data_[Hf4Al10Ir2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Al  1.6100  1.2500  0.6750
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.8145]
_cell_length_b [9.8145]
_cell_length_c [3.4544]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Hf2Al5IrPd2]
_chemical_formula_sum '[Hf4 Al10 Ir2 Pd4]'
_cell_volume [332.7432]
_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
[
  Hf  Hf0  4  0.1832  0.3168  0.0000  1
  Al  Al1  8  0.0473  0.8058  0.5000  1
  Al  Al2  2  0.0000  0.5000  0.5000  1
  Pd  Pd3  4  0.1220  0.6220  0.0000  1
  Ir  Ir4  2  0.0000  0.0000  0.0000  1
]