The material structure described by Tb5(RuO6)2 crystallizes in the monoclinic C2/m space group. There are three inequivalent Tb sites. In the first Tb site, Tb(1) is bonded to one O(4), two equivalent O(1), and four equivalent O(2) atoms to form distorted TbO7 pentagonal bipyramids that share corners with two equivalent Tb(3)O6 octahedra, corners with two equivalent Ru(1)O6 octahedra,  a cornercorner with one Tb(2)O7 pentagonal bipyramid, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(1)O7 pentagonal bipyramids, and edges with four equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles range from 44-57°. In the second Tb site, Tb(2) is bonded to one O(4), two equivalent O(2), and four equivalent O(1) atoms to form distorted TbO7 pentagonal bipyramids that share corners with two equivalent Tb(3)O6 octahedra,  a cornercorner with one Tb(1)O7 pentagonal bipyramid,  an edgeedge with one Tb(3)O6 octahedra, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(2)O7 pentagonal bipyramids, and edges with four equivalent Tb(1)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 55°. In the third Tb site, Tb(3) is bonded to two equivalent O(3) and four equivalent O(1) atoms to form TbO6 octahedra that share corners with four equivalent Ru(1)O6 octahedra, corners with four equivalent Tb(1)O7 pentagonal bipyramids, corners with four equivalent Tb(2)O7 pentagonal bipyramids, and edges with two equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 48°. Ru(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form RuO6 octahedra that share corners with two equivalent Tb(3)O6 octahedra, corners with two equivalent Tb(1)O7 pentagonal bipyramids, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(1)O7 pentagonal bipyramids, and edges with two equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 48°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Tb(1), one Tb(3), and two equivalent Tb(2) atoms to form OTb4 tetrahedra that share corners with four equivalent O(1)Tb4 tetrahedra, corners with six equivalent O(2)Tb3Ru tetrahedra,  an edgeedge with one O(2)Tb3Ru tetrahedra, and edges with three equivalent O(1)Tb4 tetrahedra. In the second O site, O(2) is bonded to one Tb(2), two equivalent Tb(1), and one Ru(1) atom to form OTb3Ru tetrahedra that share corners with four equivalent O(2)Tb3Ru tetrahedra, corners with six equivalent O(1)Tb4 tetrahedra,  an edgeedge with one O(1)Tb4 tetrahedra, and edges with two equivalent O(2)Tb3Ru tetrahedra. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Tb(3) and two equivalent Ru(1) atoms. In the fourth O site, O(4) is bonded in a rectangular see-saw-like geometry to one Tb(1), one Tb(2), and two equivalent Ru(1) atoms. is represented by the CIF card [CIF]
data_Tb5(RuO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.804
_cell_length_b   6.840
_cell_length_c   7.297
_cell_angle_alpha   105.556
_cell_angle_beta   90.003
_cell_angle_gamma   115.103
_symmetry_Int_Tables_number   1
_cell_volume   250.562
_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  0.692  0.385  0.829  1.0
  Tb  Tb1  1  0.697  0.395  0.361  1.0
  Tb  Tb2  1  0.000  0.000  0.500  1.0
  Tb  Tb3  1  0.303  0.605  0.639  1.0
  Tb  Tb4  1  0.308  0.615  0.171  1.0
  Ru  Ru5  1  0.252  1.000  0.000  1.0
  Ru  Ru6  1  0.748  0.000  1.000  1.0
  O  O7  1  0.403  0.308  0.575  1.0
  O  O8  1  0.574  0.674  0.918  1.0
  O  O9  1  0.900  0.326  0.082  1.0
  O  O10  1  0.095  0.692  0.425  1.0
  O  O11  1  0.000  0.001  0.183  1.0
  O  O12  1  0.500  0.000  0.803  1.0
  O  O13  1  0.905  0.308  0.575  1.0
  O  O14  1  0.100  0.674  0.918  1.0
  O  O15  1  0.426  0.326  0.082  1.0
  O  O16  1  0.597  0.692  0.425  1.0
  O  O17  1  0.500  1.000  0.197  1.0
  O  O18  1  1.000  0.999  0.817  1.0
[/CIF]
.
