data_[Li8La16Pb24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.7859]
_cell_length_b [9.7740]
_cell_length_c [16.7997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [LiLa2Pb3]
_chemical_formula_sum '[Li8 La16 Pb24]'
_cell_volume [1442.6517]
_cell_formula_units_Z [8]
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  0.0000  0.3307  1.0
  La  La1  8  0.2307  0.0000  0.0000  1.0
  La  La2  8  0.2500  0.2500  0.2500  1.0
  Pb  Pb3  16  0.0000  0.2254  0.4119  1.0
  Pb  Pb4  8  0.0000  0.0000  0.1740  1.0
]