The material described by Pd8Cd43 crystallizes in the trigonal R3m space group. There are four inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a distorted q6 geometry to three equivalent Cd(12), three equivalent Cd(13), three equivalent Cd(6), and three equivalent Cd(8) atoms. In the second Pd site, Pd(2) is bonded in a 11-coordinate geometry to one Cd(12), one Cd(5), one Cd(9), two equivalent Cd(10), two equivalent Cd(11), two equivalent Cd(13), and two equivalent Cd(7) atoms. In the third Pd site, Pd(3) is bonded in a distorted q6 geometry to three equivalent Cd(2), three equivalent Cd(4), three equivalent Cd(5), and three equivalent Cd(9) atoms. In the fourth Pd site, Pd(4) is bonded in a 12-coordinate geometry to one Cd(1), one Cd(4), one Cd(6), one Cd(8), two equivalent Cd(10), two equivalent Cd(2), two equivalent Cd(3), and two equivalent Cd(7) atoms. There are thirteen inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 12-coordinate geometry to three equivalent Pd(4), three equivalent Cd(2), three equivalent Cd(3), and three equivalent Cd(8) atoms. In the second Cd site, Cd(2) is bonded in a 12-coordinate geometry to one Pd(3), two equivalent Pd(4), one Cd(1), one Cd(3), one Cd(9), two equivalent Cd(10), two equivalent Cd(2), and two equivalent Cd(4) atoms. In the third Cd site, Cd(11) is bonded in a 12-coordinate geometry to two equivalent Pd(2), one Cd(12), one Cd(13), one Cd(8), one Cd(9), two equivalent Cd(10), two equivalent Cd(5), and two equivalent Cd(7) atoms. In the fourth Cd site, Cd(3) is bonded in a 12-coordinate geometry to two equivalent Pd(4), one Cd(1), one Cd(2), one Cd(4), one Cd(6), two equivalent Cd(10), two equivalent Cd(7), and two equivalent Cd(8) atoms. In the fifth Cd site, Cd(12) is bonded in a 13-coordinate geometry to one Pd(1), one Pd(2), one Cd(11), one Cd(8), one Cd(9), two equivalent Cd(10), two equivalent Cd(13), two equivalent Cd(6), and two equivalent Cd(7) atoms. In the sixth Cd site, Cd(4) is bonded in a 13-coordinate geometry to one Pd(3), one Pd(4), one Cd(3), one Cd(5), one Cd(6), two equivalent Cd(10), two equivalent Cd(2), two equivalent Cd(7), and two equivalent Cd(9) atoms. In the seventh Cd site, Cd(13) is bonded in a 11-coordinate geometry to one Pd(1), two equivalent Pd(2), one Cd(11), one Cd(6), two equivalent Cd(12), two equivalent Cd(13), and two equivalent Cd(7) atoms. In the eighth Cd site, Cd(5) is bonded in a distorted bent 150 degrees geometry to one Pd(2), one Pd(3), one Cd(4), and two equivalent Cd(11) atoms. In the ninth Cd site, Cd(6) is bonded in a distorted bent 150 degrees geometry to one Pd(1), one Pd(4), one Cd(13), one Cd(3), one Cd(4), and two equivalent Cd(12) atoms. In the tenth Cd site, Cd(7) is bonded in a distorted bent 150 degrees geometry to one Pd(2), one Pd(4), one Cd(11), one Cd(12), one Cd(13), one Cd(3), and one