data_[K4Be8In4Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Be  1.5700  1.0500  0.5900
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.8117]
_cell_length_b [14.3494]
_cell_length_c [10.3388]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1853]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KBe2InBr6]
_chemical_formula_sum '[K4 Be8 In4 Br24]'
_cell_volume [1514.9005]
_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
[
  K  K0  4  0.0000  0.1968  0.7500  1.0
  Be  Be1  8  0.2370  0.0931  0.2197  1.0
  In  In2  4  0.0000  0.4058  0.2500  1.0
  Br  Br3  8  0.0906  0.3943  0.6121  1.0
  Br  Br4  8  0.1433  0.2127  0.1227  1.0
  Br  Br5  8  0.1791  0.0392  0.6398  1.0
]