data_[Rb4Ba2Ge2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ba  0.8900  2.1500  1.4900
  Ge  2.0100  1.2500  0.7700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.0612]
_cell_length_b [8.4305]
_cell_length_c [14.0066]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.1832]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Rb2BaGeBr6]
_chemical_formula_sum '[Rb4 Ba2 Ge2 Br12]'
_cell_volume [787.4422]
_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
[
  Rb  Rb0  4  0.2224  0.0705  0.2471  1.0
  Ba  Ba1  2  0.5000  0.0000  0.0000  1.0
  Ge  Ge2  2  0.0000  0.0000  0.5000  1.0
  Br  Br3  4  0.1232  0.2170  0.9428  1.0
  Br  Br4  4  0.2317  0.6866  0.9467  1.0
  Br  Br5  4  0.3385  0.0325  0.7319  1.0
]