data_[Na1Cu2Pb1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cu  1.9000  1.3500  0.8200
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.7632]
_cell_length_b [6.7905]
_cell_length_c [7.8481]
_cell_angle_alpha [64.9492]
_cell_angle_beta [65.4380]
_cell_angle_gamma [61.2234]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [NaCu2PbCl6]
_chemical_formula_sum '[Na1 Cu2 Pb1 Cl6]'
_cell_volume [275.8292]
_cell_formula_units_Z [1]
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
[
  Na  Na0  1  0.4901  0.5083  0.5181  1.0
  Cu  Cu1  1  0.2352  0.2682  0.2704  1.0
  Cu  Cu2  1  0.7523  0.7490  0.7664  1.0
  Pb  Pb3  1  0.9890  0.0023  0.0186  1.0
  Cl  Cl4  1  0.0565  0.4273  0.7241  1.0
  Cl  Cl5  1  0.2240  0.9345  0.2881  1.0
  Cl  Cl6  1  0.4217  0.7229  0.7927  1.0
  Cl  Cl7  1  0.5670  0.2156  0.2992  1.0
  Cl  Cl8  1  0.6950  0.0840  0.7901  1.0
  Cl  Cl9  1  0.9062  0.5656  0.2297  1.0
]