data_[Sm36Cd3Pd18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [14.4318]
_cell_length_b [14.4318]
_cell_length_c [9.1291]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Sm12CdPd6]
_chemical_formula_sum '[Sm36 Cd3 Pd18]'
_cell_volume [1646.6453]
_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
[
  Sm  Sm0  18  0.0397  0.2530  0.9284  1
  Sm  Sm1  18  0.0578  0.1780  0.3252  1
  Cd  Cd2  3  0.0000  0.0000  0.0000  1
  Pd  Pd3  18  0.0715  0.4986  0.2816  1
]