data_[Y24Ho2Sc12]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Im-3]
_cell_length_a [10.4884]
_cell_length_b [10.4884]
_cell_length_c [10.4884]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [204]
_chemical_formula_structural [Y12HoSc6]
_chemical_formula_sum '[Y24 Ho2 Sc12]'
_cell_volume [1153.8074]
_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
[
  Y  Y0  24  0.0000  0.1947  0.2684  1
  Ho  Ho1  2  0.0000  0.0000  0.0000  1
  Sc  Sc2  12  0.0000  0.3627  0.5000  1
]