data_ZnGa2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91
_cell_length_b   4.91
_cell_length_c   4.47
_cell_angle_alpha   96.19
_cell_angle_beta   96.19
_cell_angle_gamma   34.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnGa2Ir
_chemical_formula_sum   'Zn1 Ga2 Ir1'
_cell_volume   60.07
_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  0.89  0.0  0.33  1.0
  Ga  Ga0  1  0.87  0.0  0.39  1.0
  Ga  Ga1  1  0.0  0.0  0.2  1.0
  Ir  Ir2  1  0.45  0.0  0.18  1.0

data_ZnGa2Ir
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   4.47
_cell_length_c   4.91
_cell_angle_alpha   96.19
_cell_angle_beta   107.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnGa2Ir
_chemical_formula_sum   'Zn1 Ga2 Ir1'
_cell_volume   60.07
_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  0.33  0.89  1.0
  Ga  Ga1  1  0.0  0.2  0.0  1.0
  Ga  Ga2  1  0.0  0.39  0.87  1.0
  Ir  Ir3  1  0.0  0.18  0.45  1.0

Zn Ga Ga Ir
Zn Ga Ga Ir 0 1 o o o 0 2 + o o 0 3 o o o 1 3 o o o 2 3 o o o 