data_[Li8Te12Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [16.3856]
_cell_length_b [7.8497]
_cell_length_c [7.0445]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Li2Te3Pb2]
_chemical_formula_sum '[Li8 Te12 Pb8]'
_cell_volume [906.0687]
_cell_formula_units_Z [4]
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  0.1001  0.2500  0.4239  1
  Li  Li1  4  0.2029  0.7500  0.9625  1
  Te  Te2  8  0.1931  0.5017  0.2653  1
  Te  Te3  4  0.0468  0.7500  0.7826  1
  Pb  Pb4  4  0.0583  0.7500  0.3311  1
  Pb  Pb5  4  0.1165  0.2500  0.9862  1
]