data_Cd2TePd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17
_cell_length_b   5.17
_cell_length_c   6.71
_cell_angle_alpha   109.88
_cell_angle_beta   109.88
_cell_angle_gamma   36.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2TePd
_chemical_formula_sum   'Cd2 Te1 Pd1'
_cell_volume   98.36
_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  0.71  0.0  0.22  1.0
  Cd  Cd1  1  0.03  0.0  0.99  1.0
  Te  Te3  1  0.89  0.0  0.68  1.0
  Pd  Pd2  1  0.34  0.0  0.5  1.0

data_Cd2TePd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   5.17
_cell_length_c   6.71
_cell_angle_alpha   109.88
_cell_angle_beta   90.0
_cell_angle_gamma   108.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2TePd
_chemical_formula_sum   'Cd2 Te1 Pd1'
_cell_volume   98.36
_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  0.0  0.29  0.78  1.0
  Cd  Cd1  1  0.0  0.97  0.01  1.0
  Te  Te2  1  0.0  0.11  0.32  1.0
  Pd  Pd3  1  0.0  0.66  0.5  1.0

Cd Cd Te Pd
Cd Cd Te Pd 0 1 o o - 0 1 + o - 0 3 o o o 0 3 + o o 0 0 + - o 0 2 o o o 1 2 - o o 1 3 o o + 2 3 + o o 2 3 o o o 2 3 + - o 3 3 + - o 
PdCd2Te crystallizes in the triclinic P1 space group. Pd(1) is bonded in a 5-coordinate geometry to one Cd(2), two equivalent Cd(1), and two equivalent Te(1) atoms. The Pd(1)-Cd(2) bond length is 3.20 Å. There is one shorter (3.09 Å) and one longer (3.12 Å) Pd(1)-Cd(1) bond length. There is one shorter (2.70 Å) and one longer (2.98 Å) Pd(1)-Te(1) bond length. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 7-coordinate geometry to two equivalent Pd(1), two equivalent Cd(1), two equivalent Cd(2), and one Te(1) atom. Both Cd(1)-Cd(1) bond lengths are 3.20 Å. There is one shorter (2.58 Å) and one longer (3.35 Å) Cd(1)-Cd(2) bond length. The Cd(1)-Te(1) bond length is 2.91 Å. In the second Cd site, Cd(2) is bonded in a distorted single-bond geometry to one Pd(1), two equivalent Cd(1), and one Te(1) atom. The Cd(2)-Te(1) bond length is 1.96 Å. Te(1) is bonded in a distorted single-bond geometry to two equivalent Pd(1), one Cd(1), and one Cd(2) atom.