data_InPdPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   4.56
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InPdPt2
_chemical_formula_sum   'In1 Pd1 Pt2'
_cell_volume   67.12
_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
  In  In0  1  0.84  0.84  0.84  1.0
  Pd  Pd1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.61  0.61  0.61  1.0
  Pt  Pt3  1  0.23  0.23  0.23  1.0

data_InPdPt2
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   11.17
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   InPdPt2
_chemical_formula_sum   'In3 Pd3 Pt6'
_cell_volume   201.37
_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
  In  In0  3  0.0  0.0  0.16  1.0
  Pd  Pd1  3  0.0  0.0  0.0  1.0
  Pt  Pt2  3  0.0  0.0  0.39  1.0
  Pt  Pt3  3  0.0  0.0  0.77  1.0

In Pd Pt Pt
Pt2PdIn crystallizes in the trigonal R3m space group. There are two inequivalent Pt sites. In the first Pt site, Pt(1) is bonded in a distorted single-bond geometry to three equivalent Pt(2) and one In(1) atom. All Pt(1)-Pt(2) bond lengths are 2.70 Å. The Pt(1)-In(1) bond length is 2.52 Å. In the second Pt site, Pt(2) is bonded in a 10-coordinate geometry to three equivalent Pt(1), four equivalent Pd(1), and three equivalent In(1) atoms. There is one shorter (2.52 Å) and three longer (2.90 Å) Pt(2)-Pd(1) bond lengths. All Pt(2)-In(1) bond lengths are 2.70 Å. Pd(1) is bonded in a distorted single-bond geometry to four equivalent Pt(2) and one In(1) atom. The Pd(1)-In(1) bond length is 1.81 Å. In(1) is bonded in a 1-coordinate geometry to one Pt(1), three equivalent Pt(2), and one Pd(1) atom.