data_[Li4Ni2Pb2Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ni  1.9100  1.3500  0.7400
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.7408]
_cell_length_b [8.0000]
_cell_length_c [7.5005]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8010]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2NiPbCl8]
_chemical_formula_sum '[Li4 Ni2 Pb2 Cl16]'
_cell_volume [584.4276]
_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
[
  Li  Li0  4  0.0592  0.5000  0.7760  1.0
  Ni  Ni1  2  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.0000  0.2941  0.0000  1.0
  Cl  Cl4  4  0.0000  0.3232  0.5000  1.0
  Cl  Cl5  4  0.1689  0.0000  0.7819  1.0
  Cl  Cl6  4  0.1800  0.0000  0.2306  1.0
]