data_[Cs8Cu4Ge4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cu  1.9000  1.3500  0.8200
  Ge  2.0100  1.2500  0.7700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3068]
_cell_length_b [21.4311]
_cell_length_c [14.4229]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2CuGeBr5]
_chemical_formula_sum '[Cs8 Cu4 Ge4 Br20]'
_cell_volume [1331.2371]
_cell_formula_units_Z [4]
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  0.0000  0.1181  0.7001  1.0
  Cs  Cs1  4  0.0000  0.1256  0.3001  1.0
  Cu  Cu2  4  0.0000  0.4515  0.4608  1.0
  Ge  Ge3  4  0.0000  0.2130  0.0067  1.0
  Br  Br4  4  0.0000  0.0645  0.0359  1.0
  Br  Br5  4  0.0000  0.2858  0.6390  1.0
  Br  Br6  4  0.0000  0.2954  0.3732  1.0
  Br  Br7  4  0.0000  0.3354  0.0010  1.0
  Br  Br8  4  0.0000  0.4932  0.3072  1.0
]