data_[In2Pb2Cl6]
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 [Cm]
_cell_length_a [8.2259]
_cell_length_b [8.0638]
_cell_length_c [5.7570]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2330]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [InPbCl3]
_chemical_formula_sum '[In2 Pb2 Cl6]'
_cell_volume [381.8737]
_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
[
  In  In0  2  0.1043  0.0000  0.9192  1.0
  Pb  Pb1  2  0.0011  0.5000  0.5003  1.0
  Cl  Cl2  4  0.2220  0.2231  0.5450  1.0
  Cl  Cl3  2  0.4605  0.0000  0.9983  1.0
]