data_Te2PdW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   122.19
_cell_angle_beta   120.7
_cell_angle_gamma   87.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2PdW
_chemical_formula_sum   'Te2 Pd1 W1'
_cell_volume   78.99
_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
  Te  Te1  1  0.0  0.4  0.76  1.0
  Te  Te2  1  0.35  0.0  0.75  1.0
  Pd  Pd0  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.0  0.51  1.0

data_Te2PdW
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.69
_cell_length_b   4.8
_cell_length_c   4.85
_cell_angle_alpha   119.65
_cell_angle_beta   118.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2PdW
_chemical_formula_sum   'Te2 Pd1 W1'
_cell_volume   78.99
_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
  Te  Te0  1  0.24  0.64  0.64  1.0
  Te  Te1  1  0.6  0.25  0.6  1.0
  Pd  Pd2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.49  0.49  0.49  1.0

Te Te Pd W
Te Te Pd W 0 3 o o o 0 2 o o + 0 2 o + + 1 3 o o o 1 2 + o + 1 2 o o + 2 3 o o - 2 3 o o o 
WPdTe2 crystallizes in the triclinic P1 space group. W(1) is bonded in a distorted water-like geometry to two equivalent Pd(1), one Te(1), and one Te(2) atom. There is one shorter (2.40 Å) and one longer (2.46 Å) W(1)-Pd(1) bond length. The W(1)-Te(1) bond length is 1.66 Å. The W(1)-Te(2) bond length is 1.48 Å. Pd(1) is bonded in a 6-coordinate geometry to two equivalent W(1), two equivalent Te(1), and two equivalent Te(2) atoms. There is one shorter (2.49 Å) and one longer (2.76 Å) Pd(1)-Te(1) bond length. There is one shorter (2.54 Å) and one longer (2.76 Å) Pd(1)-Te(2) bond length. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a distorted single-bond geometry to one W(1) and two equivalent Pd(1) atoms. In the second Te site, Te(2) is bonded in a single-bond geometry to one W(1) and two equivalent Pd(1) atoms.