data_[La4Al2Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Al  1.6100  1.2500  0.6750
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.4152]
_cell_length_b [4.3946]
_cell_length_c [9.2651]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.1972]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La2AlSn]
_chemical_formula_sum '[La4 Al2 Sn2]'
_cell_volume [248.1385]
_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  2  0.2178  0.2500  0.4343  1.0
  La  La1  2  0.2954  0.7500  0.0743  1.0
  Al  Al2  2  0.3589  0.7500  0.7135  1.0
  Sn  Sn3  2  0.1361  0.2500  0.7880  1.0
]