data_InCo2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53
_cell_length_b   4.53
_cell_length_c   2.76
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   104.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InCo2Ir
_chemical_formula_sum   'In1 Co2 Ir1'
_cell_volume   54.87
_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
  In  In2  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.38  0.21  0.38  1.0
  Co  Co1  1  0.38  0.79  0.38  1.0
  Ir  Ir3  1  0.77  0.0  0.0  1.0

data_InCo2Ir
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   4.53
_cell_length_c   4.53
_cell_angle_alpha   104.65
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InCo2Ir
_chemical_formula_sum   'In1 Co2 Ir1'
_cell_volume   54.87
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.38  0.38  0.79  1.0
  Co  Co2  1  0.38  0.38  0.21  1.0
  Ir  Ir3  1  0.0  0.77  0.0  1.0

In Co Co Ir
IrCo2In crystallizes in the triclinic P1 space group. Ir(1) is bonded in a distorted single-bond geometry to two equivalent Co(1), two equivalent Co(2), and one In(1) atom. There is one shorter (2.42 Å) and one longer (2.77 Å) Ir(1)-Co(1) bond length. There is one shorter (2.05 Å) and one longer (2.45 Å) Ir(1)-Co(2) bond length. The Ir(1)-In(1) bond length is 1.05 Å. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 8-coordinate geometry to two equivalent Ir(1), two equivalent Co(1), two equivalent Co(2), and two equivalent In(1) atoms. Both Co(1)-Co(1) bond lengths are 2.76 Å. There is one shorter (1.88 Å) and one longer (2.65 Å) Co(1)-Co(2) bond length. There is one shorter (2.05 Å) and one longer (2.45 Å) Co(1)-In(1) bond length. In the second Co site, Co(2) is bonded in a 8-coordinate geometry to two equivalent Ir(1), two equivalent Co(1), two equivalent Co(2), and two equivalent In(1) atoms. Both Co(2)-Co(2) bond lengths are 2.76 Å. There is one shorter (2.42 Å) and one longer (2.77 Å) Co(2)-In(1) bond length. In(1) is bonded in a distorted single-bond geometry to one Ir(1), two equivalent Co(1), and two equivalent Co(2) atoms.