data_Y2CdIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63
_cell_length_b   6.63
_cell_length_c   6.63
_cell_angle_alpha   149.84
_cell_angle_beta   137.66
_cell_angle_gamma   52.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2CdIr
_chemical_formula_sum   'Y2 Cd1 Ir1'
_cell_volume   97.96
_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
  Y  Y2  1  0.0  0.0  0.62  1.0
  Y  Y3  1  0.0  0.39  0.07  1.0
  Cd  Cd0  1  0.0  0.0  0.28  1.0
  Ir  Ir1  1  0.72  0.0  0.9  1.0

data_Y2CdIr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.45
_cell_length_b   4.79
_cell_length_c   6.63
_cell_angle_alpha   111.17
_cell_angle_beta   105.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2CdIr
_chemical_formula_sum   'Y2 Cd1 Ir1'
_cell_volume   97.96
_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
  Y  Y0  1  0.38  0.38  0.38  1.0
  Y  Y1  1  0.93  0.33  0.33  1.0
  Cd  Cd2  1  0.72  0.72  0.72  1.0
  Ir  Ir3  1  0.82  0.1  0.82  1.0

Y Y Cd Ir
Y Y Cd Ir 0 1 o o + 2 3 - o - 
Y2IrCd crystallizes in the triclinic P1 space group. There are two inequivalent Y sites. In the first Y site, Y(1) is bonded in a 5-coordinate geometry to two equivalent Y(2), two equivalent Ir(1), and one Cd(1) atom. There is one shorter (1.48 Å) and one longer (2.03 Å) Y(1)-Y(2) bond length. There is one shorter (3.45 Å) and one longer (3.64 Å) Y(1)-Ir(1) bond length. The Y(1)-Cd(1) bond length is 2.28 Å. In the second Y site, Y(2) is bonded in a 4-coordinate geometry to two equivalent Y(1), one Ir(1), and one Cd(1) atom. The Y(2)-Ir(1) bond length is 3.04 Å. The Y(2)-Cd(1) bond length is 2.90 Å. Ir(1) is bonded in a distorted single-bond geometry to one Y(2), two equivalent Y(1), and one Cd(1) atom. The Ir(1)-Cd(1) bond length is 1.67 Å. Cd(1) is bonded in a 2-coordinate geometry to one Y(1), one Y(2), and one Ir(1) atom.