data_[Li12Cd12Sn8]
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
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.7066]
_cell_length_b [10.2480]
_cell_length_c [14.8125]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Li3Cd3Sn2]
_chemical_formula_sum '[Li12 Cd12 Sn8]'
_cell_volume [714.4521]
_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  8  0.0000  0.0905  0.5795  1.0
  Li  Li1  4  0.0000  0.2597  0.7500  1.0
  Cd  Cd2  8  0.0000  0.3959  0.5621  1.0
  Cd  Cd3  4  0.0000  0.4716  0.2500  1.0
  Sn  Sn4  8  0.0000  0.2316  0.1337  1.0
]