data_[Ho20In12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [12.1377]
_cell_length_b [12.1377]
_cell_length_c [6.1252]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Ho5In3]
_chemical_formula_sum '[Ho20 In12]'
_cell_volume [902.3810]
_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  16  0.0809  0.2187  0.5000  1.0
  Ho  Ho1  4  0.0000  0.5000  0.2500  1.0
  In  In2  8  0.1626  0.3374  0.0000  1.0
  In  In3  4  0.0000  0.0000  0.2500  1.0
]