data_[La12Pr20Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.6800]
_cell_length_b [8.3792]
_cell_length_c [14.9587]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.4417]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Pr5Cd]
_chemical_formula_sum '[La12 Pr20 Cd4]'
_cell_volume [1337.4284]
_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
[
  La  La0  4  0.1416  0.5000  0.4999  1
  La  La1  4  0.2015  0.0000  0.8650  1
  La  La2  2  0.0000  0.0000  0.0000  1
  La  La3  2  0.0000  0.0000  0.5000  1
  Pr  Pr4  8  0.2350  0.2369  0.6637  1
  Pr  Pr5  4  0.0000  0.3277  0.0000  1
  Pr  Pr6  4  0.0092  0.5000  0.2416  1
  Pr  Pr7  4  0.2237  0.0000  0.1370  1
  Cd  Cd8  4  0.0223  0.0000  0.2870  1
]