Cd(4) atom. In the eleventh Cd site, Cd(8) is bonded in a 2-coordinate geometry to one Pd(1), one Pd(4), one Cd(1), one Cd(11), one Cd(12), and two equivalent Cd(3) atoms. In the twelfth Cd site, Cd(9) is bonded in a 2-coordinate geometry to one Pd(2), one Pd(3), one Cd(11), one Cd(12), one Cd(2), and two equivalent Cd(4) atoms. In the thirteenth Cd site, Cd(10) is bonded in a 2-coordinate geometry to one Pd(2), one Pd(4), one Cd(11), one Cd(12), one Cd(2), one Cd(3), and one Cd(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cd43Pd8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.050
_cell_length_b   10.050
_cell_length_c   10.050
_cell_angle_alpha   90.102
_cell_angle_beta   90.102
_cell_angle_gamma   90.102
_symmetry_Int_Tables_number   1
_cell_volume   1015.123
_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  0.604  0.604  0.604  1.0
  Cd  Cd1  1  0.605  0.394  0.394  1.0
  Cd  Cd2  1  0.394  0.394  0.605  1.0
  Cd  Cd3  1  0.394  0.605  0.394  1.0
  Cd  Cd4  1  0.500  0.858  0.500  1.0
  Cd  Cd5  1  0.500  0.500  0.858  1.0
  Cd  Cd6  1  0.858  0.500  0.500  1.0
  Cd  Cd7  1  0.497  0.140  0.497  1.0
  Cd  Cd8  1  0.497  0.497  0.140  1.0
  Cd  Cd9  1  0.140  0.497  0.497  1.0
  Cd  Cd10  1  0.054  0.287  0.287  1.0
  Cd  Cd11  1  0.287  0.054  0.287  1.0
  Cd  Cd12  1  0.287  0.287  0.054  1.0
  Cd  Cd13  1  0.050  0.697  0.697  1.0
  Cd  Cd14  1  0.306  0.954  0.696  1.0
  Cd  Cd15  1  0.306  0.696  0.954  1.0
  Cd  Cd16  1  0.954  0.696  0.306  1.0
  Cd  Cd17  1  0.696  0.954  0.306  1.0
  Cd  Cd18  1  0.697  0.697  0.050  1.0
  Cd  Cd19  1  0.954  0.306  0.696  1.0
  Cd  Cd20  1  0.697  0.050  0.697  1.0
  Cd  Cd21  1  0.696  0.306  0.954  1.0
  Cd  Cd22  1  0.548  0.807  0.807  1.0
  Cd  Cd23  1  0.807  0.548  0.807  1.0
  Cd  Cd24  1  0.807  0.807  0.548  1.0
  Cd  Cd25  1  0.541  0.193  0.193  1.0
  Cd  Cd26  1  0.808  0.454  0.195  1.0
  Cd  Cd27  1  0.808  0.195  0.454  1.0
  Cd  Cd28  1  0.454  0.195  0.808  1.0
  Cd  Cd29  1  0.195  0.454  0.808  1.0
  Cd  Cd30  1  0.193  0.193  0.541  1.0
  Cd  Cd31  1  0.454  0.808  0.195  1.0
  Cd  Cd32  1  0.193  0.541  0.193  1.0
  Cd  Cd33  1  0.195  0.808  0.454  1.0
  Cd  Cd34  1  0.004  0.350  0.004  1.0
  Cd  Cd35  1  0.004  0.004  0.350  1.0
  Cd  Cd36  1  0.350  0.004  0.004  1.0
  Cd  Cd37  1  0.000  0.643  0.000  1.0
  Cd  Cd38  1  0.000  0.000  0.643  1.0
  Cd  Cd39  1  0.643  0.000  0.000  1.0
  Cd  Cd40  1  0.107  0.905  0.905  1.0
  Cd  Cd41  1  0.905  0.905  0.107  1.0
  Cd  Cd42  1  0.905  0.107  0.905  1.0
  Pd  Pd43  1  0.832  0.832  0.832  1.0
  Pd  Pd44  1  0.821  0.173  0.173  1.0
  Pd  Pd45  1  0.173  0.173  0.821  1.0
  Pd  Pd46  1  0.173  0.821  0.173  1.0
  Pd  Pd47  1  0.329  0.329  0.329  1.0
  Pd  Pd48  1  0.329  0.672  0.672  1.0
  Pd  Pd49  1  0.672  0.672  0.329  1.0
  Pd  Pd50  1  0.672  0.329  0.672  1.0
[/CIF]
.
