data_[Li18Cd36Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [10.6722]
_cell_length_b [10.6722]
_cell_length_c [12.3121]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Li3Cd6Pd]
_chemical_formula_sum '[Li18 Cd36 Pd6]'
_cell_volume [1214.4256]
_cell_formula_units_Z [6]
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
[
  Li  Li0  18  0.0397  0.5865  0.7072  1.0
  Cd  Cd1  18  0.0435  0.8583  0.8151  1.0
  Cd  Cd2  18  0.0589  0.2557  0.4140  1.0
  Pd  Pd3  3  0.0000  0.0000  0.0000  1.0
  Pd  Pd4  3  0.0000  0.0000  0.5000  1.0
]