data_[Li6Tl6Cd6In3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.8935]
_cell_length_b [4.8935]
_cell_length_c [24.9289]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Li2Tl2Cd2In]
_chemical_formula_sum '[Li6 Tl6 Cd6 In3]'
_cell_volume [516.9791]
_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  6  0.0000  0.0000  0.1232  1.0
  Tl  Tl1  6  0.0000  0.0000  0.3690  1.0
  Cd  Cd2  6  0.0000  0.0000  0.2377  1.0
  In  In3  3  -0.0000  -0.0000  0.5000  1.0
]