The material described by Zr(O4Cl)4 is Indium-like structured and crystallizes in the monoclinic Cc space group. The structure is zero-dimensional and consists of four Zr(O4Cl)4 clusters. Zr(1) is bonded in a 6-coordinate geometry to one O(1), one O(12), one O(14), one O(15), one O(5), and one O(6) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in an L-shaped geometry to one Zr(1) and one Cl(3) atom. In the second O site, O(2) is bonded in a single-bond geometry to one Cl(4) atom. In the third O site, O(3) is bonded in a single-bond geometry to one Cl(3) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one O(10) atom. In the fifth O site, O(5) is bonded in a water-like geometry to one Zr(1) and one Cl(4) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one Zr(1) and one Cl(2) atom. In the seventh O site, O(7) is bonded in a single-bond geometry to one Cl(1) atom. In the eighth O site, O(8) is bonded in a single-bond geometry to one Cl(3) atom. In the ninth O site, O(9) is bonded in a single-bond geometry to one Cl(2) atom. In the tenth O site, O(10) is bonded in a distorted water-like geometry to one O(16) and one O(4) atom. In the eleventh O site, O(11) is bonded in a single-bond geometry to one Cl(1) atom. In the twelfth O site, O(12) is bonded in a water-like geometry to one Zr(1) and one Cl(4) atom. In the thirteenth O site, O(13) is bonded in a single-bond geometry to one Cl(2) atom. In the fourteenth O site, O(14) is bonded in a water-like geometry to one Zr(1) and one Cl(3) atom. In the fifteenth O site, O(15) is bonded in a single-bond geometry to one Zr(1) and one O(16) atom. In the sixteenth O site, O(16) is bonded in a 3-coordinate geometry to one O(10), one O(15), and one Cl(1) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a trigonal non-coplanar geometry to one O(11), one O(16), and one O(7) atom. In the second Cl site, Cl(2) is bonded in a trigonal non-coplanar geometry to one O(13), one O(6), and one O(9) atom. In the third Cl site, Cl(3) is bonded in a tetrahedral geometry to one O(1), one O(14), one O(3), and one O(8) atom. In the fourth Cl site, Cl(4) is bonded in a trigonal non-coplanar geometry to one O(12), one O(2), and one O(5) atom. is represented by the CIF card [CIF]
data_Zr(ClO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.271
_cell_length_b   8.271
_cell_length_c   13.876
_cell_angle_alpha   75.165
_cell_angle_beta   75.165
_cell_angle_gamma   63.032
_symmetry_Int_Tables_number   1
_cell_volume   806.977
_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
  Zr  Zr0  1  0.650  0.636  0.900  1.0
  Zr  Zr1  1  0.636  0.650  0.400  1.0
  Cl  Cl2  1  0.996  0.255  0.140  1.0
  Cl  Cl3  1  0.210  0.607  0.963  1.0
  Cl  Cl4  1  0.022  0.599  0.316  1.0
  Cl  Cl5  1  0.599  0.022  0.816  1.0
  Cl  Cl6  1  0.607  0.210  0.463  1.0
  Cl  Cl7  1  0.446  0.938  0.241  1.0
  Cl  Cl8  1  0.255  0.996  0.640  1.0
  Cl  Cl9  1  0.938  0.446  0.741  1.0
  O  O10  1  0.899  0.581  0.261  1.0
  O  O11  1  0.966  0.540  0.639  1.0
  O  O12  1  0.175  0.428  0.337  1.0
  O  O13  1  0.715  0.238  0.966  1.0
  O  O14  1  0.948  0.549  0.818  1.0
  O  O15  1  0.661  0.393  0.414  1.0
  O  O16  1  0.238  0.715  0.466  1.0
  O  O17  1  0.166  0.010  0.743  1.0
  O  O18  1  0.748  0.071  0.767  1.0
  O  O19  1  0.428  0.175  0.837  1.0
  O  O20  1  0.782  0.060  0.482  1.0
  O  O21  1  0.146  0.761  0.546  1.0
  O  O22  1  0.140  0.119  0.565  1.0
  O  O23  1  0.581  0.899  0.761  1.0
  O  O24  1  0.010  0.166  0.243  1.0
  O  O25  1  0.071  0.748  0.267  1.0
  O  O26  1  0.730  0.480  0.774  1.0
  O  O27  1  0.259  0.477  0.056  1.0
  O  O28  1  0.648  0.892  0.918  1.0
  O  O29  1  0.393  0.661  0.914  1.0
  O  O30  1  0.119  0.140  0.065  1.0
  O  O31  1  0.504  0.724  0.526  1.0
  O  O32  1  0.480  0.730  0.274  1.0
  O  O33  1  0.549  0.948  0.318  1.0
  O  O34  1  0.761  0.146  0.046  1.0
  O  O35  1  0.892  0.648  0.418  1.0
  O  O36  1  0.540  0.966  0.139  1.0
  O  O37  1  0.477  0.259  0.556  1.0
  O  O38  1  0.724  0.504  0.026  1.0
  O  O39  1  0.285  0.757  0.633  1.0
  O  O40  1  0.757  0.285  0.133  1.0
  O  O41  1  0.060  0.782  0.982  1.0
[/CIF]
.
