The material described by ZrI4 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one ZrI4 cluster. There are two inequivalent Zr sites. In the first Zr site, Zr(1) is bonded to one I(2), one I(3), one I(5), one I(6), and two equivalent I(1) atoms to form ZrI6 octahedra that share  an edgeedge with one Zr(1)I6 octahedra and  an edgeedge with one Zr(2)I5 trigonal bipyramid. In the second Zr site, Zr(2) is bonded to one I(2), one I(3), one I(4), one I(7), and one I(8) atom to form edge-sharing ZrI5 trigonal bipyramids. There are eight inequivalent I sites. In the first I site, I(1) is bonded in a water-like geometry to two equivalent Zr(1) atoms. In the second I site, I(2) is bonded in a water-like geometry to one Zr(1) and one Zr(2) atom. In the third I site, I(3) is bonded in a water-like geometry to one Zr(1) and one Zr(2) atom. In the fourth I site, I(4) is bonded in a single-bond geometry to one Zr(2) atom. In the fifth I site, I(5) is bonded in a single-bond geometry to one Zr(1) atom. In the sixth I site, I(6) is bonded in a single-bond geometry to one Zr(1) atom. In the seventh I site, I(7) is bonded in a single-bond geometry to one Zr(2) atom. In the eighth I site, I(8) is bonded in a single-bond geometry to one Zr(2) atom. is represented by the CIF file [CIF]
data_ZrI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.428
_cell_length_b   8.396
_cell_length_c   27.022
_cell_angle_alpha   92.761
_cell_angle_beta   90.245
_cell_angle_gamma   89.018
_symmetry_Int_Tables_number   1
_cell_volume   1909.664
_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
  Zr  Zr0  1  0.155  0.877  0.942  1.0
  Zr  Zr1  1  0.845  0.123  0.058  1.0
  Zr  Zr2  1  0.859  0.609  0.827  1.0
  Zr  Zr3  1  0.141  0.391  0.173  1.0
  I  I4  1  0.891  0.129  0.953  1.0
  I  I5  1  0.109  0.871  0.047  1.0
  I  I6  1  0.872  0.650  0.933  1.0
  I  I7  1  0.128  0.350  0.067  1.0
  I  I8  1  0.094  0.886  0.837  1.0
  I  I9  1  0.906  0.114  0.163  1.0
  I  I10  1  0.673  0.801  0.773  1.0
  I  I11  1  0.327  0.199  0.227  1.0
  I  I12  1  0.373  0.111  0.940  1.0
  I  I13  1  0.627  0.889  0.060  1.0
  I  I14  1  0.355  0.620  0.942  1.0
  I  I15  1  0.645  0.380  0.058  1.0
  I  I16  1  0.086  0.444  0.775  1.0
  I  I17  1  0.914  0.556  0.225  1.0
  I  I18  1  0.652  0.367  0.836  1.0
  I  I19  1  0.348  0.633  0.164  1.0
[/CIF]
.
The material described by ZrI4 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one ZrI4 cluster. There are two inequivalent Zr sites. In the first Zr site, Zr(1) is bonded to one I(2), one I(3), one I(5), one I(6), and two equivalent I(1) atoms to form ZrI6 octahedra that share  an edgeedge with one Zr(1)I6 octahedra and  an edgeedge with one Zr(2)I5 trigonal bipyramid. In the second Zr site, Zr(2) is bonded to one I(2), one I(3), one I(4), one I(7), and one I(8) atom to form edge-sharing ZrI5 trigonal bipyramids. There are eight inequivalent I sites. In the first I site, I(1) is bonded in a water-like geometry to two equivalent Zr(1) atoms. In the second I site, I(2) is bonded in a water-like geometry to one Zr(1) and one Zr(2) atom. In the third I site, I(3) is bonded in a water-like geometry to one Zr(1) and one Zr(2) atom. In the fourth I site, I(4) is bonded in a single-bond geometry to one Zr(2) atom. In the fifth I site, I(5) is bonded in a single-bond geometry to one Zr(1) atom. In the sixth I site, I(6) is bonded in a single-bond geometry to one Zr(1) atom. In the seventh I site, I(7) is bonded in a single-bond geometry to one Zr(2) atom. In the eighth I site, I(8) is bonded in a single-bond geometry to one Zr(2) atom. is represented by the CIF file [CIF]
data_ZrI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.428
_cell_length_b   8.396
_cell_length_c   27.022
_cell_angle_alpha   92.761
_cell_angle_beta   90.245
_cell_angle_gamma   89.018
_symmetry_Int_Tables_number   1
_cell_volume   1909.664
_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
  Zr  Zr0  1  0.155  0.877  0.942  1.0
  Zr  Zr1  1  0.845  0.123  0.058  1.0
  Zr  Zr2  1  0.859  0.609  0.827  1.0
  Zr  Zr3  1  0.141  0.391  0.173  1.0
  I  I4  1  0.891  0.129  0.953  1.0
  I  I5  1  0.109  0.871  0.047  1.0
  I  I6  1  0.872  0.650  0.933  1.0
  I  I7  1  0.128  0.350  0.067  1.0
  I  I8  1  0.094  0.886  0.837  1.0
  I  I9  1  0.906  0.114  0.163  1.0
  I  I10  1  0.673  0.801  0.773  1.0
  I  I11  1  0.327  0.199  0.227  1.0
  I  I12  1  0.373  0.111  0.940  1.0
  I  I13  1  0.627  0.889  0.060  1.0
  I  I14  1  0.355  0.620  0.942  1.0
  I  I15  1  0.645  0.380  0.058  1.0
  I  I16  1  0.086  0.444  0.775  1.0
  I  I17  1  0.914  0.556  0.225  1.0
  I  I18  1  0.652  0.367  0.836  1.0
  I  I19  1  0.348  0.633  0.164  1.0
[/CIF]
.