data_[La16Sb2Pb10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sb  2.0500  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.8837]
_cell_length_b [9.8837]
_cell_length_c [9.8605]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [La8SbPb5]
_chemical_formula_sum '[La16 Sb2 Pb10]'
_cell_volume [963.2545]
_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
[
  La  La0  8  0.0695  0.3209  0.4462  1
  La  La1  8  0.0711  0.1822  0.8041  1
  Sb  Sb2  2  0.0000  0.5000  0.7500  1
  Pb  Pb3  8  0.1248  0.2490  0.1253  1
  Pb  Pb4  2  0.0000  0.0000  0.5000  1
]