data_[Ce8Co4Sn2]
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 [P1]
_cell_length_a [6.5212]
_cell_length_b [6.8471]
_cell_length_c [8.2725]
_cell_angle_alpha [106.2155]
_cell_angle_beta [108.2433]
_cell_angle_gamma [102.0930]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ce4Co2Sn]
_chemical_formula_sum '[Ce8 Co4 Sn2]'
_cell_volume [318.4985]
_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  1  0.0046  0.5622  0.7394  1.0
  Ce  Ce1  1  0.2777  0.5641  0.1658  1.0
  Ce  Ce2  1  0.3975  0.2000  0.4028  1.0
  Ce  Ce3  1  0.4470  0.5543  0.7327  1.0
  Ce  Ce4  1  0.5070  0.1336  0.9441  1.0
  Ce  Ce5  1  0.7243  0.9582  0.5432  1.0
  Ce  Ce6  1  0.8012  0.7114  0.1229  1.0
  Ce  Ce7  1  0.9092  0.2953  0.3177  1.0
  Co  Co8  1  0.1020  0.1683  0.7151  1.0
  Co  Co9  1  0.3976  0.8631  0.0908  1.0
  Co  Co10  1  0.6824  0.5333  0.3691  1.0
  Co  Co11  1  0.8041  0.3379  0.8634  1.0
  Sn  Sn12  1  0.0123  0.0421  0.9700  1.0
  Sn  Sn13  1  0.1831  0.8261  0.5230  1.0
]