data_[Pr16Cd4Pt2]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.8622]
_cell_length_b [5.3511]
_cell_length_c [7.0653]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.2876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr8Cd2Pt]
_chemical_formula_sum '[Pr16 Cd4 Pt2]'
_cell_volume [696.7909]
_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  0.0199  0.0000  0.7766  1.0
  Pr  Pr1  4  0.0907  0.5000  0.4407  1.0
  Pr  Pr2  4  0.1520  0.5000  0.9604  1.0
  Pr  Pr3  4  0.2036  0.0000  0.3018  1.0
  Cd  Cd4  4  0.1893  0.0000  0.7374  1.0
  Pt  Pt5  2  0.0000  0.5000  0.0000  1.0
]