data_[La8Pr20Cd12]
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/c]
_cell_length_a [11.8771]
_cell_length_b [16.1347]
_cell_length_c [6.7656]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.0629]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La2Pr5Cd3]
_chemical_formula_sum '[La8 Pr20 Cd12]'
_cell_volume [1291.4669]
_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  8  0.1212  0.2577  0.0832  1.0
  Pr  Pr1  8  0.1287  0.1494  0.5888  1.0
  Pr  Pr2  8  0.2362  0.0479  0.0215  1.0
  Pr  Pr3  4  0.0000  0.4606  0.2500  1.0
  Cd  Cd4  8  0.1210  0.3524  0.6204  1.0
  Cd  Cd5  4  0.0000  0.0242  0.2500  1.0
]