data_In2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.19
_cell_length_b   6.19
_cell_length_c   11.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2Sb
_chemical_formula_sum   'In8 Sb4'
_cell_volume   383.43
_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  0.79  1.0
  In  In1  1  0.0  0.0  0.0  1.0
  In  In2  1  0.59  0.49  0.68  1.0
  In  In3  1  0.5  0.87  0.89  1.0
  In  In4  1  0.41  0.49  0.68  1.0
  In  In5  1  0.0  0.73  0.68  1.0
  In  In6  1  0.09  0.62  0.89  1.0
  In  In7  1  0.68  0.87  0.89  1.0
  Sb  Sb8  1  0.09  0.79  0.32  1.0
  Sb  Sb9  1  0.0  0.57  0.11  1.0
  Sb  Sb10  1  0.0  0.57  0.25  1.0
  Sb  Sb11  1  0.09  0.79  0.46  1.0

data_In2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.19
_cell_length_b   6.19
_cell_length_c   11.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2Sb
_chemical_formula_sum   'In8 Sb4'
_cell_volume   383.43
_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  0.0  1.0
  In  In1  1  0.0  0.0  0.79  1.0
  In  In2  1  0.0  0.73  0.68  1.0
  In  In3  1  0.09  0.62  0.89  1.0
  In  In4  1  0.41  0.49  0.68  1.0
  In  In5  1  0.5  0.87  0.89  1.0
  In  In6  1  0.59  0.49  0.68  1.0
  In  In7  1  0.68  0.87  0.89  1.0
  Sb  Sb8  1  0.0  0.57  0.11  1.0
  Sb  Sb9  1  0.0  0.57  0.25  1.0
  Sb  Sb10  1  0.09  0.79  0.32  1.0
  Sb  Sb11  1  0.09  0.79  0.46  1.0

In In In In In In In In Sb Sb Sb Sb
In In In In In In In In Sb Sb Sb Sb 0 7 - - o 0 5 o - o 0 1 o o + 1 7 - - - 2 4 o o o 2 5 + o o 3 7 o o o 3 6 o o o 5 6 o o o 6 9 o o + 8 10 o o o 8 11 o o o 9 10 o o o 