data_[Cs1Ge2Sb1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ge  2.0100  1.2500  0.7700
  Sb  2.0500  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4600]
_cell_length_b [7.2240]
_cell_length_c [9.7550]
_cell_angle_alpha [91.2013]
_cell_angle_beta [95.8627]
_cell_angle_gamma [98.4869]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsGe2SbCl8]
_chemical_formula_sum '[Cs1 Ge2 Sb1 Cl8]'
_cell_volume [447.6007]
_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
  Ge  Ge1  2  0.4428  0.5783  0.8093  1.0
  Sb  Sb2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.2071  0.2079  0.8255  1.0
  Cl  Cl4  2  0.2094  0.7086  0.9530  1.0
  Cl  Cl5  2  0.2712  0.6131  0.5982  1.0
  Cl  Cl6  2  0.2968  0.1136  0.2125  1.0
]