data_[Dy8Th16Sc12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Th  1.3000  1.8000  1.0800
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.7018]
_cell_length_b [11.4463]
_cell_length_c [5.9662]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9003]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Dy2Th4Sc3]
_chemical_formula_sum '[Dy8 Th16 Sc12]'
_cell_volume [1062.1070]
_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  8  0.2220  0.3670  0.3463  1
  Th  Th1  8  0.0546  0.1320  0.5186  1
  Th  Th2  8  0.1101  0.3683  0.8098  1
  Sc  Sc3  8  0.1648  0.1150  0.0788  1
  Sc  Sc4  4  0.0000  0.3861  0.2500  1
]