data_[Pr10Cd2Te16]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.5863]
_cell_length_b [9.5863]
_cell_length_c [9.7060]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Pr5CdTe8]
_chemical_formula_sum '[Pr10 Cd2 Te16]'
_cell_volume [891.9506]
_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  8  0.1284  0.2485  0.8814  1.0
  Pr  Pr1  2  0.0000  0.0000  0.5000  1.0
  Cd  Cd2  2  0.0000  0.5000  0.2500  1.0
  Te  Te3  8  0.0715  0.1770  0.2058  1.0
  Te  Te4  8  0.0786  0.3216  0.5618  1.0
]