data_[Li2Bi4Pb16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Bi  2.0200  1.6000  1.0350
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8636]
_cell_length_b [6.8551]
_cell_length_c [6.3967]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1375]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li(BiPb4)2]
_chemical_formula_sum '[Li2 Bi4 Pb16]'
_cell_volume [698.6071]
_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  2  0.0000  0.0000  0.0000  1.0
  Bi  Bi1  4  0.1530  0.0000  0.4435  1.0
  Pb  Pb2  8  0.0693  0.2659  0.7661  1.0
  Pb  Pb3  4  0.1360  0.5000  0.3387  1.0
  Pb  Pb4  4  0.2435  0.0000  0.0346  1.0
]