data_[Li8Pr6Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [11.4061]
_cell_length_b [5.0174]
_cell_length_c [8.1834]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.8841]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li4Pr3Cd2]
_chemical_formula_sum '[Li8 Pr6 Cd4]'
_cell_volume [454.6431]
_cell_formula_units_Z [2]
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
[
  Li  Li0  4  0.1329  0.0000  0.5979  1.0
  Li  Li1  4  0.2146  0.5000  0.0541  1.0
  Pr  Pr2  4  0.0471  0.5000  0.3228  1.0
  Pr  Pr3  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd4  4  0.2500  0.5000  0.7060  1.0
]