data_BiPdRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.59
_cell_length_b   4.59
_cell_length_c   4.59
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiPdRh2
_chemical_formula_sum   'Bi1 Pd1 Rh2'
_cell_volume   68.23
_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
  Bi  Bi0  1  0.62  0.62  0.62  1.0
  Pd  Pd1  1  0.24  0.24  0.24  1.0
  Rh  Rh2  1  0.86  0.86  0.86  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

data_BiPdRh2
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.59
_cell_length_b   4.59
_cell_length_c   11.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   BiPdRh2
_chemical_formula_sum   'Bi3 Pd3 Rh6'
_cell_volume   204.68
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  Bi  Bi0  3  0.0  0.0  0.38  1.0
  Pd  Pd1  3  0.0  0.0  0.76  1.0
  Rh  Rh2  3  0.0  0.0  -0.0  1.0
  Rh  Rh3  3  0.0  0.0  0.14  1.0

Bi Pd Rh Rh
Bi Pd Rh Rh 0 2 o - o 0 2 - o o 0 2 o o - 0 2 o o o 0 1 o o + 0 1 o + o 0 1 + o o 0 3 o + + 0 3 + o + 0 3 + + o 1 3 o o o 1 3 o o + 1 3 + o o 1 3 o + o 1 2 - - o 1 2 - o - 1 2 o - - 2 3 + + + 
Rh2PdBi crystallizes in the trigonal R3m space group. There are two inequivalent Rh sites. In the first Rh site, Rh(1) is bonded in a 1-coordinate geometry to one Rh(2), three equivalent Pd(1), and four equivalent Bi(1) atoms. The Rh(1)-Rh(2) bond length is 1.52 Å. All Rh(1)-Pd(1) bond lengths are 2.70 Å. There is one shorter (2.73 Å) and three longer (2.84 Å) Rh(1)-Bi(1) bond lengths. In the second Rh site, Rh(2) is bonded in a distorted single-bond geometry to one Rh(1), four equivalent Pd(1), and three equivalent Bi(1) atoms. There is one shorter (2.73 Å) and three longer (2.84 Å) Rh(2)-Pd(1) bond lengths. All Rh(2)-Bi(1) bond lengths are 2.70 Å. Pd(1) is bonded in a 10-coordinate geometry to three equivalent Rh(1), four equivalent Rh(2), and three equivalent Bi(1) atoms. All Pd(1)-Bi(1) bond lengths are 2.70 Å. Bi(1) is bonded in a 10-coordinate geometry to three equivalent Rh(2), four equivalent Rh(1), and three equivalent Pd(1) atoms.