The material described by Zr(O4Cl)4 is Indium-like structured and crystallizes in the monoclinic Cc space group. The structure is zero-dimensional and consists of four Zr(O4Cl)4 clusters. Zr(1) is bonded in a 6-coordinate geometry to one O(1), one O(12), one O(14), one O(15), one O(5), and one O(6) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in an L-shaped geometry to one Zr(1) and one Cl(3) atom. In the second O site, O(2) is bonded in a single-bond geometry to one Cl(4) atom. In the third O site, O(3) is bonded in a single-bond geometry to one Cl(3) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one O(10) atom. In the fifth O site, O(5) is bonded in a water-like geometry to one Zr(1) and one Cl(4) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one Zr(1) and one Cl(2) atom. In the seventh O site, O(7) is bonded in a single-bond geometry to one Cl(1) atom. In the eighth O site, O(8) is bonded in a single-bond geometry to one Cl(3) atom. In the ninth O site, O(9) is bonded in a single-bond geometry to one Cl(2) atom. In the tenth O site, O(10) is bonded in a distorted water-like geometry to one O(16) and one O(4) atom. In the eleventh O site, O(11) is bonded in a single-bond geometry to one Cl(1) atom. In the twelfth O site, O(12) is bonded in a water-like geometry to one Zr(1) and one Cl(4) atom. In the thirteenth O site, O(13) is bonded in a single-bond geometry to one Cl(2) atom. In the fourteenth O site, O(14) is bonded in a water-like geometry to one Zr(1) and one Cl(3) atom. In the fifteenth O site, O(15) is bonded in a single-bond geometry to one Zr(1) and one O(16) atom. In the sixteenth O site, O(16) is bonded in a 3-coordinate geometry to one O(10), one O(15), and one Cl(1) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a trigonal non-coplanar geometry to one O(11), one O(16), and one O(7) atom. In the second Cl site, Cl(2) is bonded in a trigonal non-coplanar geometry to one O(13), one O(6), and one O(9) atom. In the third Cl site, Cl(3) is bonded in a tetrahedral geometry to one O(1), one O(14), one O(3), and one O(8) atom. In the fourth Cl site, Cl(4) is bonded in a trigonal non-coplanar geometry to one O(12), one O(2), and one O(5) atom. is represented by the CIF card [CIF]
data_Zr(ClO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.271
_cell_length_b   8.271
_cell_length_c   13.876
_cell_angle_alpha   75.165
_cell_angle_beta   75.165
_cell_angle_gamma   63.032
_symmetry_Int_Tables_number   1
_cell_volume   806.977
_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
  Zr  Zr0  1  0.650  0.636  0.900  1.0
  Zr  Zr1  1  0.636  0.650  0.400  1.0
  Cl  Cl2  1  0.996  0.255  0.140  1.0
  Cl  Cl3  1  0.210  0.607  0.963  1.0
  Cl  Cl4  1  0.022  0.599  0.316  1.0
  Cl  Cl5  1  0.599  0.022  0.816  1.0
  Cl  Cl6  1  0.607  0.210  0.463  1.0
  Cl  Cl7  1  0.446  0.938  0.241  1.0
  Cl  Cl8  1  0.255  0.996  0.640  1.0
  Cl  Cl9  1  0.938  0.446  0.741  1.0
  O  O10  1  0.899  0.581  0.261  1.0
  O  O11  1  0.966  0.540  0.639  1.0
  O  O12  1  0.175  0.428  0.337  1.0
  O  O13  1  0.715  0.238  0.966  1.0
  O  O14  1  0.948  0.549  0.818  1.0
  O  O15  1  0.661  0.393  0.414  1.0
  O  O16  1  0.238  0.715  0.466  1.0
  O  O17  1  0.166  0.010  0.743  1.0
  O  O18  1  0.748  0.071  0.767  1.0
  O  O19  1  0.428  0.175  0.837  1.0
  O  O20  1  0.782  0.060  0.482  1.0
  O  O21  1  0.146  0.761  0.546  1.0
  O  O22  1  0.140  0.119  0.565  1.0
  O  O23  1  0.581  0.899  0.761  1.0
  O  O24  1  0.010  0.166  0.243  1.0
  O  O25  1  0.071  0.748  0.267  1.0
  O  O26  1  0.730  0.480  0.774  1.0
  O  O27  1  0.259  0.477  0.056  1.0
  O  O28  1  0.648  0.892  0.918  1.0
  O  O29  1  0.393  0.661  0.914  1.0
  O  O30  1  0.119  0.140  0.065  1.0
  O  O31  1  0.504  0.724  0.526  1.0
  O  O32  1  0.480  0.730  0.274  1.0
  O  O33  1  0.549  0.948  0.318  1.0
  O  O34  1  0.761  0.146  0.046  1.0
  O  O35  1  0.892  0.648  0.418  1.0
  O  O36  1  0.540  0.966  0.139  1.0
  O  O37  1  0.477  0.259  0.556  1.0
  O  O38  1  0.724  0.504  0.026  1.0
  O  O39  1  0.285  0.757  0.633  1.0
  O  O40  1  0.757  0.285  0.133  1.0
  O  O41  1  0.060  0.782  0.982  1.0
[/CIF]
.