The material structure described by Ce6Pd12In5 crystallizes in the hexagonal P6_3/mcm space group. There are four inequivalent Ce sites. In the first Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the second Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the third Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the fourth Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four equivalent Pd(1); and three In(1,1) atoms. There are nine inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 7-coordinate geometry to four Ce(1,1,1); two Pd(2,2); one In(1); and two In(2,2) atoms. In the second Pd site, Pd(2) is bonded in a 11-coordinate geometry to three Ce(1,1); one Pd(2); three Pd(1,1); one In(2); and three In(1,1) atoms. In the third Pd site, Pd(1) is bonded in a 7-coordinate geometry to four equivalent Ce(1); two Pd(2,2); one In(1); and two equivalent In(2) atoms. In the fourth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three Ce(1,1); one Pd(2); three Pd(1,1); one In(2); and three In(1,1) atoms. In the fifth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three equivalent Ce(1); one Pd(2); three equivalent Pd(1); one In(2); and three In(1,1) atoms. In the sixth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three equivalent Ce(1); one Pd(2); three equivalent Pd(1); one In(2); and three In(1,1,1) atoms. In the seventh Pd site, Pd(1) is bonded in a 7-coordinate geometry to four Ce(1,1); two Pd(2,2); one In(1); and two In(2,2) atoms. In the eighth Pd site, Pd(3) is bonded in a distorted octahedral geometry to six equivalent Ce(1) atoms. In the ninth Pd site, Pd(4) is bonded in a 9-coordinate geometry to six Ce(1,1,1,1) and three In(1,1,1) atoms. There are six inequivalent In sites. In the first In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the second In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the third In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six equivalent Pd(1) atoms. In the fourth In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six Pd(1,1) atoms. In the fifth In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the sixth In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six Pd(1,1) atoms. is represented by the CIF card [CIF]
data_Ce6In5Pd12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.278
_cell_length_b   8.278
_cell_length_c   16.319
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   968.547
_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
  Ce  Ce0  1  0.723  0.723  0.622  1.0
  Ce  Ce1  1  0.277  0.000  0.622  1.0
  Ce  Ce2  1  0.000  0.723  0.378  1.0
  Ce  Ce3  1  0.000  0.277  0.622  1.0
  Ce  Ce4  1  0.723  0.000  0.122  1.0
  Ce  Ce5  1  0.723  0.000  0.378  1.0
  Ce  Ce6  1  0.277  0.277  0.122  1.0
  Ce  Ce7  1  0.000  0.277  0.878  1.0
  Ce  Ce8  1  0.723  0.723  0.878  1.0
  Ce  Ce9  1  0.000  0.723  0.122  1.0
  Ce  Ce10  1  0.277  0.000  0.878  1.0
  Ce  Ce11  1  0.277  0.277  0.378  1.0
  In  In12  1  0.632  0.632  0.250  1.0
  In  In13  1  0.632  0.000  0.750  1.0
  In  In14  1  0.667  0.333  0.000  1.0
  In  In15  1  0.000  0.368  0.250  1.0
  In  In16  1  0.333  0.667  0.000  1.0
  In  In17  1  0.368  0.368  0.750  1.0
  In  In18  1  0.667  0.333  0.500  1.0
  In  In19  1  0.368  0.000  0.250  1.0
  In  In20  1  0.333  0.667  0.500  1.0
  In  In21  1  0.000  0.632  0.750  1.0
  Pd  Pd22  1  0.383  0.383  0.571  1.0
  Pd  Pd23  1  0.667  0.333  0.333  1.0
  Pd  Pd24  1  0.383  0.000  0.071  1.0
  Pd  Pd25  1  0.383  0.000  0.429  1.0
  Pd  Pd26  1  0.333  0.667  0.333  1.0
  Pd  Pd27  1  0.000  0.617  0.929  1.0
  Pd  Pd28  1  0.667  0.333  0.667  1.0
  Pd  Pd29  1  0.617  0.000  0.571  1.0
  Pd  Pd30  1  0.333  0.667  0.667  1.0
  Pd  Pd31  1  0.333  0.667  0.167  1.0
  Pd  Pd32  1  0.617  0.000  0.929  1.0
  Pd  Pd33  1  0.333  0.667  0.833  1.0
  Pd  Pd34  1  0.383  0.383  0.929  1.0
  Pd  Pd35  1  0.667  0.333  0.833  1.0
  Pd  Pd36  1  0.617  0.617  0.429  1.0
  Pd  Pd37  1  0.000  0.617  0.571  1.0
  Pd  Pd38  1  0.000  0.000  0.000  1.0
  Pd  Pd39  1  0.617  0.617  0.071  1.0
  Pd  Pd40  1  0.000  0.383  0.429  1.0
  Pd  Pd41  1  0.000  0.383  0.071  1.0
  Pd  Pd42  1  0.000  0.000  0.500  1.0
  Pd  Pd43  1  0.667  0.333  0.167  1.0
  Pd  Pd44  1  0.000  0.000  0.750  1.0
  Pd  Pd45  1  0.000  0.000  0.250  1.0
[/CIF]
