data_Fe2CoPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   2.88
_cell_length_c   5.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CoPd
_chemical_formula_sum   'Fe2 Co1 Pd1'
_cell_volume   47.95
_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
  Fe  Fe1  1  0.44  0.44  0.18  1.0
  Fe  Fe2  1  0.44  0.44  0.59  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.0  0.0  0.88  1.0

data_Fe2CoPd
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.08
_cell_length_b   4.08
_cell_length_c   5.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Fe2CoPd
_chemical_formula_sum   'Fe4 Co2 Pd2'
_cell_volume   95.89
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.44  0.0  0.18  1.0
  Fe  Fe1  2  0.44  0.0  0.59  1.0
  Co  Co2  2  0.0  0.0  0.0  1.0
  Pd  Pd3  2  0.0  0.0  0.88  1.0

Fe Fe Co Pd
Fe Fe Co Pd 0 2 o o o 0 2 o + o 0 2 + o o 0 2 + + o 0 3 o o - 0 3 o + - 0 3 + o - 0 1 o o o 1 2 o o + 1 2 o + + 1 2 + o + 1 3 o o o 1 3 o + o 1 3 + o o 1 3 + + o 1 1 + o o 1 1 o + o 2 3 o o - 
Fe2CoPd crystallizes in the monoclinic Cm space group. There are two inequivalent Fe sites. In the first Fe site, Fe(1) is bonded in a 5-coordinate geometry to one Fe(2) and four equivalent Co(1) atoms. The Fe(1)-Fe(2) bond length is 2.40 Å. There are a spread of Fe(1)-Co(1) bond distances ranging from 2.07-2.49 Å. In the second Fe site, Fe(2) is bonded in a 5-coordinate geometry to one Fe(1) and four equivalent Pd(1) atoms. There are a spread of Fe(2)-Pd(1) bond distances ranging from 2.46-2.83 Å. Co(1) is bonded in a single-bond geometry to four equivalent Fe(1) and one Pd(1) atom. The Co(1)-Pd(1) bond length is 0.67 Å. Pd(1) is bonded in a single-bond geometry to four equivalent Fe(2) and one Co(1) atom.