data_InSn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   9.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSn
_chemical_formula_sum   'In4 Sn4'
_cell_volume   233.8
_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
  In  In0  1  0.0  0.0  0.38  1.0
  In  In1  1  0.0  0.0  0.14  1.0
  In  In2  1  0.66  0.54  0.14  1.0
  In  In3  1  0.0  0.08  0.38  1.0
  Sn  Sn4  1  0.66  0.54  0.7  1.0
  Sn  Sn5  1  0.0  0.08  0.46  1.0
  Sn  Sn6  1  0.0  0.08  0.82  1.0
  Sn  Sn7  1  0.66  0.54  0.06  1.0

data_InSn
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   9.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSn
_chemical_formula_sum   'In4 Sn4'
_cell_volume   233.8
_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
  In  In0  1  0.0  0.0  0.14  1.0
  In  In1  1  0.0  0.0  0.38  1.0
  In  In2  1  0.0  0.08  0.38  1.0
  In  In3  1  0.66  0.54  0.14  1.0
  Sn  Sn4  1  0.0  0.08  0.46  1.0
  Sn  Sn5  1  0.0  0.08  0.82  1.0
  Sn  Sn6  1  0.66  0.54  0.06  1.0
  Sn  Sn7  1  0.66  0.54  0.7  1.0

In In In In Sn Sn Sn Sn
In In In In Sn Sn Sn Sn 0 3 o o o 0 1 o o o 0 5 o o o 1 7 - - o 1 2 - - o 1 3 o o o 1 6 o o - 2 7 o o o 3 5 o o o 4 6 o o o 4 6 + + o 4 5 + + o 4 7 o o + 5 6 o o o 6 7 - - + 