data_[Li8Cd4Pd6]
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 [C2/m]
_cell_length_a [12.1970]
_cell_length_b [4.0459]
_cell_length_c [6.2259]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0517]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li4Cd2Pd3]
_chemical_formula_sum '[Li8 Cd4 Pd6]'
_cell_volume [288.6106]
_cell_formula_units_Z [2]
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  0.0501  0.5000  0.3412  1.0
  Li  Li1  4  0.2230  0.0000  0.3386  1.0
  Cd  Cd2  4  0.1606  0.5000  0.0040  1.0
  Pd  Pd3  4  0.1122  0.0000  0.6581  1.0
  Pd  Pd4  2  0.0000  0.0000  0.0000  1.0
]