The crystal structure described by K3InCl6 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent K sites. In the first K site, K(1) is bonded in a 8-coordinate geometry to one Cl(1), one Cl(2), one Cl(3), one Cl(6), two equivalent Cl(4), and two equivalent Cl(5) atoms. In the second K site, K(2) is bonded in a 6-coordinate geometry to one Cl(1), one Cl(2), one Cl(5), one Cl(6), and two equivalent Cl(3) atoms. In the third K site, K(3) is bonded in a 8-coordinate geometry to one Cl(2), one Cl(3), one Cl(5), one Cl(6), two equivalent Cl(1), and two equivalent Cl(4) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in an octahedral geometry to two equivalent Cl(2), two equivalent Cl(3), and two equivalent Cl(6) atoms. In the second In site, In(2) is bonded in an octahedral geometry to two equivalent Cl(1), two equivalent Cl(4), and two equivalent Cl(5) atoms. There are six inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 5-coordinate geometry to one K(1), one K(2), two equivalent K(3), and one In(2) atom. In the second Cl site, Cl(2) is bonded in a 4-coordinate geometry to one K(1), one K(2), one K(3), and one In(1) atom. In the third Cl site, Cl(3) is bonded to one K(1), one K(3), two equivalent K(2), and one In(1) atom to form a mixture of distorted corner and edge-sharing ClK4In square pyramids. In the fourth Cl site, Cl(4) is bonded to two equivalent K(1), two equivalent K(3), and one In(2) atom to form a mixture of distorted corner and edge-sharing ClK4In trigonal bipyramids. In the fifth Cl site, Cl(5) is bonded to one K(2), one K(3), two equivalent K(1), and one In(2) atom to form a mixture of distorted corner and edge-sharing ClK4In trigonal bipyramids. In the sixth Cl site, Cl(6) is bonded in a 4-coordinate geometry to one K(1), one K(2), one K(3), and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K3InCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.642
_cell_length_b   12.328
_cell_length_c   12.809
_cell_angle_alpha   71.073
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1141.521
_cell_formula_units_Z   4
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
  K  K0  1  0.069  0.611  0.680  1.0
  K  K1  1  0.977  0.139  0.100  1.0
  K  K2  1  0.437  0.236  0.316  1.0
  K  K3  1  0.023  0.861  0.900  1.0
  K  K4  1  0.431  0.111  0.680  1.0
  K  K5  1  0.563  0.764  0.684  1.0
  K  K6  1  0.477  0.361  0.900  1.0
  K  K7  1  0.569  0.889  0.320  1.0
  K  K8  1  0.063  0.736  0.316  1.0
  K  K9  1  0.523  0.639  0.100  1.0
  K  K10  1  0.931  0.389  0.320  1.0
  K  K11  1  0.937  0.264  0.684  1.0
  In  In12  1  0.000  0.500  0.000  1.0
  In  In13  1  0.000  0.000  0.500  1.0
  In  In14  1  0.500  0.500  0.500  1.0
  In  In15  1  0.500  0.000  0.000  1.0
  Cl  Cl16  1  0.294  0.496  0.349  1.0
  Cl  Cl17  1  0.989  0.372  0.885  1.0
  Cl  Cl18  1  0.716  0.408  0.102  1.0
  Cl  Cl19  1  0.137  0.190  0.499  1.0
  Cl  Cl20  1  0.290  0.394  0.653  1.0
  Cl  Cl21  1  0.790  0.106  0.347  1.0
  Cl  Cl22  1  0.822  0.652  0.862  1.0
  Cl  Cl23  1  0.011  0.628  0.115  1.0
  Cl  Cl24  1  0.794  0.004  0.651  1.0
  Cl  Cl25  1  0.178  0.348  0.138  1.0
  Cl  Cl26  1  0.863  0.810  0.501  1.0
  Cl  Cl27  1  0.363  0.690  0.499  1.0
  Cl  Cl28  1  0.511  0.872  0.885  1.0
  Cl  Cl29  1  0.489  0.128  0.115  1.0
  Cl  Cl30  1  0.322  0.848  0.138  1.0
  Cl  Cl31  1  0.784  0.908  0.102  1.0
  Cl  Cl32  1  0.206  0.996  0.349  1.0
  Cl  Cl33  1  0.210  0.894  0.653  1.0
  Cl  Cl34  1  0.284  0.592  0.898  1.0
  Cl  Cl35  1  0.706  0.504  0.651  1.0
  Cl  Cl36  1  0.678  0.152  0.862  1.0
  Cl  Cl37  1  0.216  0.092  0.898  1.0
  Cl  Cl38  1  0.637  0.310  0.501  1.0
  Cl  Cl39  1  0.710  0.606  0.347  1.0
[/CIF]
.
