data_InBBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.07
_cell_length_b   7.54
_cell_length_c   3.65
_cell_angle_alpha   84.88
_cell_angle_beta   68.39
_cell_angle_gamma   26.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InBBr
_chemical_formula_sum   'In1 B1 Br1'
_cell_volume   76.01
_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  In2  1  0.57  0.29  0.49  1.0
  B  B0  1  0.57  0.29  0.2  1.0
  Br  Br1  1  0.57  0.29  0.05  1.0

data_InBBr
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.13
_cell_length_b   14.74
_cell_length_c   3.65
_cell_angle_alpha   90.0
_cell_angle_beta   115.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   InBBr
_chemical_formula_sum   'In2 B2 Br2'
_cell_volume   152.02
_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  0.49  0.0  0.06  1.0
  B  B1  2  0.2  0.0  0.77  1.0
  Br  Br2  2  0.05  0.0  0.62  1.0

In B Br
In B Br 0 1 o o o 1 2 o o o 