The compound described by In4CdI6 crystallizes in the tetragonal P4/mnc space group. Cd(1) is bonded in an octahedral geometry to two equivalent I(2) and four equivalent I(1) atoms. In(1) is bonded in a 4-coordinate geometry to two equivalent I(1) and two equivalent I(2) atoms. There are two inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one Cd(1) and two equivalent In(1) atoms. In the second I site, I(2) is bonded in a single-bond geometry to one Cd(1) and four equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cd(In2I3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.158
_cell_length_b   9.158
_cell_length_c   10.004
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   838.961
_cell_formula_units_Z   2
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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Cd  Cd1  1  0.500  0.500  0.500  1.0
  In  In2  1  0.857  0.643  0.750  1.0
  In  In3  1  0.857  0.643  0.250  1.0
  In  In4  1  0.643  0.143  0.750  1.0
  In  In5  1  0.643  0.143  0.250  1.0
  In  In6  1  0.143  0.357  0.250  1.0
  In  In7  1  0.143  0.357  0.750  1.0
  In  In8  1  0.357  0.857  0.250  1.0
  In  In9  1  0.357  0.857  0.750  1.0
  I  I10  1  0.851  0.306  0.000  1.0
  I  I11  1  0.149  0.694  0.000  1.0
  I  I12  1  0.694  0.851  0.000  1.0
  I  I13  1  0.000  0.000  0.288  1.0
  I  I14  1  0.194  0.649  0.500  1.0
  I  I15  1  0.649  0.806  0.500  1.0
  I  I16  1  0.000  0.000  0.712  1.0
  I  I17  1  0.500  0.500  0.212  1.0
  I  I18  1  0.806  0.351  0.500  1.0
  I  I19  1  0.351  0.194  0.500  1.0
  I  I20  1  0.500  0.500  0.788  1.0
  I  I21  1  0.306  0.149  0.000  1.0
[/CIF]
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The compound described by In4CdI6 crystallizes in the tetragonal P4/mnc space group. Cd(1) is bonded in an octahedral geometry to two equivalent I(2) and four equivalent I(1) atoms. In(1) is bonded in a 4-coordinate geometry to two equivalent I(1) and two equivalent I(2) atoms. There are two inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one Cd(1) and two equivalent In(1) atoms. In the second I site, I(2) is bonded in a single-bond geometry to one Cd(1) and four equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cd(In2I3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.158
_cell_length_b   9.158
_cell_length_c   10.004
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   838.961
_cell_formula_units_Z   2
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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Cd  Cd1  1  0.500  0.500  0.500  1.0
  In  In2  1  0.857  0.643  0.750  1.0
  In  In3  1  0.857  0.643  0.250  1.0
  In  In4  1  0.643  0.143  0.750  1.0
  In  In5  1  0.643  0.143  0.250  1.0
  In  In6  1  0.143  0.357  0.250  1.0
  In  In7  1  0.143  0.357  0.750  1.0
  In  In8  1  0.357  0.857  0.250  1.0
  In  In9  1  0.357  0.857  0.750  1.0
  I  I10  1  0.851  0.306  0.000  1.0
  I  I11  1  0.149  0.694  0.000  1.0
  I  I12  1  0.694  0.851  0.000  1.0
  I  I13  1  0.000  0.000  0.288  1.0
  I  I14  1  0.194  0.649  0.500  1.0
  I  I15  1  0.649  0.806  0.500  1.0
  I  I16  1  0.000  0.000  0.712  1.0
  I  I17  1  0.500  0.500  0.212  1.0
  I  I18  1  0.806  0.351  0.500  1.0
  I  I19  1  0.351  0.194  0.500  1.0
  I  I20  1  0.500  0.500  0.788  1.0
  I  I21  1  0.306  0.149  0.000  1.0
[/CIF]
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