [12.2887]
_cell_length_b [12.2887]
_cell_length_c [3.8530]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Pr5Cd(InIr)2]
_chemical_formula_sum '[Pr10 Cd2 In4 Ir4]'
_cell_volume [581.8409]
_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
[
  Pr  Pr0  8  0.0730  0.2085  0.5000  1.0
  Pr  Pr1  2  0.0000  0.5000  0.5000  1.0
  Cd  Cd2  2  0.0000  0.0000  0.0000  1.0
  In  In3  4  0.1795  0.6795  0.0000  1.0
  Ir  Ir4  4  0.1324  0.3676  0.0000  1.0
]