data_ZnIn2Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   5.73
_cell_angle_alpha   142.75
_cell_angle_beta   124.86
_cell_angle_gamma   68.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnIn2Ga
_chemical_formula_sum   'Zn1 In2 Ga1'
_cell_volume   91.89
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  In  In1  1  0.83  0.0  0.32  1.0
  In  In2  1  0.0  0.65  0.42  1.0
  Ga  Ga0  1  0.0  0.0  0.74  1.0

data_ZnIn2Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.66
_cell_length_b   5.3
_cell_length_c   5.73
_cell_angle_alpha   117.57
_cell_angle_beta   108.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnIn2Ga
_chemical_formula_sum   'Zn1 In2 Ga1'
_cell_volume   91.89
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.51  0.68  0.51  1.0
  In  In2  1  0.58  0.23  0.23  1.0
  Ga  Ga3  1  0.26  0.26  0.26  1.0

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