The structure described by K2Cu(ClF)2 crystallizes in the tetragonal I4/mmm space group. K(1) is bonded in a distorted single-bond geometry to four equivalent Cl(1) and one F(1) atom. Cu(1) is bonded to four equivalent Cl(1) and two equivalent F(1) atoms to form distorted corner-sharing CuCl4F2 octahedra. The corner-sharing octahedra are not tilted. Cl(1) is bonded to four equivalent K(1) and two equivalent Cu(1) atoms to form a mixture of face, corner, and edge-sharing ClK4Cu2 octahedra. The corner-sharing octahedra are not tilted. F(1) is bonded in a linear geometry to one K(1) and one Cu(1) atom. is represented by the CIF file [CIF]
data_K2Cu(ClF)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.044
_cell_length_b   5.035
_cell_length_c   7.298
_cell_angle_alpha   110.194
_cell_angle_beta   110.234
_cell_angle_gamma   89.964
_symmetry_Int_Tables_number   1
_cell_volume   161.733
_cell_formula_units_Z   1
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  0.651  0.651  0.302  1.0
  K  K1  1  0.349  0.349  0.698  1.0
  Cu  Cu2  1  0.000  0.000  0.000  1.0
  Cl  Cl3  1  0.500  0.000  0.000  1.0
  Cl  Cl4  1  0.000  0.500  0.000  1.0
  F  F5  1  0.849  0.849  0.699  1.0
  F  F6  1  0.151  0.151  0.301  1.0
[/CIF]
.
The structure described by K2Cu(ClF)2 crystallizes in the tetragonal I4/mmm space group. K(1) is bonded in a distorted single-bond geometry to four equivalent Cl(1) and one F(1) atom. Cu(1) is bonded to four equivalent Cl(1) and two equivalent F(1) atoms to form distorted corner-sharing CuCl4F2 octahedra. The corner-sharing octahedra are not tilted. Cl(1) is bonded to four equivalent K(1) and two equivalent Cu(1) atoms to form a mixture of face, corner, and edge-sharing ClK4Cu2 octahedra. The corner-sharing octahedra are not tilted. F(1) is bonded in a linear geometry to one K(1) and one Cu(1) atom. is represented by the CIF file [CIF]
data_K2Cu(ClF)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.044
_cell_length_b   5.035
_cell_length_c   7.298
_cell_angle_alpha   110.194
_cell_angle_beta   110.234
_cell_angle_gamma   89.964
_symmetry_Int_Tables_number   1
_cell_volume   161.733
_cell_formula_units_Z   1
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  0.651  0.651  0.302  1.0
  K  K1  1  0.349  0.349  0.698  1.0
  Cu  Cu2  1  0.000  0.000  0.000  1.0
  Cl  Cl3  1  0.500  0.000  0.000  1.0
  Cl  Cl4  1  0.000  0.500  0.000  1.0
  F  F5  1  0.849  0.849  0.699  1.0
  F  F6  1  0.151  0.151  0.301  1.0
[/CIF]
.