The material structure described by Tb11Pd4In9 crystallizes in the orthorhombic Cmmm space group. There are five inequivalent Tb sites. In the first Tb site, Tb(1) is bonded in a 8-coordinate geometry to two equivalent Pd(1), two equivalent In(2), and four equivalent In(1) atoms. In the second Tb site, Tb(2) is bonded in a distorted body-centered cubic geometry to four equivalent In(1) and four equivalent In(2) atoms. In the third Tb site, Tb(3) is bonded in a 10-coordinate geometry to four equivalent Pd(1), two equivalent In(3), and four equivalent In(1) atoms. In the fourth Tb site, Tb(4) is bonded in a 10-coordinate geometry to four equivalent Pd(1), two equivalent In(3), and four equivalent In(2) atoms. In the fifth Tb site, Tb(5) is bonded in a distorted body-centered cubic geometry to eight equivalent In(2) atoms. Pd(1) is bonded in a 9-coordinate geometry to two equivalent Tb(1), two equivalent Tb(3), two equivalent Tb(4), one In(1), one In(2), and one In(3) atom. There are three inequivalent In sites. In the first In site, In(1) is bonded in a 10-coordinate geometry to two equivalent Tb(2), two equivalent Tb(3), four equivalent Tb(1), one Pd(1), and one In(1) atom. In the second In site, In(2) is bonded in a 10-coordinate geometry to two equivalent Tb(1), two equivalent Tb(2), two equivalent Tb(4), two equivalent Tb(5), one Pd(1), and one In(2) atom. In the third In site, In(3) is bonded to four equivalent Tb(3), four equivalent Tb(4), and four equivalent Pd(1) atoms to form face-sharing InTb8Pd4 cuboctahedra. is represented by the CIF card [CIF]
data_Tb11In9Pd4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.204
_cell_length_b   13.204
_cell_length_c   3.680
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   112.817
_symmetry_Int_Tables_number   1
_cell_volume   591.304
_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
  Tb  Tb0  1  0.414  0.072  0.000  1.0
  Tb  Tb1  1  0.586  0.928  0.000  1.0
  Tb  Tb2  1  0.072  0.414  0.000  1.0
  Tb  Tb3  1  0.928  0.586  0.000  1.0
  Tb  Tb4  1  0.160  0.840  0.000  1.0
  Tb  Tb5  1  0.840  0.160  0.000  1.0
  Tb  Tb6  1  0.372  0.628  0.000  1.0
  Tb  Tb7  1  0.628  0.372  0.000  1.0
  Tb  Tb8  1  0.309  0.309  0.000  1.0
  Tb  Tb9  1  0.691  0.691  0.000  1.0
  Tb  Tb10  1  0.000  0.000  0.000  1.0
  In  In11  1  0.367  0.842  0.500  1.0
  In  In12  1  0.633  0.158  0.500  1.0
  In  In13  1  0.842  0.367  0.500  1.0
  In  In14  1  0.158  0.633  0.500  1.0
  In  In15  1  0.216  0.074  0.500  1.0
  In  In16  1  0.784  0.926  0.500  1.0
  In  In17  1  0.074  0.216  0.500  1.0
  In  In18  1  0.926  0.784  0.500  1.0
  In  In19  1  0.500  0.500  0.500  1.0
  Pd  Pd20  1  0.449  0.246  0.500  1.0
  Pd  Pd21  1  0.551  0.754  0.500  1.0
  Pd  Pd22  1  0.246  0.449  0.500  1.0
  Pd  Pd23  1  0.754  0.551  0.500  1.0
[/CIF]
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The material structure described by Tb11Pd4In9 crystallizes in the orthorhombic Cmmm space group. There are five inequivalent Tb sites. In the first Tb site, Tb(1) is bonded in a 8-coordinate geometry to two equivalent Pd(1), two equivalent In(2), and four equivalent In(1) atoms. In the second Tb site, Tb(2) is bonded in a distorted body-centered cubic geometry to four equivalent In(1) and four equivalent In(2) atoms. In the third Tb site, Tb(3) is bonded in a 10-coordinate geometry to four equivalent Pd(1), two equivalent In(3), and four equivalent In(1) atoms. In the fourth Tb site, Tb(4) is bonded in a 10-coordinate geometry to four equivalent Pd(1), two equivalent In(3), and four equivalent In(2) atoms. In the fifth Tb site, Tb(5) is bonded in a distorted body-centered cubic geometry to eight equivalent In(2) atoms. Pd(1) is bonded in a 9-coordinate geometry to two equivalent Tb(1), two equivalent Tb(3), two equivalent Tb(4), one In(1), one In(2), and one In(3) atom. There are three inequivalent In sites. In the first In site, In(1) is bonded in a 10-coordinate geometry to two equivalent Tb(2), two equivalent Tb(3), four equivalent Tb(1), one Pd(1), and one In(1) atom. In the second In site, In(2) is bonded in a 10-coordinate geometry to two equivalent Tb(1), two equivalent Tb(2), two equivalent Tb(4), two equivalent Tb(5), one Pd(1), and one In(2) atom. In the third In site, In(3) is bonded to four equivalent Tb(3), four equivalent Tb(4), and four equivalent Pd(1) atoms to form face-sharing InTb8Pd4 cuboctahedra. is represented by the CIF card [CIF]
data_Tb11In9Pd4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.204
_cell_length_b   13.204
_cell_length_c   3.680
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   112.817
_symmetry_Int_Tables_number   1
_cell_volume   591.304
_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
  Tb  Tb0  1  0.414  0.072  0.000  1.0
  Tb  Tb1  1  0.586  0.928  0.000  1.0
  Tb  Tb2  1  0.072  0.414  0.000  1.0
  Tb  Tb3  1  0.928  0.586  0.000  1.0
  Tb  Tb4  1  0.160  0.840  0.000  1.0
  Tb  Tb5  1  0.840  0.160  0.000  1.0
  Tb  Tb6  1  0.372  0.628  0.000  1.0
  Tb  Tb7  1  0.628  0.372  0.000  1.0
  Tb  Tb8  1  0.309  0.309  0.000  1.0
  Tb  Tb9  1  0.691  0.691  0.000  1.0
  Tb  Tb10  1  0.000  0.000  0.000  1.0
  In  In11  1  0.367  0.842  0.500  1.0
  In  In12  1  0.633  0.158  0.500  1.0
  In  In13  1  0.842  0.367  0.500  1.0
  In  In14  1  0.158  0.633  0.500  1.0
  In  In15  1  0.216  0.074  0.500  1.0
  In  In16  1  0.784  0.926  0.500  1.0
  In  In17  1  0.074  0.216  0.500  1.0
  In  In18  1  0.926  0.784  0.500  1.0
  In  In19  1  0.500  0.500  0.500  1.0
  Pd  Pd20  1  0.449  0.246  0.500  1.0
  Pd  Pd21  1  0.551  0.754  0.500  1.0
  Pd  Pd22  1  0.246  0.449  0.500  1.0
  Pd  Pd23  1  0.754  0.551  0.500  1.0
[/CIF]
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