The material described by (KZnHCl3)2H2 crystallizes in the monoclinic P2_1/c space group. The structure consists of four 1333-74-0 atoms inside a KZnHCl3 framework. In the KZnHCl3 framework, K(1) is bonded in a 7-coordinate geometry to two equivalent Cl(2), two equivalent Cl(3), and three equivalent Cl(1) atoms. Zn(1) is bonded in a tetrahedral geometry to one H(2), one Cl(1), one Cl(2), and one Cl(3) atom. H(2) 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 4-coordinate geometry to three equivalent K(1) and one Zn(1) atom. In the second Cl site, Cl(2) is bonded in a 3-coordinate geometry to two equivalent K(1) and one Zn(1) atom. In the third Cl site, Cl(3) is bonded in a distorted T-shaped geometry to two equivalent K(1) and one Zn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_KZnH2Cl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.322
_cell_length_b   11.230
_cell_length_c   11.625
_cell_angle_alpha   90.000
_cell_angle_beta   108.378
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   783.242
_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  0.767  0.863  0.135  1.0
  K  K1  1  0.233  0.137  0.865  1.0
  K  K2  1  0.733  0.363  0.365  1.0
  K  K3  1  0.267  0.637  0.635  1.0
  Zn  Zn4  1  0.278  0.623  0.304  1.0
  Zn  Zn5  1  0.722  0.377  0.696  1.0
  Zn  Zn6  1  0.222  0.123  0.196  1.0
  Zn  Zn7  1  0.778  0.877  0.804  1.0
  H  H8  1  0.789  0.384  0.070  1.0
  H  H9  1  0.211  0.616  0.930  1.0
  H  H10  1  0.711  0.884  0.430  1.0
  H  H11  1  0.289  0.116  0.570  1.0
  H  H12  1  0.084  0.611  0.164  1.0
  H  H13  1  0.916  0.389  0.836  1.0
  H  H14  1  0.416  0.111  0.336  1.0
  H  H15  1  0.584  0.889  0.664  1.0
  Cl  Cl16  1  0.225  0.453  0.395  1.0
  Cl  Cl17  1  0.775  0.547  0.605  1.0
  Cl  Cl18  1  0.275  0.953  0.105  1.0
  Cl  Cl19  1  0.725  0.047  0.895  1.0
  Cl  Cl20  1  0.574  0.623  0.240  1.0
  Cl  Cl21  1  0.426  0.377  0.760  1.0
  Cl  Cl22  1  0.926  0.123  0.260  1.0
  Cl  Cl23  1  0.074  0.877  0.740  1.0
  Cl  Cl24  1  0.167  0.785  0.380  1.0
  Cl  Cl25  1  0.833  0.215  0.620  1.0
  Cl  Cl26  1  0.333  0.285  0.120  1.0
  Cl  Cl27  1  0.667  0.715  0.880  1.0
[/CIF]
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The material described by (KZnHCl3)2H2 crystallizes in the monoclinic P2_1/c space group. The structure consists of four 1333-74-0 atoms inside a KZnHCl3 framework. In the KZnHCl3 framework, K(1) is bonded in a 7-coordinate geometry to two equivalent Cl(2), two equivalent Cl(3), and three equivalent Cl(1) atoms. Zn(1) is bonded in a tetrahedral geometry to one H(2), one Cl(1), one Cl(2), and one Cl(3) atom. H(2) 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 4-coordinate geometry to three equivalent K(1) and one Zn(1) atom. In the second Cl site, Cl(2) is bonded in a 3-coordinate geometry to two equivalent K(1) and one Zn(1) atom. In the third Cl site, Cl(3) is bonded in a distorted T-shaped geometry to two equivalent K(1) and one Zn(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_KZnH2Cl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.322
_cell_length_b   11.230
_cell_length_c   11.625
_cell_angle_alpha   90.000
_cell_angle_beta   108.378
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   783.242
_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  0.767  0.863  0.135  1.0
  K  K1  1  0.233  0.137  0.865  1.0
  K  K2  1  0.733  0.363  0.365  1.0
  K  K3  1  0.267  0.637  0.635  1.0
  Zn  Zn4  1  0.278  0.623  0.304  1.0
  Zn  Zn5  1  0.722  0.377  0.696  1.0
  Zn  Zn6  1  0.222  0.123  0.196  1.0
  Zn  Zn7  1  0.778  0.877  0.804  1.0
  H  H8  1  0.789  0.384  0.070  1.0
  H  H9  1  0.211  0.616  0.930  1.0
  H  H10  1  0.711  0.884  0.430  1.0
  H  H11  1  0.289  0.116  0.570  1.0
  H  H12  1  0.084  0.611  0.164  1.0
  H  H13  1  0.916  0.389  0.836  1.0
  H  H14  1  0.416  0.111  0.336  1.0
  H  H15  1  0.584  0.889  0.664  1.0
  Cl  Cl16  1  0.225  0.453  0.395  1.0
  Cl  Cl17  1  0.775  0.547  0.605  1.0
  Cl  Cl18  1  0.275  0.953  0.105  1.0
  Cl  Cl19  1  0.725  0.047  0.895  1.0
  Cl  Cl20  1  0.574  0.623  0.240  1.0
  Cl  Cl21  1  0.426  0.377  0.760  1.0
  Cl  Cl22  1  0.926  0.123  0.260  1.0
  Cl  Cl23  1  0.074  0.877  0.740  1.0
  Cl  Cl24  1  0.167  0.785  0.380  1.0
  Cl  Cl25  1  0.833  0.215  0.620  1.0
  Cl  Cl26  1  0.333  0.285  0.120  1.0
  Cl  Cl27  1  0.667  0.715  0.880  1.0
[/CIF]
.