data_[Pr12Cd4Te24]
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 [Cmc2_1]
_cell_length_a [12.4810]
_cell_length_b [14.7937]
_cell_length_c [7.7214]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pr3CdTe6]
_chemical_formula_sum '[Pr12 Cd4 Te24]'
_cell_volume [1425.6773]
_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
[
  Pr  Pr0  8  0.1778  0.0954  0.4869  1
  Pr  Pr1  4  0.0000  0.4017  0.3766  1
  Cd  Cd2  4  0.0000  0.2120  0.0131  1
  Te  Te3  8  0.1631  0.4591  0.6810  1
  Te  Te4  8  0.1803  0.2706  0.2143  1
  Te  Te5  4  0.0000  0.0361  0.1821  1
  Te  Te6  4  0.0000  0.2284  0.6490  1
]