data_[Dy3Hf9Al24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Hf  1.3000  1.5500  0.8500
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.3444]
_cell_length_b [5.3444]
_cell_length_c [26.2641]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [DyHf3Al8]
_chemical_formula_sum '[Dy3 Hf9 Al24]'
_cell_volume [649.6683]
_cell_formula_units_Z [3]
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
[
  Dy  Dy0  3  0.0000  0.0000  0.8750  1.0
  Hf  Hf1  3  0.0000  0.0000  0.0014  1.0
  Hf  Hf2  3  0.0000  0.0000  0.3757  1.0
  Hf  Hf3  3  0.0000  0.0000  0.4972  1.0
  Al  Al4  9  0.0008  0.5004  0.9393  1.0
  Al  Al5  9  0.1675  0.3350  0.7694  1.0
  Al  Al6  3  0.0000  0.0000  0.1870  1.0
  Al  Al7  3  0.0000  0.0000  0.6878  1.0
]