The material structure described by KZnHCl3 crystallizes in the orthorhombic P2_12_12_1 space group. K(1) is bonded to two equivalent Cl(1), two equivalent Cl(2), and two equivalent Cl(3) atoms to form distorted KCl6 pentagonal pyramids that share corners with six equivalent K(1)Cl6 pentagonal pyramids and corners with six equivalent Zn(1)HCl3 tetrahedra. Zn(1) is bonded to one H(1), one Cl(1), one Cl(2), and one Cl(3) atom to form ZnHCl3 tetrahedra that share corners with six equivalent K(1)Cl6 pentagonal pyramids. H(1) is bonded in a single-bond geometry to one Zn(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted trigonal planar geometry to two equivalent K(1) and one Zn(1) atom. In the second Cl site, Cl(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent K(1) and one Zn(1) atom. In the third Cl site, Cl(3) is bonded in a distorted trigonal planar geometry to two equivalent K(1) and one Zn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_KZnHCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.666
_cell_length_b   8.988
_cell_length_c   11.821
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   708.204
_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
  K  K0  1  0.189  0.013  0.007  1.0
  K  K1  1  0.311  0.987  0.507  1.0
  K  K2  1  0.811  0.513  0.493  1.0
  K  K3  1  0.689  0.487  0.993  1.0
  Zn  Zn4  1  0.267  0.391  0.244  1.0
  Zn  Zn5  1  0.233  0.609  0.744  1.0
  Zn  Zn6  1  0.733  0.891  0.256  1.0
  Zn  Zn7  1  0.767  0.109  0.756  1.0
  H  H8  1  0.174  0.567  0.274  1.0
  H  H9  1  0.326  0.433  0.774  1.0
  H  H10  1  0.826  0.067  0.226  1.0
  H  H11  1  0.674  0.933  0.726  1.0
  Cl  Cl12  1  0.099  0.081  0.746  1.0
  Cl  Cl13  1  0.401  0.919  0.246  1.0
  Cl  Cl14  1  0.901  0.581  0.754  1.0
  Cl  Cl15  1  0.599  0.419  0.254  1.0
  Cl  Cl16  1  0.150  0.365  0.067  1.0
  Cl  Cl17  1  0.350  0.635  0.567  1.0
  Cl  Cl18  1  0.850  0.865  0.433  1.0
  Cl  Cl19  1  0.650  0.135  0.933  1.0
  Cl  Cl20  1  0.107  0.273  0.384  1.0
  Cl  Cl21  1  0.393  0.727  0.884  1.0
  Cl  Cl22  1  0.893  0.773  0.116  1.0
  Cl  Cl23  1  0.607  0.227  0.616  1.0
[/CIF]
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The material structure described by KZnHCl3 crystallizes in the orthorhombic P2_12_12_1 space group. K(1) is bonded to two equivalent Cl(1), two equivalent Cl(2), and two equivalent Cl(3) atoms to form distorted KCl6 pentagonal pyramids that share corners with six equivalent K(1)Cl6 pentagonal pyramids and corners with six equivalent Zn(1)HCl3 tetrahedra. Zn(1) is bonded to one H(1), one Cl(1), one Cl(2), and one Cl(3) atom to form ZnHCl3 tetrahedra that share corners with six equivalent K(1)Cl6 pentagonal pyramids. H(1) is bonded in a single-bond geometry to one Zn(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted trigonal planar geometry to two equivalent K(1) and one Zn(1) atom. In the second Cl site, Cl(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent K(1) and one Zn(1) atom. In the third Cl site, Cl(3) is bonded in a distorted trigonal planar geometry to two equivalent K(1) and one Zn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_KZnHCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.666
_cell_length_b   8.988
_cell_length_c   11.821
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   708.204
_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
  K  K0  1  0.189  0.013  0.007  1.0
  K  K1  1  0.311  0.987  0.507  1.0
  K  K2  1  0.811  0.513  0.493  1.0
  K  K3  1  0.689  0.487  0.993  1.0
  Zn  Zn4  1  0.267  0.391  0.244  1.0
  Zn  Zn5  1  0.233  0.609  0.744  1.0
  Zn  Zn6  1  0.733  0.891  0.256  1.0
  Zn  Zn7  1  0.767  0.109  0.756  1.0
  H  H8  1  0.174  0.567  0.274  1.0
  H  H9  1  0.326  0.433  0.774  1.0
  H  H10  1  0.826  0.067  0.226  1.0
  H  H11  1  0.674  0.933  0.726  1.0
  Cl  Cl12  1  0.099  0.081  0.746  1.0
  Cl  Cl13  1  0.401  0.919  0.246  1.0
  Cl  Cl14  1  0.901  0.581  0.754  1.0
  Cl  Cl15  1  0.599  0.419  0.254  1.0
  Cl  Cl16  1  0.150  0.365  0.067  1.0
  Cl  Cl17  1  0.350  0.635  0.567  1.0
  Cl  Cl18  1  0.850  0.865  0.433  1.0
  Cl  Cl19  1  0.650  0.135  0.933  1.0
  Cl  Cl20  1  0.107  0.273  0.384  1.0
  Cl  Cl21  1  0.393  0.727  0.884  1.0
  Cl  Cl22  1  0.893  0.773  0.116  1.0
  Cl  Cl23  1  0.607  0.227  0.616  1.0
[/CIF]
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