The structure described by IK1 is Molybdenum Carbide MAX Phase-like structured and crystallizes in the orthorhombic Pnma space group. K(1) is bonded to six equivalent I(1) atoms to form a mixture of edge, corner, and face-sharing KI6 octahedra. The corner-sharing octahedral tilt angles range from 44-49°. I(1) is bonded to six equivalent K(1) atoms to form a mixture of distorted edge and corner-sharing IK6 pentagonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_KI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.958
_cell_length_b   4.958
_cell_length_c   8.693
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   119.138
_symmetry_Int_Tables_number   1
_cell_volume   186.640
_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
  I  I0  1  0.343  0.157  0.250  1.0
  I  I1  1  0.657  0.843  0.750  1.0
  K  K2  1  1.000  0.500  0.500  1.0
  K  K3  1  0.000  0.500  0.000  1.0
[/CIF]
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The structure described by IK1 is Molybdenum Carbide MAX Phase-like structured and crystallizes in the orthorhombic Pnma space group. K(1) is bonded to six equivalent I(1) atoms to form a mixture of edge, corner, and face-sharing KI6 octahedra. The corner-sharing octahedral tilt angles range from 44-49°. I(1) is bonded to six equivalent K(1) atoms to form a mixture of distorted edge and corner-sharing IK6 pentagonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_KI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.958
_cell_length_b   4.958
_cell_length_c   8.693
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   119.138
_symmetry_Int_Tables_number   1
_cell_volume   186.640
_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
  I  I0  1  0.343  0.157  0.250  1.0
  I  I1  1  0.657  0.843  0.750  1.0
  K  K2  1  1.000  0.500  0.500  1.0
  K  K3  1  0.000  0.500  0.000  1.0
[/CIF]
.