data_MnTePd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.15
_cell_length_b   3.15
_cell_length_c   7.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnTePd2
_chemical_formula_sum   'Mn1 Te1 Pd2'
_cell_volume   70.59
_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
  Mn  Mn0  1  0.0  0.0  0.56  1.0
  Te  Te3  1  0.13  0.0  0.62  1.0
  Pd  Pd1  1  0.13  0.0  0.11  1.0
  Pd  Pd2  1  0.0  0.0  0.45  1.0

data_MnTePd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   3.15
_cell_length_c   7.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnTePd2
_chemical_formula_sum   'Mn1 Te1 Pd2'
_cell_volume   70.59
_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
  Mn  Mn0  1  0.0  0.0  0.56  1.0
  Te  Te1  1  0.13  0.0  0.62  1.0
  Pd  Pd2  1  0.0  0.0  0.45  1.0
  Pd  Pd3  1  0.13  0.0  0.11  1.0

Mn Te Pd Pd
Mn Te Pd Pd 0 1 o o o 0 2 o o o 0 3 o o o 2 2 o + o 2 2 + o o 2 3 o o o 
MnPd2Te crystallizes in the triclinic P1 space group. Mn(1) is bonded in a distorted bent 150 degrees geometry to one Pd(2) and one Te(1) atom. The Mn(1)-Pd(2) bond length is 0.77 Å. The Mn(1)-Te(1) bond length is 0.58 Å. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 6-coordinate geometry to one Pd(2), four equivalent Pd(1), and one Te(1) atom. The Pd(1)-Pd(2) bond length is 2.45 Å. All Pd(1)-Pd(1) bond lengths are 3.15 Å. The Pd(1)-Te(1) bond length is 3.55 Å. In the second Pd site, Pd(2) is bonded in a single-bond geometry to one Mn(1) and one Pd(1) atom. Te(1) is bonded in a single-bond geometry to one Mn(1) and one Pd(1) atom.