data_[K2Cd4In4]
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 [P-1]
_cell_length_a [7.2338]
_cell_length_b [7.2798]
_cell_length_c [7.9609]
_cell_angle_alpha [74.3946]
_cell_angle_beta [65.2976]
_cell_angle_gamma [63.1020]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [K(CdIn)2]
_chemical_formula_sum '[K2 Cd4 In4]'
_cell_volume [338.0005]
_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  2  0.1173  0.2338  0.7604  1.0
  Cd  Cd1  2  0.1689  0.1758  0.2904  1.0
  Cd  Cd2  2  0.4663  0.3813  0.2550  1.0
  In  In3  2  0.2937  0.7289  0.4896  1.0
  In  In4  2  0.4429  0.8121  0.0606  1.0
]