data_[K4As4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  As  2.1800  1.1500  0.6600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.6637]
_cell_length_b [6.9776]
_cell_length_c [9.9118]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.1012]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KAsCl5]
_chemical_formula_sum '[K4 As4 Cl20]'
_cell_volume [881.6255]
_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  0.4927  0.7500  1.0
  As  As1  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  8  0.1284  0.2419  0.0537  1.0
  Cl  Cl3  8  0.1302  0.2388  0.5746  1.0
  Cl  Cl4  4  0.0000  0.0287  0.2500  1.0
]