data_[Cs4Be8Ga4Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Be  1.5700  1.0500  0.5900
  Ga  1.8100  1.3000  0.7600
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.3220]
_cell_length_b [15.5692]
_cell_length_c [9.9127]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.1075]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsBe2GaBr6]
_chemical_formula_sum '[Cs4 Be8 Ga4 Br24]'
_cell_volume [1618.8898]
_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  0.1610  0.7500  1.0
  Be  Be1  8  0.2390  0.3862  0.7773  1.0
  Ga  Ga2  4  0.0000  0.4604  0.2500  1.0
  Br  Br3  8  0.0649  0.3893  0.5967  1.0
  Br  Br4  8  0.1650  0.2283  0.1593  1.0
  Br  Br5  8  0.2013  0.0003  0.1035  1.0
]