data_[Pr12Ho20In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [12.9314]
_cell_length_b [15.6452]
_cell_length_c [6.4507]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Pr3Ho5In2]
_chemical_formula_sum '[Pr12 Ho20 In8]'
_cell_volume [1305.0787]
_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
[
  Pr  Pr0  8  0.1176  0.2397  0.0000  1
  Pr  Pr1  4  0.0000  0.0000  0.2500  1
  Ho  Ho2  8  0.1224  0.3372  0.5000  1
  Ho  Ho3  8  0.2459  0.5000  0.2500  1
  Ho  Ho4  4  0.0000  0.5000  0.2500  1
  In  In5  8  0.1392  0.1472  0.5000  1
]