The material described by Zn(IO3)2 crystallizes in the monoclinic P2_1 space group. Zn(1) is bonded in an octahedral geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(2) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(2) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(1) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(1) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(1) atom. There are two inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(1), one O(2), and one O(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zn(IO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.096
_cell_length_b   5.494
_cell_length_c   9.422
_cell_angle_alpha   90.469
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   263.772
_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
  Zn  Zn0  1  0.923  0.768  0.255  1.0
  Zn  Zn1  1  0.423  0.232  0.745  1.0
  I  I2  1  0.486  0.737  0.933  1.0
  I  I3  1  0.986  0.263  0.067  1.0
  I  I4  1  0.003  0.731  0.600  1.0
  I  I5  1  0.503  0.269  0.400  1.0
  O  O6  1  0.688  0.552  0.396  1.0
  O  O7  1  0.188  0.448  0.604  1.0
  O  O8  1  0.633  0.151  0.565  1.0
  O  O9  1  0.133  0.849  0.435  1.0
  O  O10  1  0.705  0.094  0.277  1.0
  O  O11  1  0.205  0.906  0.723  1.0
  O  O12  1  0.199  0.338  0.919  1.0
  O  O13  1  0.699  0.662  0.081  1.0
  O  O14  1  0.143  0.469  0.194  1.0
  O  O15  1  0.643  0.531  0.806  1.0
  O  O16  1  0.156  0.988  0.124  1.0
  O  O17  1  0.656  0.012  0.876  1.0
[/CIF]
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The material described by Zn(IO3)2 crystallizes in the monoclinic P2_1 space group. Zn(1) is bonded in an octahedral geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(2) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(2) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one I(1) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(1) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Zn(1) and one I(1) atom. There are two inequivalent I sites. In the first I site, I(1) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. In the second I site, I(2) is bonded in a 3-coordinate geometry to one O(1), one O(2), and one O(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zn(IO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.096
_cell_length_b   5.494
_cell_length_c   9.422
_cell_angle_alpha   90.469
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   263.772
_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
  Zn  Zn0  1  0.923  0.768  0.255  1.0
  Zn  Zn1  1  0.423  0.232  0.745  1.0
  I  I2  1  0.486  0.737  0.933  1.0
  I  I3  1  0.986  0.263  0.067  1.0
  I  I4  1  0.003  0.731  0.600  1.0
  I  I5  1  0.503  0.269  0.400  1.0
  O  O6  1  0.688  0.552  0.396  1.0
  O  O7  1  0.188  0.448  0.604  1.0
  O  O8  1  0.633  0.151  0.565  1.0
  O  O9  1  0.133  0.849  0.435  1.0
  O  O10  1  0.705  0.094  0.277  1.0
  O  O11  1  0.205  0.906  0.723  1.0
  O  O12  1  0.199  0.338  0.919  1.0
  O  O13  1  0.699  0.662  0.081  1.0
  O  O14  1  0.143  0.469  0.194  1.0
  O  O15  1  0.643  0.531  0.806  1.0
  O  O16  1  0.156  0.988  0.124  1.0
  O  O17  1  0.656  0.012  0.876  1.0
[/CIF]
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