#------------------------------------------------------------------------------
#$Date: 2016-03-21 16:59:14 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178763 $
#$URL: svn://www.crystallography.net/cod/cif/4/10/17/4101761.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4101761
loop_
_publ_author_name
'Zhang, Jian'
'Deng, Liang'
'Chan, Hoi-Shan'
'Xie, Zuowei'
_publ_section_title
;
 Role of c,c'-linkage in the formation and stabilization of
 supercarboranes. Synthesis and structure of carbon-atoms-apart 13-vertex
 carborane and 14-vertex metallacarborane.
;
_journal_issue                   1
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              18
_journal_page_last               19
_journal_paper_doi               10.1021/ja067129e
_journal_volume                  129
_journal_year                    2007
_chemical_formula_sum            'C14 H31 B11 Ru'
_chemical_formula_weight         419.37
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.9962(13)
_cell_length_b                   12.7008(16)
_cell_length_c                   16.033(2)
_cell_measurement_temperature    293(2)
_cell_volume                     2035.5(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_av_sigmaI/netI    0.0369
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            11094
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    0.765
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8030
_exptl_absorpt_correction_type   sadabs
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.368
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             856
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.446
_refine_diff_density_min         -0.244
_refine_diff_density_rms         0.062
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.02(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     240
_refine_ls_number_reflns         3588
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.088
_refine_ls_R_factor_all          0.0306
_refine_ls_R_factor_gt           0.0259
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0325P)²+0.0568P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0605
_refine_ls_wR_factor_ref         0.0632
_reflns_number_gt                3328
_reflns_number_total             3588
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ja067129esi20061005_033852.cif
_cod_data_source_block           4
_cod_original_sg_symbol_H-M      P2(1)2(1)2(1)
_cod_database_code               4101761
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.10037(3) 0.559578(19) 0.108011(15) 0.02413(8) Uani 1 1 d . . .
C2 C 0.1321(3) 0.5484(3) 0.24644(19) 0.0303(8) Uani 1 1 d . . .
C3 C 0.0228(4) 0.5902(3) 0.3041(2) 0.0450(10) Uani 1 1 d . . .
H3A H 0.0495 0.5805 0.3611 0.067 Uiso 1 1 calc R . .
H3B H -0.0588 0.5525 0.2939 0.067 Uiso 1 1 calc R . .
H3C H 0.0091 0.6638 0.2935 0.067 Uiso 1 1 calc R . .
B3 B 0.2252(4) 0.6422(3) 0.1996(3) 0.0336(10) Uani 1 1 d . . .
H3 H 0.1934 0.7244 0.2086 0.040 Uiso 1 1 calc R . .
B4 B 0.3137(4) 0.6123(3) 0.1059(3) 0.0357(9) Uani 1 1 d . . .
H4 H 0.3353 0.6768 0.0621 0.043 Uiso 1 1 calc R . .
B5 B 0.2938(5) 0.4865(3) 0.0606(3) 0.0360(10) Uani 1 1 d . . .
H5 H 0.3032 0.4820 -0.0076 0.043 Uiso 1 1 calc R . .
B6 B 0.1854(4) 0.3931(3) 0.1085(3) 0.0330(8) Uani 1 1 d . . .
H6 H 0.1345 0.3383 0.0659 0.040 Uiso 1 1 calc R . .
B7 B 0.1011(4) 0.4277(3) 0.2031(2) 0.0301(8) Uani 1 1 d . . .
H7 H 0.0015 0.3933 0.2134 0.036 Uiso 1 1 calc R . .
B8 B 0.2922(4) 0.5636(4) 0.2813(2) 0.0351(9) Uani 1 1 d . . .
H8 H 0.3224 0.5961 0.3420 0.042 Uiso 1 1 calc R . .
C9 C 0.3847(4) 0.5982(3) 0.2010(2) 0.0383(9) Uani 1 1 d . . .
C10 C 0.4972(5) 0.6738(4) 0.2259(3) 0.0649(14) Uani 1 1 d . . .
H10A H 0.4776 0.7430 0.2051 0.097 Uiso 1 1 calc R . .
H10B H 0.5802 0.6497 0.2026 0.097 Uiso 1 1 calc R . .
H10C H 0.5043 0.6760 0.2856 0.097 Uiso 1 1 calc R . .
B10 B 0.4310(4) 0.5126(4) 0.1285(3) 0.0428(12) Uani 1 1 d . . .
H10 H 0.5358 0.5179 0.1080 0.051 Uiso 1 1 calc R . .
B11 B 0.3598(4) 0.3872(3) 0.1275(3) 0.0375(11) Uani 1 1 d . . .
