data_[Pr20Al4In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.3386]
_cell_length_b [8.3386]
_cell_length_c [14.5916]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Pr5AlIn2]
_chemical_formula_sum '[Pr20 Al4 In8]'
_cell_volume [1014.5872]
_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  16  0.1724  0.3276  0.6543  1.0
  Pr  Pr1  4  0.0000  0.0000  0.0000  1.0
  Al  Al2  4  0.0000  0.0000  0.2500  1.0
  In  In3  8  0.1237  0.3763  0.0000  1.0
]