data_[Ce6Al9Pd3Pt36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Al  1.6100  1.2500  0.6750
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.2381]
_cell_length_b [8.2381]
_cell_length_c [18.1364]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ce2Al3PdPt12]
_chemical_formula_sum '[Ce6 Al9 Pd3 Pt36]'
_cell_volume [1065.9590]
_cell_formula_units_Z [3]
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
[
  Ce  Ce0  6  0.0000  0.0000  0.3850  1
  Al  Al1  9  0.0000  0.5000  0.5000  1
  Pd  Pd2  3  0.0000  0.0000  0.0000  1
  Pt  Pt3  18  0.0095  0.5048  0.8775  1
  Pt  Pt4  18  0.0226  0.5113  0.3658  1
]