data_[Li8Cd20Pd8]
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 [Cc]
_cell_length_a [17.9098]
_cell_length_b [5.1097]
_cell_length_c [7.5633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4219]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Li2Cd5Pd2]
_chemical_formula_sum '[Li8 Cd20 Pd8]'
_cell_volume [660.3894]
_cell_formula_units_Z [4]
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  4  0.2550  0.3377  0.8716  1.0
  Li  Li1  4  0.4634  0.3318  0.4205  1.0
  Cd  Cd2  4  0.0232  0.3205  0.3069  1.0
  Cd  Cd3  4  0.0895  0.1648  0.7066  1.0
  Cd  Cd4  4  0.1464  0.3357  0.0925  1.0
  Cd  Cd5  4  0.3047  0.1689  0.2673  1.0
  Cd  Cd6  4  0.4131  0.1957  0.0401  1.0
  Pd  Pd7  4  0.1939  0.1702  0.4795  1.0
  Pd  Pd8  4  0.3609  0.3173  0.6512  1.0
]