data_[Ho5Hf1Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Hf  1.3000  1.5500  0.8500
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.5673]
_cell_length_b [3.5673]
_cell_length_c [20.5570]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Ho5HfCd4]
_chemical_formula_sum '[Ho5 Hf1 Cd4]'
_cell_volume [261.5953]
_cell_formula_units_Z [1]
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  2  0.5000  0.5000  0.1042  1.0
  Ho  Ho1  2  0.5000  0.5000  0.3059  1.0
  Ho  Ho2  1  0.5000  0.5000  0.5000  1.0
  Hf  Hf3  1  0.0000  0.0000  0.0000  1.0
  Cd  Cd4  2  0.0000  0.0000  0.2077  1.0
  Cd  Cd5  2  0.0000  0.0000  0.4030  1.0
]