data_[Ce22Co8Sn18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [13.8233]
_cell_length_b [20.5333]
_cell_length_c [4.1104]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Ce11Co4Sn9]
_chemical_formula_sum '[Ce22 Co8 Sn18]'
_cell_volume [1166.6831]
_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  8  0.2492  0.1691  0.0000  1
  Ce  Ce1  4  0.0000  0.1602  0.0000  1
  Ce  Ce2  4  0.0000  0.3739  0.0000  1
  Ce  Ce3  4  0.1870  0.5000  0.0000  1
  Ce  Ce4  2  0.0000  0.0000  0.0000  1
  Co  Co5  8  0.1540  0.3967  0.5000  1
  Sn  Sn6  8  0.1081  0.2637  0.5000  1
  Sn  Sn7  8  0.1494  0.0732  0.5000  1
  Sn  Sn8  2  0.0000  0.5000  0.5000  1
]