data_In2SbSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.74
_cell_length_b   8.74
_cell_length_c   8.74
_cell_angle_alpha   25.94
_cell_angle_beta   25.94
_cell_angle_gamma   25.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2SbSe
_chemical_formula_sum   'In2 Sb1 Se1'
_cell_volume   112.41
_cell_formula_units_Z   1
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  0.24  1.0
  In  In1  1  0.0  0.0  0.34  1.0
  Sb  Sb2  1  0.0  0.0  0.74  1.0
  Se  Se3  1  0.0  0.0  0.64  1.0

data_In2SbSe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.79
_cell_length_b   3.92
_cell_length_c   8.74
_cell_angle_alpha   90.0
_cell_angle_beta   105.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   In2SbSe
_chemical_formula_sum   'In4 Sb2 Se2'
_cell_volume   224.82
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.66  1.0
  In  In1  2  0.0  0.0  0.76  1.0
  Sb  Sb2  2  0.0  0.0  0.26  1.0
  Se  Se3  2  0.0  0.0  0.36  1.0

In In Sb Se
In In Sb Se 0 1 o o o 2 3 o o o 