The material structure described by PdAg(O3I)3 crystallizes in the triclinic P-1 space group. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a square co-planar geometry to two equivalent O(1) and two equivalent O(4) atoms. In the second Pd site, Pd(2) is bonded in a square co-planar geometry to two equivalent O(2) and two equivalent O(7) atoms. Ag(1) is bonded in a 4-coordinate geometry to one O(1), one O(6), one O(8), and one O(9) atom. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Pd(1), one Ag(1), and one I(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Pd(2) and one I(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one I(1) and one I(3) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Pd(1) and one I(2) atom. In the fifth O site, O(5) is bonded in a single-bond geometry to one I(2) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Ag(1) and one I(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Pd(2) and one I(3) atom. In the eighth O site, O(8) is bonded in a water-like geometry to one Ag(1) and one I(3) atom. In the ninth O site, O(9) is bonded in a distorted bent 120 degrees geometry to one Ag(1) and one I(3) atom. There are three inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(1), one O(2), and one O(3) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. In the third I site, I(3) is bonded in a 3-coordinate geometry to one O(3), one O(7), one O(8), and one O(9) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AgPd(IO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.473
_cell_length_b   8.197
_cell_length_c   8.787
_cell_angle_alpha   62.867
_cell_angle_beta   76.422
_cell_angle_gamma   82.227
_symmetry_Int_Tables_number   1
_cell_volume   465.418
_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
  Ag  Ag0  1  0.318  0.174  0.161  1.0
  Ag  Ag1  1  0.682  0.826  0.839  1.0
  Pd  Pd2  1  0.000  0.000  0.500  1.0
  Pd  Pd3  1  0.000  0.000  0.000  1.0
  I  I4  1  0.279  0.206  0.603  1.0
  I  I5  1  0.721  0.794  0.397  1.0
  I  I6  1  0.251  0.645  0.767  1.0
  I  I7  1  0.749  0.355  0.233  1.0
  I  I8  1  0.694  0.283  0.786  1.0
  I  I9  1  0.306  0.717  0.214  1.0
  O  O10  1  0.140  0.223  0.443  1.0
  O  O11  1  0.860  0.777  0.557  1.0
  O  O12  1  0.078  0.222  0.772  1.0
  O  O13  1  0.922  0.778  0.228  1.0
  O  O14  1  0.316  0.448  0.508  1.0
  O  O15  1  0.684  0.552  0.492  1.0
  O  O16  1  0.091  0.858  0.730  1.0
  O  O17  1  0.909  0.142  0.270  1.0
  O  O18  1  0.215  0.560  0.001  1.0
  O  O19  1  0.785  0.440  0.999  1.0
  O  O20  1  0.469  0.767  0.686  1.0
  O  O21  1  0.531  0.233  0.314  1.0
  O  O22  1  0.728  0.067  0.987  1.0
  O  O23  1  0.272  0.933  0.013  1.0
  O  O24  1  0.670  0.164  0.659  1.0
  O  O25  1  0.330  0.836  0.341  1.0
  O  O26  1  0.449  0.323  0.863  1.0
  O  O27  1  0.551  0.677  0.137  1.0
[/CIF]
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The material structure described by PdAg(O3I)3 crystallizes in the triclinic P-1 space group. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a square co-planar geometry to two equivalent O(1) and two equivalent O(4) atoms. In the second Pd site, Pd(2) is bonded in a square co-planar geometry to two equivalent O(2) and two equivalent O(7) atoms. Ag(1) is bonded in a 4-coordinate geometry to one O(1), one O(6), one O(8), and one O(9) atom. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Pd(1), one Ag(1), and one I(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Pd(2) and one I(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one I(1) and one I(3) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Pd(1) and one I(2) atom. In the fifth O site, O(5) is bonded in a single-bond geometry to one I(2) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Ag(1) and one I(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Pd(2) and one I(3) atom. In the eighth O site, O(8) is bonded in a water-like geometry to one Ag(1) and one I(3) atom. In the ninth O site, O(9) is bonded in a distorted bent 120 degrees geometry to one Ag(1) and one I(3) atom. There are three inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(1), one O(2), and one O(3) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. In the third I site, I(3) is bonded in a 3-coordinate geometry to one O(3), one O(7), one O(8), and one O(9) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AgPd(IO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.473
_cell_length_b   8.197
_cell_length_c   8.787
_cell_angle_alpha   62.867
_cell_angle_beta   76.422
_cell_angle_gamma   82.227
_symmetry_Int_Tables_number   1
_cell_volume   465.418
_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
  Ag  Ag0  1  0.318  0.174  0.161  1.0
  Ag  Ag1  1  0.682  0.826  0.839  1.0
  Pd  Pd2  1  0.000  0.000  0.500  1.0
  Pd  Pd3  1  0.000  0.000  0.000  1.0
  I  I4  1  0.279  0.206  0.603  1.0
  I  I5  1  0.721  0.794  0.397  1.0
  I  I6  1  0.251  0.645  0.767  1.0
  I  I7  1  0.749  0.355  0.233  1.0
  I  I8  1  0.694  0.283  0.786  1.0
  I  I9  1  0.306  0.717  0.214  1.0
  O  O10  1  0.140  0.223  0.443  1.0
  O  O11  1  0.860  0.777  0.557  1.0
  O  O12  1  0.078  0.222  0.772  1.0
  O  O13  1  0.922  0.778  0.228  1.0
  O  O14  1  0.316  0.448  0.508  1.0
  O  O15  1  0.684  0.552  0.492  1.0
  O  O16  1  0.091  0.858  0.730  1.0
  O  O17  1  0.909  0.142  0.270  1.0
  O  O18  1  0.215  0.560  0.001  1.0
  O  O19  1  0.785  0.440  0.999  1.0
  O  O20  1  0.469  0.767  0.686  1.0
  O  O21  1  0.531  0.233  0.314  1.0
  O  O22  1  0.728  0.067  0.987  1.0
  O  O23  1  0.272  0.933  0.013  1.0
  O  O24  1  0.670  0.164  0.659  1.0
  O  O25  1  0.330  0.836  0.341  1.0
  O  O26  1  0.449  0.323  0.863  1.0
  O  O27  1  0.551  0.677  0.137  1.0
[/CIF]
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