The material structure described by K3In(O3I)6 crystallizes in the triclinic P-1 space group. There are two inequivalent K sites. In the first K site, K(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(8), one O(9), and two equivalent O(6) atoms. In the second K site, K(2) is bonded in a distorted hexagonal bipyramidal geometry to two equivalent O(2), two equivalent O(3), two equivalent O(6), and two equivalent O(7) atoms. In(1) is bonded in an octahedral geometry to two equivalent O(4), two equivalent O(5), and two equivalent O(9) atoms. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one K(1) and one I(2) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one K(1), one K(2), and one I(2) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one K(1), one K(2), one I(1), and one I(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one K(1), one In(1), and one I(3) atom. In the fifth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one In(1) and one I(1) atom. In the sixth O site, O(6) is bonded to one K(2), two equivalent K(1), and one I(3) atom to form a mixture of distorted corner and edge-sharing OK3I trigonal pyramids. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to one K(2), one I(1), and two equivalent I(3) atoms. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one K(1), one I(1), and one I(3) atom. In the ninth O site, O(9) is bonded in a distorted trigonal non-coplanar geometry to one K(1), one In(1), and one I(2) atom. There are three inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(3), one O(5), one O(7), and one O(8) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(1), one O(2), one O(3), and one O(9) atom. In the third I site, I(3) is bonded in a 3-coordinate geometry to one O(4), one O(6), one O(8), and two equivalent O(7) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_K3In(IO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.899
_cell_length_b   7.034
_cell_length_c   10.607
_cell_angle_alpha   98.138
_cell_angle_beta   108.647
_cell_angle_gamma   102.582
_symmetry_Int_Tables_number   1
_cell_volume   463.433
_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
  K  K0  1  0.372  0.536  0.293  1.0
  K  K1  1  0.628  0.464  0.707  1.0
  K  K2  1  0.000  0.500  0.500  1.0
  In  In3  1  0.000  0.000  0.000  1.0
  I  I4  1  0.563  0.034  0.194  1.0
  I  I5  1  0.437  0.966  0.806  1.0
  I  I6  1  0.782  0.530  0.101  1.0
  I  I7  1  0.218  0.470  0.899  1.0
  I  I8  1  0.138  0.056  0.380  1.0
  I  I9  1  0.862  0.944  0.620  1.0
  O  O10  1  0.585  0.651  0.123  1.0
  O  O11  1  0.415  0.349  0.877  1.0
  O  O12  1  0.006  0.356  0.736  1.0
  O  O13  1  0.994  0.644  0.264  1.0
  O  O14  1  0.613  0.303  0.236  1.0
  O  O15  1  0.387  0.697  0.764  1.0
  O  O16  1  0.053  0.114  0.210  1.0
  O  O17  1  0.947  0.886  0.790  1.0
  O  O18  1  0.314  0.963  0.041  1.0
  O  O19  1  0.686  0.037  0.959  1.0
  O  O20  1  0.297  0.305  0.471  1.0
  O  O21  1  0.703  0.695  0.529  1.0
  O  O22  1  0.887  0.076  0.401  1.0
  O  O23  1  0.113  0.924  0.599  1.0
  O  O24  1  0.559  0.036  0.686  1.0
  O  O25  1  0.441  0.964  0.314  1.0
  O  O26  1  0.117  0.321  0.006  1.0
  O  O27  1  0.883  0.679  0.994  1.0
[/CIF]
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The material structure described by K3In(O3I)6 crystallizes in the triclinic P-1 space group. There are two inequivalent K sites. In the first K site, K(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(8), one O(9), and two equivalent O(6) atoms. In the second K site, K(2) is bonded in a distorted hexagonal bipyramidal geometry to two equivalent O(2), two equivalent O(3), two equivalent O(6), and two equivalent O(7) atoms. In(1) is bonded in an octahedral geometry to two equivalent O(4), two equivalent O(5), and two equivalent O(9) atoms. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one K(1) and one I(2) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one K(1), one K(2), and one I(2) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one K(1), one K(2), one I(1), and one I(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one K(1), one In(1), and one I(3) atom. In the fifth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one In(1) and one I(1) atom. In the sixth O site, O(6) is bonded to one K(2), two equivalent K(1), and one I(3) atom to form a mixture of distorted corner and edge-sharing OK3I trigonal pyramids. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to one K(2), one I(1), and two equivalent I(3) atoms. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one K(1), one I(1), and one I(3) atom. In the ninth O site, O(9) is bonded in a distorted trigonal non-coplanar geometry to one K(1), one In(1), and one I(2) atom. There are three inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(3), one O(5), one O(7), and one O(8) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(1), one O(2), one O(3), and one O(9) atom. In the third I site, I(3) is bonded in a 3-coordinate geometry to one O(4), one O(6), one O(8), and two equivalent O(7) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_K3In(IO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.899
_cell_length_b   7.034
_cell_length_c   10.607
_cell_angle_alpha   98.138
_cell_angle_beta   108.647
_cell_angle_gamma   102.582
_symmetry_Int_Tables_number   1
_cell_volume   463.433
_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
  K  K0  1  0.372  0.536  0.293  1.0
  K  K1  1  0.628  0.464  0.707  1.0
  K  K2  1  0.000  0.500  0.500  1.0
  In  In3  1  0.000  0.000  0.000  1.0
  I  I4  1  0.563  0.034  0.194  1.0
  I  I5  1  0.437  0.966  0.806  1.0
  I  I6  1  0.782  0.530  0.101  1.0
  I  I7  1  0.218  0.470  0.899  1.0
  I  I8  1  0.138  0.056  0.380  1.0
  I  I9  1  0.862  0.944  0.620  1.0
  O  O10  1  0.585  0.651  0.123  1.0
  O  O11  1  0.415  0.349  0.877  1.0
  O  O12  1  0.006  0.356  0.736  1.0
  O  O13  1  0.994  0.644  0.264  1.0
  O  O14  1  0.613  0.303  0.236  1.0
  O  O15  1  0.387  0.697  0.764  1.0
  O  O16  1  0.053  0.114  0.210  1.0
  O  O17  1  0.947  0.886  0.790  1.0
  O  O18  1  0.314  0.963  0.041  1.0
  O  O19  1  0.686  0.037  0.959  1.0
  O  O20  1  0.297  0.305  0.471  1.0
  O  O21  1  0.703  0.695  0.529  1.0
  O  O22  1  0.887  0.076  0.401  1.0
  O  O23  1  0.113  0.924  0.599  1.0
  O  O24  1  0.559  0.036  0.686  1.0
  O  O25  1  0.441  0.964  0.314  1.0
  O  O26  1  0.117  0.321  0.006  1.0
  O  O27  1  0.883  0.679  0.994  1.0
[/CIF]
.