The compound described by Pd3In is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. There are three inequivalent Pd sites. In the first Pd site, Pd(3) is bonded to four equivalent Pd(1), four equivalent Pd(2), and four equivalent In(1) atoms to form PdIn4Pd8 cuboctahedra that share corners with four equivalent In(1)Pd12 cuboctahedra, corners with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent In(1)Pd12 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(2)In4Pd8 cuboctahedra, faces with five equivalent Pd(3)In4Pd8 cuboctahedra, and faces with five equivalent In(1)Pd12 cuboctahedra. In the second Pd site, Pd(1) is bonded to four equivalent Pd(1), four equivalent Pd(3), and four equivalent In(1) atoms to form distorted PdIn4Pd8 cuboctahedra that share corners with four equivalent Pd(1)In4Pd8 cuboctahedra, corners with eight equivalent Pd(2)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, edges with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with eight equivalent In(1)Pd12 cuboctahedra, faces with two equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(3)In4Pd8 cuboctahedra, faces with four equivalent In(1)Pd12 cuboctahedra, and faces with eight equivalent Pd(1)In4Pd8 cuboctahedra. In the third Pd site, Pd(2) is bonded to four equivalent Pd(2), four equivalent Pd(3), and four equivalent In(1) atoms to form distorted PdIn4Pd8 cuboctahedra that share corners with four equivalent Pd(2)In4Pd8 cuboctahedra, corners with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with eight equivalent In(1)Pd12 cuboctahedra, faces with two equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(3)In4Pd8 cuboctahedra, faces with four equivalent In(1)Pd12 cuboctahedra, and faces with eight equivalent Pd(2)In4Pd8 cuboctahedra. In(1) is bonded to four equivalent Pd(1), four equivalent Pd(2), and four equivalent Pd(3) atoms to form InPd12 cuboctahedra that share corners with four equivalent Pd(3)In4Pd8 cuboctahedra, corners with eight equivalent In(1)Pd12 cuboctahedra, edges with four equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent In(1)Pd12 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(2)In4Pd8 cuboctahedra, faces with five equivalent Pd(3)In4Pd8 cuboctahedra, and faces with five equivalent In(1)Pd12 cuboctahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_InPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.090
_cell_length_b   4.090
_cell_length_c   8.209
_cell_angle_alpha   104.425
_cell_angle_beta   104.425
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   128.491
_cell_formula_units_Z   2
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  0.875  0.875  0.750  1.0
  In  In1  1  0.125  0.125  0.250  1.0
  Pd  Pd2  1  0.500  0.000  0.000  1.0
  Pd  Pd3  1  0.000  0.500  0.000  1.0
  Pd  Pd4  1  0.250  0.750  0.500  1.0
  Pd  Pd5  1  0.750  0.250  0.500  1.0
  Pd  Pd6  1  0.626  0.626  0.252  1.0
  Pd  Pd7  1  0.374  0.374  0.748  1.0
[/CIF]
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The compound described by Pd3In is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. There are three inequivalent Pd sites. In the first Pd site, Pd(3) is bonded to four equivalent Pd(1), four equivalent Pd(2), and four equivalent In(1) atoms to form PdIn4Pd8 cuboctahedra that share corners with four equivalent In(1)Pd12 cuboctahedra, corners with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent In(1)Pd12 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(2)In4Pd8 cuboctahedra, faces with five equivalent Pd(3)In4Pd8 cuboctahedra, and faces with five equivalent In(1)Pd12 cuboctahedra. In the second Pd site, Pd(1) is bonded to four equivalent Pd(1), four equivalent Pd(3), and four equivalent In(1) atoms to form distorted PdIn4Pd8 cuboctahedra that share corners with four equivalent Pd(1)In4Pd8 cuboctahedra, corners with eight equivalent Pd(2)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, edges with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with eight equivalent In(1)Pd12 cuboctahedra, faces with two equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(3)In4Pd8 cuboctahedra, faces with four equivalent In(1)Pd12 cuboctahedra, and faces with eight equivalent Pd(1)In4Pd8 cuboctahedra. In the third Pd site, Pd(2) is bonded to four equivalent Pd(2), four equivalent Pd(3), and four equivalent In(1) atoms to form distorted PdIn4Pd8 cuboctahedra that share corners with four equivalent Pd(2)In4Pd8 cuboctahedra, corners with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(3)In4Pd8 cuboctahedra, edges with eight equivalent In(1)Pd12 cuboctahedra, faces with two equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(3)In4Pd8 cuboctahedra, faces with four equivalent In(1)Pd12 cuboctahedra, and faces with eight equivalent Pd(2)In4Pd8 cuboctahedra. In(1) is bonded to four equivalent Pd(1), four equivalent Pd(2), and four equivalent Pd(3) atoms to form InPd12 cuboctahedra that share corners with four equivalent Pd(3)In4Pd8 cuboctahedra, corners with eight equivalent In(1)Pd12 cuboctahedra, edges with four equivalent Pd(3)In4Pd8 cuboctahedra, edges with four equivalent In(1)Pd12 cuboctahedra, edges with eight equivalent Pd(1)In4Pd8 cuboctahedra, edges with eight equivalent Pd(2)In4Pd8 cuboctahedra, faces with four equivalent Pd(1)In4Pd8 cuboctahedra, faces with four equivalent Pd(2)In4Pd8 cuboctahedra, faces with five equivalent Pd(3)In4Pd8 cuboctahedra, and faces with five equivalent In(1)Pd12 cuboctahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_InPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.090
_cell_length_b   4.090
_cell_length_c   8.209
_cell_angle_alpha   104.425
_cell_angle_beta   104.425
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   128.491
_cell_formula_units_Z   2
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  0.875  0.875  0.750  1.0
  In  In1  1  0.125  0.125  0.250  1.0
  Pd  Pd2  1  0.500  0.000  0.000  1.0
  Pd  Pd3  1  0.000  0.500  0.000  1.0
  Pd  Pd4  1  0.250  0.750  0.500  1.0
  Pd  Pd5  1  0.750  0.250  0.500  1.0
  Pd  Pd6  1  0.626  0.626  0.252  1.0
  Pd  Pd7  1  0.374  0.374  0.748  1.0
[/CIF]
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