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The material structure described by Ce6Pd12In5 crystallizes in the hexagonal P6_3/mcm space group. There are four inequivalent Ce sites. In the first Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the second Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the third Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four Pd(1,1); and three In(1,1,1) atoms. In the fourth Ce site, Ce(1) is bonded in a 8-coordinate geometry to one Pd(3); one Pd(4); two Pd(2,2); four equivalent Pd(1); and three In(1,1) atoms. There are nine inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 7-coordinate geometry to four Ce(1,1,1); two Pd(2,2); one In(1); and two In(2,2) atoms. In the second Pd site, Pd(2) is bonded in a 11-coordinate geometry to three Ce(1,1); one Pd(2); three Pd(1,1); one In(2); and three In(1,1) atoms. In the third Pd site, Pd(1) is bonded in a 7-coordinate geometry to four equivalent Ce(1); two Pd(2,2); one In(1); and two equivalent In(2) atoms. In the fourth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three Ce(1,1); one Pd(2); three Pd(1,1); one In(2); and three In(1,1) atoms. In the fifth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three equivalent Ce(1); one Pd(2); three equivalent Pd(1); one In(2); and three In(1,1) atoms. In the sixth Pd site, Pd(2) is bonded in a 11-coordinate geometry to three equivalent Ce(1); one Pd(2); three equivalent Pd(1); one In(2); and three In(1,1,1) atoms. In the seventh Pd site, Pd(1) is bonded in a 7-coordinate geometry to four Ce(1,1); two Pd(2,2); one In(1); and two In(2,2) atoms. In the eighth Pd site, Pd(3) is bonded in a distorted octahedral geometry to six equivalent Ce(1) atoms. In the ninth Pd site, Pd(4) is bonded in a 9-coordinate geometry to six Ce(1,1,1,1) and three In(1,1,1) atoms. There are six inequivalent In sites. In the first In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the second In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the third In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six equivalent Pd(1) atoms. In the fourth In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six Pd(1,1) atoms. In the fifth In site, In(1) is bonded in a 13-coordinate geometry to six Ce(1,1,1); one Pd(4); two Pd(1,1); and four Pd(2,2,2,2) atoms. In the sixth In site, In(2) is bonded in a distorted body-centered cubic geometry to two equivalent Pd(2) and six Pd(1,1) atoms. is represented by the CIF card [CIF]
data_Ce6In5Pd12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.278
_cell_length_b   8.278
_cell_length_c   16.319
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   968.547
_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
  Ce  Ce0  1  0.723  0.723  0.622  1.0
  Ce  Ce1  1  0.277  0.000  0.622  1.0
  Ce  Ce2  1  0.000  0.723  0.378  1.0
  Ce  Ce3  1  0.000  0.277  0.622  1.0
  Ce  Ce4  1  0.723  0.000  0.122  1.0
  Ce  Ce5  1  0.723  0.000  0.378  1.0
  Ce  Ce6  1  0.277  0.277  0.122  1.0
  Ce  Ce7  1  0.000  0.277  0.878  1.0
  Ce  Ce8  1  0.723  0.723  0.878  1.0
  Ce  Ce9  1  0.000  0.723  0.122  1.0
  Ce  Ce10  1  0.277  0.000  0.878  1.0
  Ce  Ce11  1  0.277  0.277  0.378  1.0
  In  In12  1  0.632  0.632  0.250  1.0
  In  In13  1  0.632  0.000  0.750  1.0
  In  In14  1  0.667  0.333  0.000  1.0
  In  In15  1  0.000  0.368  0.250  1.0
  In  In16  1  0.333  0.667  0.000  1.0
  In  In17  1  0.368  0.368  0.750  1.0
  In  In18  1  0.667  0.333  0.500  1.0
  In  In19  1  0.368  0.000  0.250  1.0
  In  In20  1  0.333  0.667  0.500  1.0
  In  In21  1  0.000  0.632  0.750  1.0
  Pd  Pd22  1  0.383  0.383  0.571  1.0
  Pd  Pd23  1  0.667  0.333  0.333  1.0
  Pd  Pd24  1  0.383  0.000  0.071  1.0
  Pd  Pd25  1  0.383  0.000  0.429  1.0
  Pd  Pd26  1  0.333  0.667  0.333  1.0
  Pd  Pd27  1  0.000  0.617  0.929  1.0
  Pd  Pd28  1  0.667  0.333  0.667  1.0
  Pd  Pd29  1  0.617  0.000  0.571  1.0
  Pd  Pd30  1  0.333  0.667  0.667  1.0
  Pd  Pd31  1  0.333  0.667  0.167  1.0
  Pd  Pd32  1  0.617  0.000  0.929  1.0
  Pd  Pd33  1  0.333  0.667  0.833  1.0
  Pd  Pd34  1  0.383  0.383  0.929  1.0
  Pd  Pd35  1  0.667  0.333  0.833  1.0
  Pd  Pd36  1  0.617  0.617  0.429  1.0
  Pd  Pd37  1  0.000  0.617  0.571  1.0
  Pd  Pd38  1  0.000  0.000  0.000  1.0
  Pd  Pd39  1  0.617  0.617  0.071  1.0
  Pd  Pd40  1  0.000  0.383  0.429  1.0
  Pd  Pd41  1  0.000  0.383  0.071  1.0
  Pd  Pd42  1  0.000  0.000  0.500  1.0
  Pd  Pd43  1  0.667  0.333  0.167  1.0
  Pd  Pd44  1  0.000  0.000  0.750  1.0
  Pd  Pd45  1  0.000  0.000  0.250  1.0
[/CIF]
.