data_[Li24Cd4Pd10]
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 [11.6831]
_cell_length_b [7.9071]
_cell_length_c [8.7738]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.9390]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li12Cd2Pd5]
_chemical_formula_sum '[Li24 Cd4 Pd10]'
_cell_volume [630.4342]
_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  8  0.0989  0.2038  0.3699  1.0
  Li  Li1  8  0.1971  0.1956  0.8027  1.0
  Li  Li2  4  0.1228  0.0000  0.9984  1.0
  Li  Li3  4  0.1439  0.5000  0.5754  1.0
  Cd  Cd4  4  0.0000  0.3023  0.0000  1.0
  Pd  Pd5  4  0.0918  0.5000  0.8277  1.0
  Pd  Pd6  4  0.2075  0.5000  0.3397  1.0
  Pd  Pd7  2  0.0000  0.0000  0.5000  1.0
]