data_[Dy4Sc24Al12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.4185]
_cell_length_b [11.6033]
_cell_length_c [7.0222]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Dy(Sc2Al)3]
_chemical_formula_sum '[Dy4 Sc24 Al12]'
_cell_volume [930.3882]
_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
[
  Dy  Dy0  4  0.0000  0.2803  0.1183  1
  Sc  Sc1  8  0.2056  0.4689  0.6220  1
  Sc  Sc2  8  0.2081  0.1991  0.8092  1
  Sc  Sc3  4  0.0000  0.0210  0.7074  1
  Sc  Sc4  4  0.0000  0.2949  0.5877  1
  Al  Al5  8  0.1444  0.1208  0.4261  1
  Al  Al6  4  0.0000  0.4932  0.8576  1
]