H11 H 0.4242 0.3234 0.1042 0.045 Uiso 1 1 calc R . .
B12 B 0.2467(4) 0.3524(3) 0.2054(3) 0.0330(10) Uani 1 1 d . . .
H12 H 0.2453 0.2691 0.2242 0.040 Uiso 1 1 calc R . .
B13 B 0.2193(4) 0.4425(4) 0.2839(2) 0.0343(9) Uani 1 1 d . . .
H13 H 0.2064 0.4092 0.3467 0.041 Uiso 1 1 calc R . .
B14 B 0.3846(4) 0.4492(4) 0.2306(3) 0.0376(9) Uani 1 1 d . . .
C21 C 0.0191(4) 0.7153(3) 0.0577(2) 0.0362(9) Uani 1 1 d . . .
C22 C 0.0676(4) 0.6523(3) -0.0079(2) 0.0381(9) Uani 1 1 d . . .
H22A H 0.1453 0.6764 -0.0399 0.046 Uiso 1 1 calc R . .
C23 C 0.0192(4) 0.5497(3) -0.0206(2) 0.0377(8) Uani 1 1 d . . .
H23A H 0.0642 0.5044 -0.0613 0.045 Uiso 1 1 calc R . .
C24 C -0.0814(4) 0.5059(3) 0.0310(2) 0.0363(9) Uani 1 1 d . . .
C25 C -0.1261(3) 0.5670(3) 0.0980(2) 0.0361(8) Uani 1 1 d . . .
H25A H -0.1807 0.5340 0.1415 0.043 Uiso 1 1 calc R . .
C26 C -0.0765(3) 0.6709(3) 0.1109(2) 0.0352(8) Uani 1 1 d . . .
H26A H -0.0981 0.7072 0.1632 0.042 Uiso 1 1 calc R . .
C27 C 0.0726(4) 0.8259(3) 0.0706(3) 0.0519(11) Uani 1 1 d . . .
H27A H 0.0168 0.8753 0.0416 0.078 Uiso 1 1 calc R . .
H27B H 0.1623 0.8302 0.0495 0.078 Uiso 1 1 calc R . .
H27C H 0.0726 0.8422 0.1291 0.078 Uiso 1 1 calc R . .
C28 C -0.1385(4) 0.3996(3) 0.0075(3) 0.0507(12) Uani 1 1 d . . .
H28A H -0.0648 0.3565 -0.0141 0.061 Uiso 1 1 calc R . .
C29 C -0.2039(5) 0.3386(4) 0.0784(3) 0.0785(17) Uani 1 1 d . . .
H29A H -0.1399 0.3278 0.1223 0.118 Uiso 1 1 calc R . .
H29B H -0.2343 0.2716 0.0581 0.118 Uiso 1 1 calc R . .
H29C H -0.2786 0.3779 0.0996 0.118 Uiso 1 1 calc R . .
C30 C -0.2392(5) 0.4166(4) -0.0646(3) 0.0710(16) Uani 1 1 d . . .
H30A H -0.1961 0.4538 -0.1092 0.107 Uiso 1 1 calc R . .
H30B H -0.3140 0.4568 -0.0448 0.107 Uiso 1 1 calc R . .
H30C H -0.2700 0.3495 -0.0845 0.107 Uiso 1 1 calc R . .
H14 H 0.470(3) 0.430(3) 0.2677(19) 0.032(9) Uiso 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
B3 Ru1 C23 148.92(15) . . ?
B3 Ru1 C22 112.92(15) . . ?
C23 Ru1 C22 36.84(14) . . ?
B3 Ru1 B4 47.50(17) . . ?
C23 Ru1 B4 110.57(17) . . ?
C22 Ru1 B4 88.24(16) . . ?
B3 Ru1 C2 44.66(14) . . ?
C23 Ru1 C2 165.03(13) . . ?
C22 Ru1 C2 151.60(14) . . ?
B4 Ru1 C2 84.20(16) . . ?
B3 Ru1 B7 84.35(14) . . ?
C23 Ru1 B7 125.80(14) . . ?
C22 Ru1 B7 162.63(13) . . ?
B4 Ru1 B7 103.20(16) . . ?
C2 Ru1 B7 44.59(13) . . ?
B3 Ru1 C26 97.55(14) . . ?
C23 Ru1 C26 76.65(14) . . ?
C22 Ru1 C26 64.65(13) . . ?
B4 Ru1 C26 123.94(14) . . ?
C2 Ru1 C26 97.43(13) . . ?
B7 Ru1 C26 116.77(14) . . ?
B3 Ru1 C25 126.45(14) . . ?
