data_[Y24Ho4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.4012]
_cell_length_b [13.2755]
_cell_length_c [7.2472]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Y6HoPd3]
_chemical_formula_sum '[Y24 Ho4 Pd12]'
_cell_volume [1096.8979]
_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  0.1685  0.4611  0.6691  1
  Y  Y1  8  0.2270  0.1936  0.8232  1
  Y  Y2  4  0.0000  0.0360  0.1567  1
  Y  Y3  4  0.0000  0.2293  0.5183  1
  Ho  Ho4  4  0.0000  0.3198  0.0416  1
  Pd  Pd5  8  0.1894  0.1014  0.4552  1
  Pd  Pd6  4  0.0000  0.4217  0.3737  1
]