data_NaTe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTe2Pd
_chemical_formula_sum   'Na1 Te2 Pd1'
_cell_volume   93.2
_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
  Na  Na0  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.4  0.4  0.4  1.0
  Te  Te3  1  0.8  0.8  0.8  1.0
  Pd  Pd1  1  0.6  0.6  0.6  1.0

data_NaTe2Pd
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   12.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   NaTe2Pd
_chemical_formula_sum   'Na3 Te6 Pd3'
_cell_volume   279.59
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  Na  Na0  3  0.0  0.0  0.0  1.0
  Te  Te1  3  0.0  0.0  0.2  1.0
  Te  Te2  3  0.0  0.0  0.6  1.0
  Pd  Pd3  3  0.0  0.0  0.4  1.0

Na Te Te Pd
Na Te Te Pd 0 2 - - - 0 2 - - o 0 2 o - - 0 2 - o - 0 3 - - o 0 3 - o - 0 3 o - - 0 1 - o o 0 1 o - o 0 1 o o - 1 3 o - o 1 3 - o o 1 3 o o - 1 3 o o o 1 2 - o o 1 2 o - o 1 2 o o - 2 3 o o o 
NaPdTe2 crystallizes in the trigonal R3m space group. Na(1) is bonded in a 10-coordinate geometry to three equivalent Pd(1), three equivalent Te(1), and four equivalent Te(2) atoms. All Na(1)-Pd(1) bond lengths are 3.06 Å. All Na(1)-Te(1) bond lengths are 3.05 Å. There is one shorter (2.50 Å) and three longer (3.37 Å) Na(1)-Te(2) bond lengths. Pd(1) is bonded in a 5-coordinate geometry to three equivalent Na(1), one Te(1), and one Te(2) atom. The Pd(1)-Te(1) bond length is 2.50 Å. The Pd(1)-Te(2) bond length is 2.50 Å. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to three equivalent Na(1) and one Pd(1) atom to form distorted corner-sharing TeNa3Pd tetrahedra. In the second Te site, Te(2) is bonded in a 1-coordinate geometry to four equivalent Na(1) and one Pd(1) atom.