The material described by PdCdF6 is Upper Bainite-derived structured and crystallizes in the trigonal R-3 space group. Pd(1) is bonded to six equivalent F(1) atoms to form PdF6 octahedra that share corners with six equivalent Cd(1)F6 octahedra. The corner-sharing octahedral tilt angles are 49°. Cd(1) is bonded to six equivalent F(1) atoms to form CdF6 octahedra that share corners with six equivalent Pd(1)F6 octahedra. The corner-sharing octahedral tilt angles are 49°. F(1) is bonded in a bent 120 degrees geometry to one Pd(1) and one Cd(1) atom. is represented by the CIF file [CIF]
data_CdPdF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.648
_cell_length_b   5.648
_cell_length_c   5.648
_cell_angle_alpha   53.186
_cell_angle_beta   53.186
_cell_angle_gamma   53.186
_symmetry_Int_Tables_number   1
_cell_volume   107.075
_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
  Cd  Cd0  1  0.500  0.500  0.500  1.0
  Pd  Pd1  1  0.000  0.000  0.000  1.0
  F  F2  1  0.394  0.059  0.779  1.0
  F  F3  1  0.059  0.779  0.394  1.0
  F  F4  1  0.221  0.606  0.941  1.0
  F  F5  1  0.941  0.221  0.606  1.0
  F  F6  1  0.606  0.941  0.221  1.0
  F  F7  1  0.779  0.394  0.059  1.0
[/CIF]
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The material described by PdCdF6 is Upper Bainite-derived structured and crystallizes in the trigonal R-3 space group. Pd(1) is bonded to six equivalent F(1) atoms to form PdF6 octahedra that share corners with six equivalent Cd(1)F6 octahedra. The corner-sharing octahedral tilt angles are 49°. Cd(1) is bonded to six equivalent F(1) atoms to form CdF6 octahedra that share corners with six equivalent Pd(1)F6 octahedra. The corner-sharing octahedral tilt angles are 49°. F(1) is bonded in a bent 120 degrees geometry to one Pd(1) and one Cd(1) atom. is represented by the CIF file [CIF]
data_CdPdF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.648
_cell_length_b   5.648
_cell_length_c   5.648
_cell_angle_alpha   53.186
_cell_angle_beta   53.186
_cell_angle_gamma   53.186
_symmetry_Int_Tables_number   1
_cell_volume   107.075
_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
  Cd  Cd0  1  0.500  0.500  0.500  1.0
  Pd  Pd1  1  0.000  0.000  0.000  1.0
  F  F2  1  0.394  0.059  0.779  1.0
  F  F3  1  0.059  0.779  0.394  1.0
  F  F4  1  0.221  0.606  0.941  1.0
  F  F5  1  0.941  0.221  0.606  1.0
  F  F6  1  0.606  0.941  0.221  1.0
  F  F7  1  0.779  0.394  0.059  1.0
[/CIF]
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