data_[Li12In4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [8.5352]
_cell_length_b [8.8043]
_cell_length_c [4.6956]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [58]
_chemical_formula_structural [Li6In2Pb]
_chemical_formula_sum '[Li12 In4 Pb2]'
_cell_volume [352.8579]
_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  0.0065  0.8319  0.0000  1.0
  Li  Li1  4  0.1622  0.9353  0.5000  1.0
  Li  Li2  4  0.1758  0.6071  0.5000  1.0
  In  In3  4  0.1625  0.2689  0.5000  1.0
  Pb  Pb4  2  0.0000  0.5000  0.0000  1.0
]