data_[Pr24Nd12Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [10.6314]
_cell_length_b [20.2399]
_cell_length_c [6.4639]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pr6Nd3Cd]
_chemical_formula_sum '[Pr24 Nd12 Cd4]'
_cell_volume [1390.8933]
_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
[
  Pr  Pr0  8  0.1737  0.4650  0.9404  1.0
  Pr  Pr1  8  0.2314  0.1959  0.6227  1.0
  Pr  Pr2  4  0.0000  0.0544  0.6146  1.0
  Pr  Pr3  4  0.0000  0.2954  0.8398  1.0
  Nd  Nd4  8  0.1688  0.1261  0.0963  1.0
  Nd  Nd5  4  0.0000  0.3924  0.4089  1.0
  Cd  Cd6  4  0.0000  0.2382  0.3325  1.0
]