data_[Cs2In2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2943]
_cell_length_b [8.9914]
_cell_length_c [9.5080]
_cell_angle_alpha [64.8870]
_cell_angle_beta [82.8718]
_cell_angle_gamma [85.5312]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CsInCl3]
_chemical_formula_sum '[Cs2 In2 Cl6]'
_cell_volume [406.4985]
_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  1  0.0495  0.6154  0.2203  1.0
  Cs  Cs1  1  0.4428  0.1317  0.7298  1.0
  In  In2  1  0.2223  0.7201  0.6254  1.0
  In  In3  1  0.4674  0.1677  0.1468  1.0
  Cl  Cl4  1  0.0035  0.4834  0.6572  1.0
  Cl  Cl5  1  0.4271  0.6628  0.8550  1.0
  Cl  Cl6  1  0.5060  0.7816  0.3897  1.0
  Cl  Cl7  1  0.5786  0.3389  0.3183  1.0
  Cl  Cl8  1  0.8947  0.0375  0.0100  1.0
  Cl  Cl9  1  0.9847  0.9719  0.5694  1.0
]