data_[Pr36Dy3Cd18]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [11.6488]
_cell_length_b [11.6488]
_cell_length_c [15.0420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Pr12DyCd6]
_chemical_formula_sum '[Pr36 Dy3 Cd18]'
_cell_volume [1767.6642]
_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  18  0.0411  0.8502  0.8049  1.0
  Pr  Pr1  18  0.0590  0.2181  0.4102  1.0
  Dy  Dy2  3  0.0000  0.0000  0.0000  1.0
  Cd  Cd3  18  0.0369  0.5918  0.7054  1.0
]