The material described by Yb2RuB6 crystallizes in the orthorhombic Pbam space group. There are two inequivalent Yb sites. In the first Yb site, Yb(1) is bonded in a 17-coordinate geometry to three equivalent Ru(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), two equivalent B(5), two equivalent B(6), and four equivalent B(1) atoms. In the second Yb site, Yb(2) is bonded in a 14-coordinate geometry to two equivalent Ru(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), two equivalent B(5), and four equivalent B(6) atoms. Ru(1) is bonded in a 15-coordinate geometry to two equivalent Yb(2), three equivalent Yb(1), two equivalent B(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), and two equivalent B(5) atoms. There are six inequivalent B sites. In the first B site, B(1) is bonded in a 9-coordinate geometry to four equivalent Yb(1), two equivalent Ru(1), one B(1), one B(2), and one B(5) atom. In the second B site, B(2) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(1), one B(3), and one B(6) atom. In the third B site, B(3) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(2), one B(4), and one B(5) atom. In the fourth B site, B(4) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(3), one B(5), and one B(6) atom. In the fifth B site, B(5) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(1), one B(3), and one B(4) atom. In the sixth B site, B(6) is bonded in a 9-coordinate geometry to two equivalent Yb(1), four equivalent Yb(2), one B(2), one B(4), and one B(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Yb2B6Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.700
_cell_length_b   9.040
_cell_length_c   11.334
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   379.075
_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
  Yb  Yb0  1  0.000  0.328  0.413  1.0
  Yb  Yb1  1  0.000  0.672  0.587  1.0
  Yb  Yb2  1  0.000  0.828  0.087  1.0
  Yb  Yb3  1  0.000  0.172  0.913  1.0
  Yb  Yb4  1  0.000  0.945  0.368  1.0
  Yb  Yb5  1  0.000  0.055  0.632  1.0
  Yb  Yb6  1  0.000  0.445  0.132  1.0
  Yb  Yb7  1  0.000  0.555  0.868  1.0
  B  B8  1  0.500  0.555  0.433  1.0
  B  B9  1  0.500  0.445  0.567  1.0
  B  B10  1  0.500  0.055  0.067  1.0
  B  B11  1  0.500  0.945  0.933  1.0
  B  B12  1  0.500  0.752  0.419  1.0
  B  B13  1  0.500  0.248  0.581  1.0
  B  B14  1  0.500  0.252  0.081  1.0
  B  B15  1  0.500  0.748  0.919  1.0
  B  B16  1  0.500  0.796  0.264  1.0
  B  B17  1  0.500  0.204  0.736  1.0
  B  B18  1  0.500  0.296  0.236  1.0
  B  B19  1  0.500  0.704  0.764  1.0
  B  B20  1  0.500  0.634  0.185  1.0
  B  B21  1  0.500  0.366  0.815  1.0
  B  B22  1  0.500  0.134  0.315  1.0
  B  B23  1  0.500  0.866  0.685  1.0
  B  B24  1  0.500  0.984  0.211  1.0
  B  B25  1  0.500  0.016  0.789  1.0
  B  B26  1  0.500  0.484  0.289  1.0
  B  B27  1  0.500  0.516  0.711  1.0
  B  B28  1  0.500  0.596  0.026  1.0
  B  B29  1  0.500  0.404  0.974  1.0
  B  B30  1  0.500  0.096  0.474  1.0
  B  B31  1  0.500  0.904  0.526  1.0
  Ru  Ru32  1  0.000  0.643  0.320  1.0
  Ru  Ru33  1  0.000  0.357  0.680  1.0
  Ru  Ru34  1  0.000  0.143  0.180  1.0
  Ru  Ru35  1  0.000  0.857  0.820  1.0
[/CIF]
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The material described by Yb2RuB6 crystallizes in the orthorhombic Pbam space group. There are two inequivalent Yb sites. In the first Yb site, Yb(1) is bonded in a 17-coordinate geometry to three equivalent Ru(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), two equivalent B(5), two equivalent B(6), and four equivalent B(1) atoms. In the second Yb site, Yb(2) is bonded in a 14-coordinate geometry to two equivalent Ru(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), two equivalent B(5), and four equivalent B(6) atoms. Ru(1) is bonded in a 15-coordinate geometry to two equivalent Yb(2), three equivalent Yb(1), two equivalent B(1), two equivalent B(2), two equivalent B(3), two equivalent B(4), and two equivalent B(5) atoms. There are six inequivalent B sites. In the first B site, B(1) is bonded in a 9-coordinate geometry to four equivalent Yb(1), two equivalent Ru(1), one B(1), one B(2), and one B(5) atom. In the second B site, B(2) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(1), one B(3), and one B(6) atom. In the third B site, B(3) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(2), one B(4), and one B(5) atom. In the fourth B site, B(4) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(3), one B(5), and one B(6) atom. In the fifth B site, B(5) is bonded in a 9-coordinate geometry to two equivalent Yb(1), two equivalent Yb(2), two equivalent Ru(1), one B(1), one B(3), and one B(4) atom. In the sixth B site, B(6) is bonded in a 9-coordinate geometry to two equivalent Yb(1), four equivalent Yb(2), one B(2), one B(4), and one B(6) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Yb2B6Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.700
_cell_length_b   9.040
_cell_length_c   11.334
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   379.075
_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
  Yb  Yb0  1  0.000  0.328  0.413  1.0
  Yb  Yb1  1  0.000  0.672  0.587  1.0
  Yb  Yb2  1  0.000  0.828  0.087  1.0
  Yb  Yb3  1  0.000  0.172  0.913  1.0
  Yb  Yb4  1  0.000  0.945  0.368  1.0
  Yb  Yb5  1  0.000  0.055  0.632  1.0
  Yb  Yb6  1  0.000  0.445  0.132  1.0
  Yb  Yb7  1  0.000  0.555  0.868  1.0
  B  B8  1  0.500  0.555  0.433  1.0
  B  B9  1  0.500  0.445  0.567  1.0
  B  B10  1  0.500  0.055  0.067  1.0
  B  B11  1  0.500  0.945  0.933  1.0
  B  B12  1  0.500  0.752  0.419  1.0
  B  B13  1  0.500  0.248  0.581  1.0
  B  B14  1  0.500  0.252  0.081  1.0
  B  B15  1  0.500  0.748  0.919  1.0
  B  B16  1  0.500  0.796  0.264  1.0
  B  B17  1  0.500  0.204  0.736  1.0
  B  B18  1  0.500  0.296  0.236  1.0
  B  B19  1  0.500  0.704  0.764  1.0
  B  B20  1  0.500  0.634  0.185  1.0
  B  B21  1  0.500  0.366  0.815  1.0
  B  B22  1  0.500  0.134  0.315  1.0
  B  B23  1  0.500  0.866  0.685  1.0
  B  B24  1  0.500  0.984  0.211  1.0
  B  B25  1  0.500  0.016  0.789  1.0
  B  B26  1  0.500  0.484  0.289  1.0
  B  B27  1  0.500  0.516  0.711  1.0
  B  B28  1  0.500  0.596  0.026  1.0
  B  B29  1  0.500  0.404  0.974  1.0
  B  B30  1  0.500  0.096  0.474  1.0
  B  B31  1  0.500  0.904  0.526  1.0
  Ru  Ru32  1  0.000  0.643  0.320  1.0
  Ru  Ru33  1  0.000  0.357  0.680  1.0
  Ru  Ru34  1  0.000  0.143  0.180  1.0
  Ru  Ru35  1  0.000  0.857  0.820  1.0
[/CIF]
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