The material structure described by Sc2Pd2In crystallizes in the tetragonal P4_2/mnm space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 6-coordinate geometry to six equivalent Pd(1) and four equivalent In(1) atoms. In the second Sc site, Sc(2) is bonded in a 6-coordinate geometry to six equivalent Pd(1) and four equivalent In(1) atoms. Pd(1) is bonded in a 8-coordinate geometry to three equivalent Sc(1), three equivalent Sc(2), and two equivalent In(1) atoms. In(1) is bonded in a 14-coordinate geometry to four equivalent Sc(1), four equivalent Sc(2), four equivalent Pd(1), and two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Sc2InPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.507
_cell_length_b   7.507
_cell_length_c   6.773
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   381.752
_cell_formula_units_Z   4
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
  Sc  Sc0  1  0.161  0.161  0.000  1.0
  Sc  Sc1  1  0.839  0.839  0.000  1.0
  Sc  Sc2  1  0.661  0.339  0.500  1.0
  Sc  Sc3  1  0.339  0.661  0.500  1.0
  Sc  Sc4  1  0.681  0.319  0.000  1.0
  Sc  Sc5  1  0.319  0.681  0.000  1.0
  Sc  Sc6  1  0.819  0.819  0.500  1.0
  Sc  Sc7  1  0.181  0.181  0.500  1.0
  In  In8  1  0.500  0.000  0.250  1.0
  In  In9  1  0.500  0.000  0.750  1.0
  In  In10  1  0.000  0.500  0.250  1.0
  In  In11  1  0.000  0.500  0.750  1.0
  Pd  Pd12  1  0.370  0.370  0.230  1.0
  Pd  Pd13  1  0.630  0.630  0.770  1.0
  Pd  Pd14  1  0.630  0.630  0.230  1.0
  Pd  Pd15  1  0.870  0.130  0.730  1.0
  Pd  Pd16  1  0.870  0.130  0.270  1.0
  Pd  Pd17  1  0.370  0.370  0.770  1.0
  Pd  Pd18  1  0.130  0.870  0.270  1.0
  Pd  Pd19  1  0.130  0.870  0.730  1.0
[/CIF]
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The material structure described by Sc2Pd2In crystallizes in the tetragonal P4_2/mnm space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 6-coordinate geometry to six equivalent Pd(1) and four equivalent In(1) atoms. In the second Sc site, Sc(2) is bonded in a 6-coordinate geometry to six equivalent Pd(1) and four equivalent In(1) atoms. Pd(1) is bonded in a 8-coordinate geometry to three equivalent Sc(1), three equivalent Sc(2), and two equivalent In(1) atoms. In(1) is bonded in a 14-coordinate geometry to four equivalent Sc(1), four equivalent Sc(2), four equivalent Pd(1), and two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Sc2InPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.507
_cell_length_b   7.507
_cell_length_c   6.773
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   381.752
_cell_formula_units_Z   4
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
  Sc  Sc0  1  0.161  0.161  0.000  1.0
  Sc  Sc1  1  0.839  0.839  0.000  1.0
  Sc  Sc2  1  0.661  0.339  0.500  1.0
  Sc  Sc3  1  0.339  0.661  0.500  1.0
  Sc  Sc4  1  0.681  0.319  0.000  1.0
  Sc  Sc5  1  0.319  0.681  0.000  1.0
  Sc  Sc6  1  0.819  0.819  0.500  1.0
  Sc  Sc7  1  0.181  0.181  0.500  1.0
  In  In8  1  0.500  0.000  0.250  1.0
  In  In9  1  0.500  0.000  0.750  1.0
  In  In10  1  0.000  0.500  0.250  1.0
  In  In11  1  0.000  0.500  0.750  1.0
  Pd  Pd12  1  0.370  0.370  0.230  1.0
  Pd  Pd13  1  0.630  0.630  0.770  1.0
  Pd  Pd14  1  0.630  0.630  0.230  1.0
  Pd  Pd15  1  0.870  0.130  0.730  1.0
  Pd  Pd16  1  0.870  0.130  0.270  1.0
  Pd  Pd17  1  0.370  0.370  0.770  1.0
  Pd  Pd18  1  0.130  0.870  0.270  1.0
  Pd  Pd19  1  0.130  0.870  0.730  1.0
[/CIF]
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