data_[Cs1In1Ge2Cl8]
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
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4547]
_cell_length_b [7.2581]
_cell_length_c [9.6072]
_cell_angle_alpha [77.1616]
_cell_angle_beta [80.7363]
_cell_angle_gamma [82.6498]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsIn(GeCl4)2]
_chemical_formula_sum '[Cs1 In1 Ge2 Cl8]'
_cell_volume [431.1195]
_cell_formula_units_Z [1]
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  0.0000  0.0000  0.5000  1.0
  In  In1  1  0.0000  0.0000  0.0000  1.0
  Ge  Ge2  2  0.4875  0.4039  0.7499  1.0
  Cl  Cl3  2  0.1507  0.7402  0.2200  1.0
  Cl  Cl4  2  0.1822  0.8153  0.8303  1.0
  Cl  Cl5  2  0.3193  0.2143  0.9663  1.0
  Cl  Cl6  2  0.4484  0.2339  0.5803  1.0
]