data_FeIrAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   3.72
_cell_length_c   5.98
_cell_angle_alpha   90.0
_cell_angle_beta   91.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeIrAu2
_chemical_formula_sum   'Fe1 Ir1 Au2'
_cell_volume   63.82
_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
  Fe  Fe2  1  0.92  0.0  0.15  1.0
  Ir  Ir3  1  0.3  0.86  0.31  1.0
  Au  Au0  1  0.83  0.0  0.91  1.0
  Au  Au1  1  0.39  0.86  0.57  1.0

data_FeIrAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   3.72
_cell_length_c   5.98
_cell_angle_alpha   90.0
_cell_angle_beta   91.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeIrAu2
_chemical_formula_sum   'Fe1 Ir1 Au2'
_cell_volume   63.82
_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
  Fe  Fe0  1  0.92  0.0  0.15  1.0
  Ir  Ir1  1  0.3  0.86  0.31  1.0
  Au  Au2  1  0.39  0.86  0.57  1.0
  Au  Au3  1  0.83  0.0  0.91  1.0

Fe Ir Au Au