data_[La12Cd4Sn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.2827]
_cell_length_b [6.6861]
_cell_length_c [6.4878]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5099]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La3CdSn2]
_chemical_formula_sum '[La12 Cd4 Sn8]'
_cell_volume [725.7804]
_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
[
  La  La0  8  0.1736  0.1128  0.1004  1
  La  La1  4  0.0000  0.3480  0.7500  1
  Cd  Cd2  4  0.0000  0.1405  0.2500  1
  Sn  Sn3  8  0.1558  0.3911  0.5447  1
]