data_[Cd13Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.7250]
_cell_length_b [7.2667]
_cell_length_c [8.8611]
_cell_angle_alpha [74.3569]
_cell_angle_beta [83.8684]
_cell_angle_gamma [89.2757]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cd13Sn2]
_chemical_formula_sum '[Cd13 Sn2]'
_cell_volume [352.9052]
_cell_formula_units_Z [1]
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
[
  Cd  Cd0  2  0.1358  0.2704  0.1956  1
  Cd  Cd1  2  0.1974  0.4050  0.8058  1
  Cd  Cd2  2  0.2899  0.5391  0.3920  1
  Cd  Cd3  2  0.3329  0.6673  0.0029  1
  Cd  Cd4  2  0.4034  0.7994  0.6073  1
  Cd  Cd5  2  0.4705  0.9382  0.1925  1
  Cd  Cd6  1  0.0000  0.0000  0.0000  1
  Sn  Sn7  2  0.0645  0.1428  0.5994  1
]