data_[La8Sn2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.2345]
_cell_length_b [4.2162]
_cell_length_c [8.9513]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.8129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La4SnCl5]
_chemical_formula_sum '[La8 Sn2 Cl10]'
_cell_volume [671.0381]
_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
[
  La  La0  4  0.0069  0.0000  0.2554  1.0
  La  La1  4  0.1745  0.5000  0.0712  1.0
  Sn  Sn2  2  0.0000  0.5000  0.0000  1.0
  Cl  Cl3  4  0.1588  0.0000  0.8241  1.0
  Cl  Cl4  4  0.1702  0.0000  0.3005  1.0
  Cl  Cl5  2  0.0000  0.5000  0.5000  1.0
]