data_[Li2Cd4In6]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3470]
_cell_length_b [3.4747]
_cell_length_c [10.0409]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.3433]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiCd2In3]
_chemical_formula_sum '[Li2 Cd4 In6]'
_cell_volume [286.4856]
_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  2  0.1875  0.7500  0.2082  1.0
  Cd  Cd1  2  0.0959  0.7500  0.9105  1.0
  Cd  Cd2  2  0.4198  0.2500  0.3854  1.0
  In  In3  2  0.0563  0.2500  0.3941  1.0
  In  In4  2  0.2975  0.2500  0.7110  1.0
  In  In5  2  0.3881  0.2500  0.0688  1.0
]