data_MoPd2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   5.13
_cell_angle_alpha   97.31
_cell_angle_beta   97.31
_cell_angle_gamma   35.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoPd2Pb
_chemical_formula_sum   'Mo1 Pd2 Pb1'
_cell_volume   70.95
_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
  Mo  Mo0  1  0.0  0.0  0.0  1.0
  Pd  Pd2  1  0.77  0.0  0.14  1.0
  Pd  Pd3  1  0.86  0.0  0.94  1.0
  Pb  Pb1  1  0.31  0.0  0.54  1.0

data_MoPd2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   4.89
_cell_length_c   5.13
_cell_angle_alpha   97.31
_cell_angle_beta   90.0
_cell_angle_gamma   107.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoPd2Pb
_chemical_formula_sum   'Mo1 Pd2 Pb1'
_cell_volume   70.95
_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
  Mo  Mo0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.0  0.14  0.06  1.0
  Pd  Pd2  1  0.0  0.23  0.86  1.0
  Pb  Pb3  1  0.0  0.69  0.46  1.0

Mo Pd Pd Pb
Mo Pd Pd Pb 0 2 - o - 0 1 - o o 0 3 o o o 0 3 o o - 1 2 o o - 1 3 + o o 1 3 o o o 1 3 o o - 2 3 + o + 2 3 + o o 2 3 o o o 3 3 + - o 
MoPd2Pb crystallizes in the triclinic P1 space group. Mo(1) is bonded in a single-bond geometry to one Pd(2) and two equivalent Pb(1) atoms. The Mo(1)-Pd(2) bond length is 0.70 Å. There is one shorter (2.97 Å) and one longer (3.00 Å) Mo(1)-Pb(1) bond length. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 1-coordinate geometry to one Pd(2) and two equivalent Pb(1) atoms. The Pd(1)-Pd(2) bond length is 1.20 Å. There is one shorter (3.16 Å) and one longer (3.19 Å) Pd(1)-Pb(1) bond length. In the second Pd site, Pd(2) is bonded in a distorted single-bond geometry to one Mo(1), one Pd(1), and one Pb(1) atom. The Pd(2)-Pb(1) bond length is 3.16 Å. Pb(1) is bonded in a 7-coordinate geometry to two equivalent Mo(1), one Pd(2), two equivalent Pd(1), and two equivalent Pb(1) atoms. Both Pb(1)-Pb(1) bond lengths are 3.00 Å.