data_CuAgIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.87
_cell_angle_alpha   99.44
_cell_angle_beta   99.44
_cell_angle_gamma   34.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAgIr2
_chemical_formula_sum   'Cu1 Ag1 Ir2'
_cell_volume   59.58
_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
  Cu  Cu1  1  0.45  0.0  0.28  1.0
  Ag  Ag0  1  0.06  0.0  0.24  1.0
  Ir  Ir2  1  0.2  0.0  0.64  1.0
  Ir  Ir3  1  0.63  0.0  0.83  1.0

data_CuAgIr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   4.69
_cell_length_c   4.87
_cell_angle_alpha   99.44
_cell_angle_beta   90.0
_cell_angle_gamma   107.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAgIr2
_chemical_formula_sum   'Cu1 Ag1 Ir2'
_cell_volume   59.58
_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
  Cu  Cu0  1  0.0  0.55  0.72  1.0
  Ag  Ag1  1  0.0  0.94  0.76  1.0
  Ir  Ir2  1  0.0  0.37  0.17  1.0
  Ir  Ir3  1  0.0  0.8  0.36  1.0

Cu Ag Ir Ir