data_Fe5Pd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35
_cell_length_b   5.35
_cell_length_c   3.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5Pd3
_chemical_formula_sum   'Fe5 Pd3'
_cell_volume   107.8
_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
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.88  0.9  0.0  1.0
  Fe  Fe2  1  0.88  0.1  0.0  1.0
  Fe  Fe3  1  0.76  0.12  0.88  1.0
  Fe  Fe4  1  0.76  0.88  0.88  1.0
  Pd  Pd5  1  0.76  0.0  0.0  1.0
  Pd  Pd6  1  0.81  0.0  0.88  1.0
  Pd  Pd7  1  0.71  0.0  0.88  1.0

data_Fe5Pd3
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.77
_cell_length_b   5.35
_cell_length_c   5.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Fe5Pd3
_chemical_formula_sum   'Fe5 Pd3'
_cell_volume   107.81
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Fe  Fe0  2  -0.0  0.1  0.88  1.0
  Fe  Fe1  2  0.88  0.12  0.76  1.0
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.0  0.0  0.76  1.0
  Pd  Pd4  1  0.88  0.0  0.71  1.0
  Pd  Pd5  1  0.88  0.0  0.81  1.0

Fe Fe Fe Fe Fe Pd Pd Pd
Fe5Pd3 is Indium-like structured and crystallizes in the monoclinic Pm space group. The structure is zero-dimensional and consists of one Fe5Pd3 cluster. There are three inequivalent Fe sites. In the first Fe site, Fe(1) is bonded in a 3-coordinate geometry to two equivalent Fe(2) and one Pd(2) atom. Both Fe(1)-Fe(2) bond lengths are 0.83 Å. The Fe(1)-Pd(2) bond length is 1.12 Å. In the second Fe site, Fe(2) is bonded in a distorted single-bond geometry to one Fe(1), one Fe(3), and one Pd(2) atom. The Fe(2)-Fe(3) bond length is 0.79 Å. The Fe(2)-Pd(2) bond length is 0.78 Å. In the third Fe site, Fe(3) is bonded in a 4-coordinate geometry to one Fe(2), one Pd(1), one Pd(2), and one Pd(3) atom. The Fe(3)-Pd(1) bond length is 0.79 Å. The Fe(3)-Pd(2) bond length is 0.71 Å. The Fe(3)-Pd(3) bond length is 0.71 Å. There are three inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a single-bond geometry to two equivalent Fe(3), one Pd(2), and one Pd(3) atom. The Pd(1)-Pd(2) bond length is 0.51 Å. The Pd(1)-Pd(3) bond length is 0.51 Å. In the second Pd site, Pd(2) is bonded in a distorted single-bond geometry to one Fe(1), two equivalent Fe(2), two equivalent Fe(3), one Pd(1), and one Pd(3) atom. The Pd(2)-Pd(3) bond length is 0.51 Å. In the third Pd site, Pd(3) is bonded in a distorted single-bond geometry to two equivalent Fe(3), one Pd(1), and one Pd(2) atom.