data_GaAg2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38
_cell_length_b   5.38
_cell_length_c   4.47
_cell_angle_alpha   109.53
_cell_angle_beta   109.53
_cell_angle_gamma   32.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaAg2Ir
_chemical_formula_sum   'Ga1 Ag2 Ir1'
_cell_volume   64.63
_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
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.51  0.0  0.17  1.0
  Ag  Ag1  1  0.27  0.0  0.02  1.0
  Ir  Ir3  1  0.39  0.0  0.1  1.0

data_GaAg2Ir
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   4.47
_cell_length_c   5.38
_cell_angle_alpha   109.53
_cell_angle_beta   106.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaAg2Ir
_chemical_formula_sum   'Ga1 Ag2 Ir1'
_cell_volume   64.63
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.0  0.02  0.27  1.0
  Ag  Ag2  1  0.0  0.17  0.51  1.0
  Ir  Ir3  1  0.0  0.1  0.39  1.0

Ga Ag Ag Ir