data_[Cs2K4In6Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.2610]
_cell_length_b [4.6290]
_cell_length_c [9.2993]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7643]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsK2(InCl2)3]
_chemical_formula_sum '[Cs2 K4 In6 Cl12]'
_cell_volume [853.8375]
_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
[
  Cs  Cs0  2  0.0000  0.5000  0.0000  1.0
  K  K1  4  0.1692  0.0000  0.3461  1.0
  In  In2  4  0.1719  0.0000  0.8298  1.0
  In  In3  2  0.0000  0.5000  0.5000  1.0
  Cl  Cl4  4  0.0121  0.0000  0.2742  1.0
  Cl  Cl5  4  0.1714  0.5000  0.5936  1.0
  Cl  Cl6  4  0.1806  0.5000  0.1109  1.0
]