data_[K6Cd4In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2923]
_cell_length_b [5.1123]
_cell_length_c [10.3370]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.5513]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K3(CdIn2)2]
_chemical_formula_sum '[K6 Cd4 In8]'
_cell_volume [657.7456]
_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  0.1225  0.5000  0.3716  1.0
  K  K1  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd2  4  0.1843  0.5000  0.7614  1.0
  In  In3  4  0.0879  0.0000  0.6293  1.0
  In  In4  4  0.2170  0.5000  0.0755  1.0
]