data_[Li12Bi2Pb10]
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 [Immm]
_cell_length_a [5.0433]
_cell_length_b [7.2135]
_cell_length_c [15.0435]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li6BiPb5]
_chemical_formula_sum '[Li12 Bi2 Pb10]'
_cell_volume [547.2736]
_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  8  0.0000  0.2451  0.8348  1
  Li  Li1  4  0.0000  0.2590  0.5000  1
  Bi  Bi2  2  0.0000  0.0000  0.0000  1
  Pb  Pb3  4  0.0000  0.0000  0.3345  1
  Pb  Pb4  4  0.0000  0.5000  0.3270  1
  Pb  Pb5  2  0.0000  0.5000  0.0000  1
]