data_[Cs8Ga4Sn4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.7346]
_cell_length_b [20.2299]
_cell_length_c [15.8618]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2GaSnBr5]
_chemical_formula_sum '[Cs8 Ga4 Sn4 Br20]'
_cell_volume [1519.2403]
_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  0.0932  0.6612  1.0
  Cs  Cs1  4  0.0000  0.1376  0.3004  1.0
  Ga  Ga2  4  0.0000  0.4634  0.4547  1.0
  Sn  Sn3  4  0.0000  0.2168  0.0226  1.0
  Br  Br4  4  0.0000  0.0755  0.0671  1.0
  Br  Br5  4  0.0000  0.2706  0.6490  1.0
  Br  Br6  4  0.0000  0.3115  0.4019  1.0
  Br  Br7  4  0.0000  0.3634  0.9881  1.0
  Br  Br8  4  0.0000  0.4993  0.7791  1.0
]