data_[Ho4Pd12Au24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [7.8593]
_cell_length_b [17.6606]
_cell_length_c [5.3436]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ho(PdAu2)3]
_chemical_formula_sum '[Ho4 Pd12 Au24]'
_cell_volume [741.6854]
_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
[
  Ho  Ho0  4  0.0000  0.1538  0.4939  1.0
  Pd  Pd1  8  0.1790  0.8803  0.4960  1.0
  Pd  Pd2  4  0.0000  0.3963  0.7021  1.0
  Au  Au3  8  0.1822  0.5352  0.5743  1.0
  Au  Au4  8  0.1896  0.2673  0.8191  1.0
  Au  Au5  4  0.0000  0.0035  0.2701  1.0
  Au  Au6  4  0.0000  0.3264  0.2403  1.0
]