data_[Pr6Cd8In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4519]
_cell_length_b [5.0471]
_cell_length_c [9.4994]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.1391]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3(Cd2In)2]
_chemical_formula_sum '[Pr6 Cd8 In4]'
_cell_volume [488.6031]
_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
[
  Pr  Pr0  4  0.1656  0.5000  0.6709  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd2  4  0.0748  0.0000  0.4101  1.0
  Cd  Cd3  4  0.2063  0.5000  0.0368  1.0
  In  In4  4  0.1101  0.5000  0.2757  1.0
]