data_SbAs2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   121.53
_cell_angle_beta   121.53
_cell_angle_gamma   87.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbAs2Pd
_chemical_formula_sum   'Sb1 As2 Pd1'
_cell_volume   78.85
_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
  Sb  Sb3  1  0.0  0.37  0.75  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  As  As1  1  0.37  0.0  0.75  1.0
  Pd  Pd2  1  0.0  0.0  0.51  1.0

data_SbAs2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.74
_cell_length_b   4.74
_cell_length_c   4.85
_cell_angle_alpha   119.24
_cell_angle_beta   119.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbAs2Pd
_chemical_formula_sum   'Sb1 As2 Pd1'
_cell_volume   78.85
_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
  Sb  Sb0  1  0.62  0.37  0.62  1.0
  As  As1  1  0.0  0.0  0.0  1.0
  As  As2  1  0.25  0.0  0.62  1.0
  Pd  Pd3  1  0.49  0.0  0.49  1.0

Sb As As Pd
Sb As As Pd 0 3 o o o 0 1 o o + 0 1 o + + 1 2 - o - 1 2 o o - 1 3 o o - 1 3 o o o 2 3 o o o 
PdSbAs2 crystallizes in the triclinic P1 space group. Pd(1) is bonded in a distorted water-like geometry to one Sb(1), one As(2), and two equivalent As(1) atoms. The Pd(1)-Sb(1) bond length is 1.55 Å. The Pd(1)-As(2) bond length is 1.55 Å. There is one shorter (2.38 Å) and one longer (2.47 Å) Pd(1)-As(1) bond length. Sb(1) is bonded in a distorted single-bond geometry to one Pd(1) and two equivalent As(1) atoms. There is one shorter (2.62 Å) and one longer (2.64 Å) Sb(1)-As(1) bond length. There are two inequivalent As sites. In the first As site, As(1) is bonded in a 6-coordinate geometry to two equivalent Pd(1), two equivalent Sb(1), and two equivalent As(2) atoms. There is one shorter (2.62 Å) and one longer (2.64 Å) As(1)-As(2) bond length. In the second As site, As(2) is bonded in a single-bond geometry to one Pd(1) and two equivalent As(1) atoms.