data_[Li12Zn2Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7689]
_cell_length_b [5.8586]
_cell_length_c [5.0417]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.3040]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li6ZnPb2]
_chemical_formula_sum '[Li12 Zn2 Pb4]'
_cell_volume [344.8017]
_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  0.0984  0.2549  0.6708  1
  Li  Li1  4  0.2033  0.0000  0.2433  1
  Zn  Zn2  2  0.0000  0.0000  0.0000  1
  Pb  Pb3  4  0.1370  0.5000  0.1792  1
]