data_[K8In4Sn4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  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 [4.5156]
_cell_length_b [19.0990]
_cell_length_c [16.9047]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [K2InSnBr5]
_chemical_formula_sum '[K8 In4 Sn4 Br20]'
_cell_volume [1457.9089]
_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  0.0555  0.6597  1.0
  K  K1  4  0.0000  0.1511  0.2574  1.0
  In  In2  4  0.0000  0.4437  0.4382  1.0
  Sn  Sn3  4  0.0000  0.2585  0.0352  1.0
  Br  Br4  4  0.0000  0.0998  0.0624  1.0
  Br  Br5  4  0.0000  0.2336  0.6641  1.0
  Br  Br6  4  0.0000  0.2559  0.4177  1.0
  Br  Br7  4  0.0000  0.4098  0.0214  1.0
  Br  Br8  4  0.0000  0.4738  0.7678  1.0
]