data_[K10Sb4Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [18.5603]
_cell_length_b [8.1242]
_cell_length_c [10.7275]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7673]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K5(SbBr6)2]
_chemical_formula_sum '[K10 Sb4 Br24]'
_cell_volume [1531.5690]
_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
[
  K  K0  4  0.1901  0.5000  0.8290  1.0
  K  K1  4  0.2071  0.5000  0.3634  1.0
  K  K2  2  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  4  0.0000  0.2518  0.0000  1.0
  Br  Br4  8  0.1448  0.2616  0.5655  1.0
  Br  Br5  8  0.1579  0.2583  0.0701  1.0
  Br  Br6  4  0.0073  0.5000  0.1959  1.0
  Br  Br7  4  0.0106  0.0000  0.1893  1.0
]