data_CrCdIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.86
_cell_angle_alpha   100.99
_cell_angle_beta   100.99
_cell_angle_gamma   33.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCdIr2
_chemical_formula_sum   'Cr1 Cd1 Ir2'
_cell_volume   61.78
_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
  Cr  Cr1  1  0.68  0.0  0.84  1.0
  Cd  Cd0  1  0.15  0.0  0.33  1.0
  Ir  Ir2  1  0.24  0.0  0.64  1.0
  Ir  Ir3  1  0.59  0.0  0.09  1.0

data_CrCdIr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   4.83
_cell_length_c   4.86
_cell_angle_alpha   100.99
_cell_angle_beta   90.0
_cell_angle_gamma   106.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCdIr2
_chemical_formula_sum   'Cr1 Cd1 Ir2'
_cell_volume   61.78
_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
  Cr  Cr0  1  0.0  0.32  0.16  1.0
  Cd  Cd1  1  0.0  0.85  0.67  1.0
  Ir  Ir2  1  0.0  0.41  0.91  1.0
  Ir  Ir3  1  0.0  0.76  0.36  1.0

Cr Cd Ir Ir