The material described by Pd8Cd43 crystallizes in the trigonal R3m space group. There are four inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a distorted q6 geometry to three equivalent Cd(12), three equivalent Cd(13), three equivalent Cd(6), and three equivalent Cd(8) atoms. In the second Pd site, Pd(2) is bonded in a 11-coordinate geometry to one Cd(12), one Cd(5), one Cd(9), two equivalent Cd(10), two equivalent Cd(11), two equivalent Cd(13), and two equivalent Cd(7) atoms. In the third Pd site, Pd(3) is bonded in a distorted q6 geometry to three equivalent Cd(2), three equivalent Cd(4), three equivalent Cd(5), and three equivalent Cd(9) atoms. In the fourth Pd site, Pd(4) is bonded in a 12-coordinate geometry to one Cd(1), one Cd(4), one Cd(6), one Cd(8), two equivalent Cd(10), two equivalent Cd(2), two equivalent Cd(3), and two equivalent Cd(7) atoms. There are thirteen inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 12-coordinate geometry to three equivalent Pd(4), three equivalent Cd(2), three equivalent Cd(3), and three equivalent Cd(8) atoms. In the second Cd site, Cd(2) is bonded in a 12-coordinate geometry to one Pd(3), two equivalent Pd(4), one Cd(1), one Cd(3), one Cd(9), two equivalent Cd(10), two equivalent Cd(2), and two equivalent Cd(4) atoms. In the third Cd site, Cd(11) is bonded in a 12-coordinate geometry to two equivalent Pd(2), one Cd(12), one Cd(13), one Cd(8), one Cd(9), two equivalent Cd(10), two equivalent Cd(5), and two equivalent Cd(7) atoms. In the fourth Cd site, Cd(3) is bonded in a 12-coordinate geometry to two equivalent Pd(4), one Cd(1), one Cd(2), one Cd(4), one Cd(6), two equivalent Cd(10), two equivalent Cd(7), and two equivalent Cd(8) atoms. In the fifth Cd site, Cd(12) is bonded in a 13-coordinate geometry to one Pd(1), one Pd(2), one Cd(11), one Cd(8), one Cd(9), two equivalent Cd(10), two equivalent Cd(13), two equivalent Cd(6), and two equivalent Cd(7) atoms. In the sixth Cd site, Cd(4) is bonded in a 13-coordinate geometry to one Pd(3), one Pd(4), one Cd(3), one Cd(5), one Cd(6), two equivalent Cd(10), two equivalent Cd(2), two equivalent Cd(7), and two equivalent Cd(9) atoms. In the seventh Cd site, Cd(13) is bonded in a 11-coordinate geometry to one Pd(1), two equivalent Pd(2), one Cd(11), one Cd(6), two equivalent Cd(12), two equivalent Cd(13), and two equivalent Cd(7) atoms. In the eighth Cd site, Cd(5) is bonded in a distorted bent 150 degrees geometry to one Pd(2), one Pd(3), one Cd(4), and two equivalent Cd(11) atoms. In the ninth Cd site, Cd(6) is bonded in a distorted bent 150 degrees geometry to one Pd(1), one Pd(4), one Cd(13), one Cd(3), one Cd(4), and two equivalent Cd(12) atoms. In the tenth Cd site, Cd(7) is bonded in a distorted bent 150 degrees geometry to one Pd(2), one Pd(4), one Cd(11), one Cd(12), one Cd(13), one Cd(3), and one