data_[In4Pb4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.4528]
_cell_length_b [8.1485]
_cell_length_c [10.0940]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.5925]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [InPbCl5]
_chemical_formula_sum '[In4 Pb4 Cl20]'
_cell_volume [856.5567]
_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
[
  In  In0  4  0.0000  0.0000  0.0000  1.0
  Pb  Pb1  4  0.0000  0.4682  0.2500  1.0
  Cl  Cl2  8  0.0648  0.3000  0.9889  1.0
  Cl  Cl3  8  0.2266  0.0901  0.6316  1.0
  Cl  Cl4  4  0.0000  0.0939  0.2500  1.0
]