The crystal structure described by K3InCl6 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent K sites. In the first K site, K(1) is bonded in a 8-coordinate geometry to one Cl(1), one Cl(2), one Cl(3), one Cl(6), two equivalent Cl(4), and two equivalent Cl(5) atoms. In the second K site, K(2) is bonded in a 6-coordinate geometry to one Cl(1), one Cl(2), one Cl(5), one Cl(6), and two equivalent Cl(3) atoms. In the third K site, K(3) is bonded in a 8-coordinate geometry to one Cl(2), one Cl(3), one Cl(5), one Cl(6), two equivalent Cl(1), and two equivalent Cl(4) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in an octahedral geometry to two equivalent Cl(2), two equivalent Cl(3), and two equivalent Cl(6) atoms. In the second In site, In(2) is bonded in an octahedral geometry to two equivalent Cl(1), two equivalent Cl(4), and two equivalent Cl(5) atoms. There are six inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 5-coordinate geometry to one K(1), one K(2), two equivalent K(3), and one In(2) atom. In the second Cl site, Cl(2) is bonded in a 4-coordinate geometry to one K(1), one K(2), one K(3), and one In(1) atom. In the third Cl site, Cl(3) is bonded to one K(1), one K(3), two equivalent K(2), and one In(1) atom to form a mixture of distorted corner and edge-sharing ClK4In square pyramids. In the fourth Cl site, Cl(4) is bonded to two equivalent K(1), two equivalent K(3), and one In(2) atom to form a mixture of distorted corner and edge-sharing ClK4In trigonal bipyramids. In the fifth Cl site, Cl(5) is bonded to one K(2), one K(3), two equivalent K(1), and one In(2) atom to form a mixture of distorted corner and edge-sharing ClK4In trigonal bipyramids. In the sixth Cl site, Cl(6) is bonded in a 4-coordinate geometry to one K(1), one K(2), one K(3), and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K3InCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.642
_cell_length_b   12.328
_cell_length_c   12.809
_cell_angle_alpha   71.073
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1141.521
_cell_formula_units_Z   4
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
  K  K0  1  0.069  0.611  0.680  1.0
  K  K1  1  0.977  0.139  0.100  1.0
  K  K2  1  0.437  0.236  0.316  1.0
  K  K3  1  0.023  0.861  0.900  1.0
  K  K4  1  0.431  0.111  0.680  1.0
  K  K5  1  0.563  0.764  0.684  1.0
  K  K6  1  0.477  0.361  0.900  1.0
  K  K7  1  0.569  0.889  0.320  1.0
  K  K8  1  0.063  0.736  0.316  1.0
  K  K9  1  0.523  0.639  0.100  1.0
  K  K10  1  0.931  0.389  0.320  1.0
  K  K11  1  0.937  0.264  0.684  1.0
  In  In12  1  0.000  0.500  0.000  1.0
  In  In13  1  0.000  0.000  0.500  1.0
  In  In14  1  0.500  0.500  0.500  1.0
  In  In15  1  0.500  0.000  0.000  1.0
  Cl  Cl16  1  0.294  0.496  0.349  1.0
  Cl  Cl17  1  0.989  0.372  0.885  1.0
  Cl  Cl18  1  0.716  0.408  0.102  1.0
  Cl  Cl19  1  0.137  0.190  0.499  1.0
  Cl  Cl20  1  0.290  0.394  0.653  1.0
  Cl  Cl21  1  0.790  0.106  0.347  1.0
  Cl  Cl22  1  0.822  0.652  0.862  1.0
  Cl  Cl23  1  0.011  0.628  0.115  1.0
  Cl  Cl24  1  0.794  0.004  0.651  1.0
  Cl  Cl25  1  0.178  0.348  0.138  1.0
  Cl  Cl26  1  0.863  0.810  0.501  1.0
  Cl  Cl27  1  0.363  0.690  0.499  1.0
  Cl  Cl28  1  0.511  0.872  0.885  1.0
  Cl  Cl29  1  0.489  0.128  0.115  1.0
  Cl  Cl30  1  0.322  0.848  0.138  1.0
  Cl  Cl31  1  0.784  0.908  0.102  1.0
  Cl  Cl32  1  0.206  0.996  0.349  1.0
  Cl  Cl33  1  0.210  0.894  0.653  1.0
  Cl  Cl34  1  0.284  0.592  0.898  1.0
  Cl  Cl35  1  0.706  0.504  0.651  1.0
  Cl  Cl36  1  0.678  0.152  0.862  1.0
  Cl  Cl37  1  0.216  0.092  0.898  1.0
  Cl  Cl38  1  0.637  0.310  0.501  1.0
  Cl  Cl39  1  0.710  0.606  0.347  1.0
[/CIF]
.