data_[Ce4Al16Sn24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Al  1.6100  1.2500  0.6750
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [9.3105]
_cell_length_b [10.1541]
_cell_length_c [12.6193]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [Ce(Al2Sn3)2]
_chemical_formula_sum '[Ce4 Al16 Sn24]'
_cell_volume [1193.0219]
_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
[
  Ce  Ce0  4  0.0000  0.0000  0.9619  1
  Al  Al1  8  0.0000  0.2186  0.3738  1
  Al  Al2  8  0.2461  0.0000  0.6232  1
  Sn  Sn3  8  0.0000  0.1522  0.6830  1
  Sn  Sn4  8  0.1756  0.0000  0.3335  1
  Sn  Sn5  8  0.2500  0.2500  0.0068  1
]