data_[K4Li2Cd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8963]
_cell_length_b [6.4902]
_cell_length_c [6.3172]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5978]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K2LiCd3]
_chemical_formula_sum '[K4 Li2 Cd6]'
_cell_volume [367.7412]
_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
[
  K  K0  4  0.1236  0.5000  0.8708  1
  Li  Li1  2  0.0000  0.0000  0.0000  1
  Cd  Cd2  4  0.2500  0.2500  0.5000  1
  Cd  Cd3  2  0.0000  0.0000  0.5000  1
]