data_[Ho16Ir4Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.3560]
_cell_length_b [4.8559]
_cell_length_c [6.8758]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.8491]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho8Ir2Pd]
_chemical_formula_sum '[Ho16 Ir4 Pd2]'
_cell_volume [554.6106]
_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
[
  Ho  Ho0  4  0.0322  0.0000  0.7819  1.0
  Ho  Ho1  4  0.0965  0.5000  0.4645  1.0
  Ho  Ho2  4  0.1696  0.5000  0.9649  1.0
  Ho  Ho3  4  0.2041  0.0000  0.3148  1.0
  Ir  Ir4  4  0.1875  0.0000  0.7085  1.0
  Pd  Pd5  2  0.0000  0.5000  0.0000  1.0
]