data_[La6In2Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [9.2905]
_cell_length_b [3.5756]
_cell_length_c [9.6372]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6164]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [La3InSn]
_chemical_formula_sum '[La6 In2 Sn2]'
_cell_volume [309.7788]
_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  0.1313  0.0000  0.1413  1
  La  La1  2  0.2812  0.0000  0.5064  1
  La  La2  2  0.3103  0.0000  0.8962  1
  In  In3  2  0.4445  0.5000  0.2447  1
  Sn  Sn4  2  0.0442  0.5000  0.6609  1
]