[CIF]
data_In3Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07327596
_cell_length_b   6.07327596
_cell_length_c   6.07327596
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In3Sn
_chemical_formula_sum   'In6 Sn2'
_cell_volume   224.01084572
_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
  In  In0  1  1.51831899  0.00000000  3.03663798  1
  In  In1  1  4.55495697  0.00000000  3.03663798  1
  In  In2  1  3.03663798  1.51831899  0.00000000  1
  In  In3  1  3.03663798  4.55495697  0.00000000  1
  In  In4  1  0.00000000  3.03663798  4.55495697  1
  In  In5  1  0.00000000  3.03663798  1.51831899  1
  Sn  Sn6  1  3.03663798  3.03663798  3.03663798  1
  Sn  Sn7  1  0.00000000  0.00000000  0.00000000  1
[/CIF]
