data_[Pr3Dy24Sc12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.1121]
_cell_length_b [7.1121]
_cell_length_c [26.6278]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Pr(Dy2Sc)4]
_chemical_formula_sum '[Pr3 Dy24 Sc12]'
_cell_volume [1166.4406]
_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
[
  Pr  Pr0  3  -0.0000  -0.0000  0.5000  1
  Dy  Dy1  18  0.0326  0.5163  0.7636  1
  Dy  Dy2  6  0.0000  0.0000  0.2188  1
  Sc  Sc3  9  0.0000  0.5000  0.0000  1
  Sc  Sc4  3  0.0000  0.0000  0.0000  1
]