data_[Cs10Sb4Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sb  2.0500  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.9292]
_cell_length_b [8.3084]
_cell_length_c [11.9676]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3050]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs5(SbBr6)2]
_chemical_formula_sum '[Cs10 Sb4 Br24]'
_cell_volume [1881.3172]
_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
[
  Cs  Cs0  4  0.1919  0.5000  0.8423  1.0
  Cs  Cs1  4  0.2019  0.5000  0.3539  1.0
  Cs  Cs2  2  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  4  0.0000  0.2490  0.0000  1.0
  Br  Br4  8  0.1471  0.2535  0.0702  1.0
  Br  Br5  8  0.1472  0.2782  0.5723  1.0
  Br  Br6  4  0.0033  0.5000  0.1702  1.0
  Br  Br7  4  0.0035  0.0000  0.1681  1.0
]