data_[Ce16Fe2Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Fe  1.8300  1.4000  0.8525
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [25.0302]
_cell_length_b [5.1804]
_cell_length_c [4.3918]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.5154]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce8FePb2]
_chemical_formula_sum '[Ce16 Fe2 Pb4]'
_cell_volume [566.8300]
_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
[
  Ce  Ce0  4  0.0478  0.0000  0.1915  1
  Ce  Ce1  4  0.0654  0.5000  0.6190  1
  Ce  Ce2  4  0.1574  0.5000  0.2519  1
  Ce  Ce3  4  0.2407  0.5000  0.7172  1
  Fe  Fe4  2  0.0000  0.5000  0.0000  1
  Pb  Pb5  4  0.1532  0.0000  0.7422  1
]