data_[Li9Cd6Pd9]
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 [R3m]
_cell_length_a [4.4900]
_cell_length_b [4.4900]
_cell_length_c [22.2060]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Li3Cd2Pd3]
_chemical_formula_sum '[Li9 Cd6 Pd9]'
_cell_volume [387.7024]
_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
[
  Li  Li0  3  0.0000  0.0000  0.2462  1
  Li  Li1  3  0.0000  0.0000  0.6259  1
  Li  Li2  3  0.0000  0.0000  0.7536  1
  Cd  Cd3  3  0.0000  0.0000  0.5009  1
  Cd  Cd4  3  0.0000  0.0000  0.9991  1
  Pd  Pd5  3  0.0000  0.0000  0.1231  1
  Pd  Pd6  3  0.0000  0.0000  0.3760  1
  Pd  Pd7  3  0.0000  0.0000  0.8753  1
]