data_[Cs4Na4Fe8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Na  0.9300  1.8000  1.1600
  Fe  1.8300  1.4000  0.8525
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.3175]
_cell_length_b [13.3456]
_cell_length_c [7.7809]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.9431]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsNa(FeBr3)2]
_chemical_formula_sum '[Cs4 Na4 Fe8 Br24]'
_cell_volume [1429.5492]
_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  0.1920  0.2500  1.0
  Na  Na1  4  0.0000  0.4003  0.7500  1.0
  Fe  Fe2  8  0.2145  0.0873  0.7773  1.0
  Br  Br3  8  0.1103  0.4260  0.1365  1.0
  Br  Br4  8  0.1428  0.0251  0.0181  1.0
  Br  Br5  8  0.1543  0.2536  0.6969  1.0
]