Cd(4) atom. In the eleventh Cd site, Cd(8) is bonded in a 2-coordinate geometry to one Pd(1), one Pd(4), one Cd(1), one Cd(11), one Cd(12), and two equivalent Cd(3) atoms. In the twelfth Cd site, Cd(9) is bonded in a 2-coordinate geometry to one Pd(2), one Pd(3), one Cd(11), one Cd(12), one Cd(2), and two equivalent Cd(4) atoms. In the thirteenth Cd site, Cd(10) is bonded in a 2-coordinate geometry to one Pd(2), one Pd(4), one Cd(11), one Cd(12), one Cd(2), one Cd(3), and one Cd(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cd43Pd8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.050
_cell_length_b   10.050
_cell_length_c   10.050
_cell_angle_alpha   90.102
_cell_angle_beta   90.102
_cell_angle_gamma   90.102
_symmetry_Int_Tables_number   1
_cell_volume   1015.123
_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  0.604  0.604  0.604  1.0
  Cd  Cd1  1  0.605  0.394  0.394  1.0
  Cd  Cd2  1  0.394  0.394  0.605  1.0
  Cd  Cd3  1  0.394  0.605  0.394  1.0
  Cd  Cd4  1  0.500  0.858  0.500  1.0
  Cd  Cd5  1  0.500  0.500  0.858  1.0
  Cd  Cd6  1  0.858  0.500  0.500  1.0
  Cd  Cd7  1  0.497  0.140  0.497  1.0
  Cd  Cd8  1  0.497  0.497  0.140  1.0
  Cd  Cd9  1  0.140  0.497  0.497  1.0
  Cd  Cd10  1  0.054  0.287  0.287  1.0
  Cd  Cd11  1  0.287  0.054  0.287  1.0
  Cd  Cd12  1  0.287  0.287  0.054  1.0
  Cd  Cd13  1  0.050  0.697  0.697  1.0
  Cd  Cd14  1  0.306  0.954  0.696  1.0
  Cd  Cd15  1  0.306  0.696  0.954  1.0
  Cd  Cd16  1  0.954  0.696  0.306  1.0
  Cd  Cd17  1  0.696  0.954  0.306  1.0
  Cd  Cd18  1  0.697  0.697  0.050  1.0
  Cd  Cd19  1  0.954  0.306  0.696  1.0
  Cd  Cd20  1  0.697  0.050  0.697  1.0
  Cd  Cd21  1  0.696  0.306  0.954  1.0
  Cd  Cd22  1  0.548  0.807  0.807  1.0
  Cd  Cd23  1  0.807  0.548  0.807  1.0
  Cd  Cd24  1  0.807  0.807  0.548  1.0
  Cd  Cd25  1  0.541  0.193  0.193  1.0
  Cd  Cd26  1  0.808  0.454  0.195  1.0
  Cd  Cd27  1  0.808  0.195  0.454  1.0
  Cd  Cd28  1  0.454  0.195  0.808  1.0
  Cd  Cd29  1  0.195  0.454  0.808  1.0
  Cd  Cd30  1  0.193  0.193  0.541  1.0
  Cd  Cd31  1  0.454  0.808  0.195  1.0
  Cd  Cd32  1  0.193  0.541  0.193  1.0
  Cd  Cd33  1  0.195  0.808  0.454  1.0
  Cd  Cd34  1  0.004  0.350  0.004  1.0
  Cd  Cd35  1  0.004  0.004  0.350  1.0
  Cd  Cd36  1  0.350  0.004  0.004  1.0
  Cd  Cd37  1  0.000  0.643  0.000  1.0
  Cd  Cd38  1  0.000  0.000  0.643  1.0
  Cd  Cd39  1  0.643  0.000  0.000  1.0
  Cd  Cd40  1  0.107  0.905  0.905  1.0
  Cd  Cd41  1  0.905  0.905  0.107  1.0
  Cd  Cd42  1  0.905  0.107  0.905  1.0
  Pd  Pd43  1  0.832  0.832  0.832  1.0
  Pd  Pd44  1  0.821  0.173  0.173  1.0
  Pd  Pd45  1  0.173  0.173  0.821  1.0
  Pd  Pd46  1  0.173  0.821  0.173  1.0
  Pd  Pd47  1  0.329  0.329  0.329  1.0
  Pd  Pd48  1  0.329  0.672  0.672  1.0
  Pd  Pd49  1  0.672  0.672  0.329  1.0
  Pd  Pd50  1  0.672  0.329  0.672  1.0
[/CIF]
.