The material structure described by Tb5(RuO6)2 crystallizes in the monoclinic C2/m space group. There are three inequivalent Tb sites. In the first Tb site, Tb(1) is bonded to one O(4), two equivalent O(1), and four equivalent O(2) atoms to form distorted TbO7 pentagonal bipyramids that share corners with two equivalent Tb(3)O6 octahedra, corners with two equivalent Ru(1)O6 octahedra,  a cornercorner with one Tb(2)O7 pentagonal bipyramid, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(1)O7 pentagonal bipyramids, and edges with four equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles range from 44-57°. In the second Tb site, Tb(2) is bonded to one O(4), two equivalent O(2), and four equivalent O(1) atoms to form distorted TbO7 pentagonal bipyramids that share corners with two equivalent Tb(3)O6 octahedra,  a cornercorner with one Tb(1)O7 pentagonal bipyramid,  an edgeedge with one Tb(3)O6 octahedra, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(2)O7 pentagonal bipyramids, and edges with four equivalent Tb(1)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 55°. In the third Tb site, Tb(3) is bonded to two equivalent O(3) and four equivalent O(1) atoms to form TbO6 octahedra that share corners with four equivalent Ru(1)O6 octahedra, corners with four equivalent Tb(1)O7 pentagonal bipyramids, corners with four equivalent Tb(2)O7 pentagonal bipyramids, and edges with two equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 48°. Ru(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form RuO6 octahedra that share corners with two equivalent Tb(3)O6 octahedra, corners with two equivalent Tb(1)O7 pentagonal bipyramids, edges with two equivalent Ru(1)O6 octahedra, edges with two equivalent Tb(1)O7 pentagonal bipyramids, and edges with two equivalent Tb(2)O7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 48°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Tb(1), one Tb(3), and two equivalent Tb(2) atoms to form OTb4 tetrahedra that share corners with four equivalent O(1)Tb4 tetrahedra, corners with six equivalent O(2)Tb3Ru tetrahedra,  an edgeedge with one O(2)Tb3Ru tetrahedra, and edges with three equivalent O(1)Tb4 tetrahedra. In the second O site, O(2) is bonded to one Tb(2), two equivalent Tb(1), and one Ru(1) atom to form OTb3Ru tetrahedra that share corners with four equivalent O(2)Tb3Ru tetrahedra, corners with six equivalent O(1)Tb4 tetrahedra,  an edgeedge with one O(1)Tb4 tetrahedra, and edges with two equivalent O(2)Tb3Ru tetrahedra. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Tb(3) and two equivalent Ru(1) atoms. In the fourth O site, O(4) is bonded in a rectangular see-saw-like geometry to one Tb(1), one Tb(2), and two equivalent Ru(1) atoms. is represented by the CIF card [CIF]
data_Tb5(RuO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.804
_cell_length_b   6.840
_cell_length_c   7.297
_cell_angle_alpha   105.556
_cell_angle_beta   90.003
_cell_angle_gamma   115.103
_symmetry_Int_Tables_number   1
_cell_volume   250.562
_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  0.692  0.385  0.829  1.0
  Tb  Tb1  1  0.697  0.395  0.361  1.0
  Tb  Tb2  1  0.000  0.000  0.500  1.0
  Tb  Tb3  1  0.303  0.605  0.639  1.0
  Tb  Tb4  1  0.308  0.615  0.171  1.0
  Ru  Ru5  1  0.252  1.000  0.000  1.0
  Ru  Ru6  1  0.748  0.000  1.000  1.0
  O  O7  1  0.403  0.308  0.575  1.0
  O  O8  1  0.574  0.674  0.918  1.0
  O  O9  1  0.900  0.326  0.082  1.0
  O  O10  1  0.095  0.692  0.425  1.0
  O  O11  1  0.000  0.001  0.183  1.0
  O  O12  1  0.500  0.000  0.803  1.0
  O  O13  1  0.905  0.308  0.575  1.0
  O  O14  1  0.100  0.674  0.918  1.0
  O  O15  1  0.426  0.326  0.082  1.0
  O  O16  1  0.597  0.692  0.425  1.0
  O  O17  1  0.500  1.000  0.197  1.0
  O  O18  1  1.000  0.999  0.817  1.0
[/CIF]
.