C23 Ru1 C25 64.69(13) . . ?
C22 Ru1 C25 76.83(14) . . ?
B4 Ru1 C25 159.60(15) . . ?
C2 Ru1 C25 102.32(12) . . ?
B7 Ru1 C25 94.69(15) . . ?
C26 Ru1 C25 36.61(12) . . ?
B3 Ru1 B5 86.29(16) . . ?
C23 Ru1 B5 88.71(15) . . ?
C22 Ru1 B5 93.56(15) . . ?
B4 Ru1 B5 46.08(16) . . ?
C2 Ru1 B5 100.60(15) . . ?
B7 Ru1 B5 85.42(16) . . ?
C26 Ru1 B5 157.70(14) . . ?
C25 Ru1 B5 147.18(15) . . ?
B3 Ru1 B6 103.27(15) . . ?
C23 Ru1 B6 95.00(15) . . ?
C22 Ru1 B6 123.28(15) . . ?
B4 Ru1 B6 85.52(15) . . ?
C2 Ru1 B6 83.43(15) . . ?
B7 Ru1 B6 46.40(15) . . ?
C26 Ru1 B6 150.53(13) . . ?
C25 Ru1 B6 114.25(14) . . ?
B5 Ru1 B6 46.02(15) . . ?
B3 Ru1 C21 91.40(14) . . ?
C23 Ru1 C21 65.84(14) . . ?
C22 Ru1 C21 36.34(13) . . ?
B4 Ru1 C21 94.28(15) . . ?
C2 Ru1 C21 116.98(13) . . ?
B7 Ru1 C21 151.51(14) . . ?
C26 Ru1 C21 35.84(13) . . ?
C25 Ru1 C21 65.46(13) . . ?
B5 Ru1 C21 122.50(15) . . ?
B6 Ru1 C21 159.50(14) . . ?
B3 Ru1 C24 161.83(14) . . ?
C23 Ru1 C24 36.49(13) . . ?
C22 Ru1 C24 65.94(14) . . ?
B4 Ru1 C24 146.54(17) . . ?
C2 Ru1 C24 128.55(13) . . ?
B7 Ru1 C24 98.32(14) . . ?
C26 Ru1 C24 65.13(12) . . ?
C25 Ru1 C24 35.62(13) . . ?
B5 Ru1 C24 111.80(15) . . ?
B6 Ru1 C24 91.23(14) . . ?
C21 Ru1 C24 77.66(13) . . ?
C3 C2 B3 114.8(3) . . ?
C3 C2 B8 115.7(3) . . ?
B3 C2 B8 63.2(2) . . ?
C3 C2 B13 115.2(3) . . ?
B3 C2 B13 115.5(3) . . ?
B8 C2 B13 59.8(2) . . ?
C3 C2 B7 115.3(3) . . ?
B3 C2 B7 123.5(3) . . ?
B8 C2 B7 113.9(3) . . ?
B13 C2 B7 62.0(2) . . ?
C3 C2 Ru1 118.4(2) . . ?
B3 C2 Ru1 66.02(17) . . ?
B8 C2 Ru1 116.7(2) . . ?
B13 C2 Ru1 117.9(2) . . ?
B7 C2 Ru1 68.26(16) . . ?
C2 B3 C9 106.3(3) . . ?
C2 B3 B8 58.9(2) . . ?
C9 B3 B8 56.6(2) . . ?
C2 B3 B4 119.8(3) . . ?
C9 B3 B4 58.2(2) . . ?
B8 B3 B4 108.3(3) . . ?
C2 B3 Ru1 69.32(18) . . ?
C9 B3 Ru1 112.8(2) . . ?
B8 B3 Ru1 116.0(2) . . ?
B4 B3 Ru1 67.46(19) . . ?
C9 B4 B10 57.3(2) . . ?
C9 B4 B5 108.8(3) . . ?
B10 B4 B5 60.7(3) . . ?
C9 B4 B3 58.1(2) . . ?
B10 B4 B3 108.0(3) . . ?
B5 B4 B3 118.9(3) . . ?
C9 B4 Ru1 110.8(3) . . ?
B10 B4 Ru1 114.6(3) . . ?
B5 B4 Ru1 68.2(2) . . ?
B3 B4 Ru1 65.04(19) . . ?
B4 B5 B6 119.6(3) . . ?
B4 B5 B11 110.6(3) . . ?
B6 B5 B11 59.6(2) . . ?
B4 B5 B10 59.6(2) . . ?
B6 B5 B10 109.2(3) . . ?
B11 B5 B10 58.6(2) . . ?
B4 B5 Ru1 65.77(19) . . ?
