data_[Cd18Ag3Pd36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [11.1467]
_cell_length_b [11.1467]
_cell_length_c [9.2873]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Cd6AgPd12]
_chemical_formula_sum '[Cd18 Ag3 Pd36]'
_cell_volume [999.3353]
_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
[
  Cd  Cd0  18  0.0886  0.1772  0.7466  1
  Ag  Ag1  3  0.0000  0.0000  0.0000  1
  Pd  Pd2  18  0.0000  0.2604  0.0000  1
  Pd  Pd3  18  0.0665  0.5333  0.1204  1
]