data_AlIn2Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.22
_cell_length_b   3.85
_cell_length_c   7.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlIn2Ga
_chemical_formula_sum   'Al1 In2 Ga1'
_cell_volume   90.84
_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
  Al  Al0  1  0.0  0.0  0.93  1.0
  In  In2  1  0.0  0.0  0.14  1.0
  In  In3  1  0.61  0.92  0.05  1.0
  Ga  Ga1  1  0.61  0.92  0.22  1.0

data_AlIn2Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   3.85
_cell_length_c   7.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlIn2Ga
_chemical_formula_sum   'Al1 In2 Ga1'
_cell_volume   90.84
_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
  Al  Al0  1  0.0  0.0  0.93  1.0
  In  In1  1  0.0  0.0  0.14  1.0
  In  In2  1  0.61  0.92  0.05  1.0
  Ga  Ga3  1  0.61  0.92  0.22  1.0

Al In In Ga
Al In In Ga 0 2 - - + 0 1 o o + 1 2 - - o 1 3 - - o 2 3 o o o 