data_InGa2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63
_cell_length_b   4.65
_cell_length_c   6.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGa2Br
_chemical_formula_sum   'In1 Ga2 Br1'
_cell_volume   103.39
_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  In3  1  0.82  0.32  0.01  1.0
  Ga  Ga1  1  0.82  0.32  0.07  1.0
  Ga  Ga2  1  0.0  0.0  0.47  1.0
  Br  Br0  1  0.0  0.0  0.64  1.0

data_InGa2Br
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   4.65
_cell_length_c   6.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGa2Br
_chemical_formula_sum   'In1 Ga2 Br1'
_cell_volume   103.39
_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  0.82  0.32  0.01  1.0
  Ga  Ga1  1  0.0  0.0  0.47  1.0
  Ga  Ga2  1  0.82  0.32  0.07  1.0
  Br  Br3  1  0.0  0.0  0.64  1.0

In Ga Ga Br
In Ga Ga Br 0 1 o o o 2 3 o o o 