data_[Cs4Ba2Ge2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ba  0.8900  2.1500  1.4900
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.9166]
_cell_length_b [8.0603]
_cell_length_c [13.7407]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6756]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2BaGeCl6]
_chemical_formula_sum '[Cs4 Ba2 Ge2 Cl12]'
_cell_volume [721.0623]
_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  4  0.2366  0.5458  0.7489  1
  Ba  Ba1  2  0.5000  0.0000  0.0000  1
  Ge  Ge2  2  0.0000  0.0000  0.5000  1
  Cl  Cl3  4  0.1576  0.7275  0.4628  1
  Cl  Cl4  4  0.2371  0.1972  0.4648  1
  Cl  Cl5  4  0.3019  0.5153  0.2338  1
]