B6 B5 Ru1 67.09(18) . . ?
B11 B5 Ru1 113.7(3) . . ?
B10 B5 Ru1 112.0(3) . . ?
B12 B6 B11 59.3(2) . . ?
B12 B6 B5 111.5(3) . . ?
B11 B6 B5 60.2(2) . . ?
B12 B6 B7 59.0(2) . . ?
B11 B6 B7 109.1(3) . . ?
B5 B6 B7 119.2(3) . . ?
B12 B6 Ru1 114.1(2) . . ?
B11 B6 Ru1 114.0(2) . . ?
B5 B6 Ru1 66.89(18) . . ?
B7 B6 Ru1 66.38(16) . . ?
C2 B7 B12 109.4(3) . . ?
C2 B7 B13 59.0(2) . . ?
B12 B7 B13 58.9(2) . . ?
C2 B7 B6 118.6(3) . . ?
B12 B7 B6 59.4(2) . . ?
B13 B7 B6 109.5(3) . . ?
C2 B7 Ru1 67.15(16) . . ?
B12 B7 Ru1 115.0(2) . . ?
B13 B7 Ru1 114.7(2) . . ?
B6 B7 Ru1 67.22(17) . . ?
C9 B8 B13 120.1(3) . . ?
C9 B8 C2 107.5(3) . . ?
B13 B8 C2 60.3(2) . . ?
C9 B8 B3 59.0(2) . . ?
B13 B8 B3 111.4(3) . . ?
C2 B8 B3 57.9(2) . . ?
C9 B8 B14 66.2(2) . . ?
B13 B8 B14 61.9(2) . . ?
C2 B8 B14 103.2(3) . . ?
B3 B8 B14 107.3(3) . . ?
C10 C9 B8 112.1(3) . . ?
C10 C9 B10 112.9(3) . . ?
B8 C9 B10 122.0(3) . . ?
C10 C9 B3 119.3(3) . . ?
B8 C9 B3 64.4(2) . . ?
B10 C9 B3 118.1(3) . . ?
C10 C9 B4 118.5(3) . . ?
B8 C9 B4 119.8(3) . . ?
B10 C9 B4 63.6(3) . . ?
B3 C9 B4 63.7(2) . . ?
C9 B10 B11 119.5(3) . . ?
C9 B10 B4 59.1(3) . . ?
B11 B10 B4 112.4(3) . . ?
C9 B10 B5 109.6(3) . . ?
B11 B10 B5 60.7(2) . . ?
B4 B10 B5 59.7(2) . . ?
C9 B10 B14 66.6(2) . . ?
B11 B10 B14 61.1(2) . . ?
B4 B10 B14 108.8(3) . . ?
B5 B10 B14 105.1(3) . . ?
B12 B11 B10 119.3(3) . . ?
B12 B11 B6 59.7(2) . . ?
B10 B11 B6 111.4(3) . . ?
B12 B11 B5 111.8(3) . . ?
B10 B11 B5 60.7(3) . . ?
B6 B11 B5 60.1(2) . . ?
B12 B11 B14 63.5(2) . . ?
B10 B11 B14 63.1(2) . . ?
B6 B11 B14 105.5(3) . . ?
B5 B11 B14 106.6(3) . . ?
B13 B12 B11 117.3(3) . . ?
B13 B12 B7 61.2(2) . . ?
B11 B12 B7 112.8(3) . . ?
B13 B12 B6 113.4(3) . . ?
B11 B12 B6 61.0(2) . . ?
B7 B12 B6 61.7(2) . . ?
B13 B12 B14 61.8(2) . . ?
B11 B12 B14 61.0(2) . . ?
B7 B12 B14 104.9(3) . . ?
B6 B12 B14 104.6(3) . . ?
B8 B13 C2 59.9(2) . . ?
B8 B13 B12 120.9(3) . . ?
C2 B13 B12 110.3(3) . . ?
B8 B13 B7 111.4(3) . . ?
C2 B13 B7 59.0(2) . . ?
B12 B13 B7 60.0(2) . . ?
B8 B13 B14 64.4(2) . . ?
C2 B13 B14 104.8(3) . . ?
B12 B13 B14 63.5(2) . . ?
B7 B13 B14 105.2(3) . . ?
B11 B14 B13 105.8(3) . . ?
B11 B14 B10 55.8(2) . . ?
B13 B14 B10 129.6(3) . . ?
B11 B14 B12 55.5(2) . . ?
B13 B14 B12 54.7(2) . . ?
B10 B14 B12 105.8(3) . . ?
B11 B14 B8 130.0(3) . . ?
B13 B14 B8 53.8(2) . . ?
B10 B14 B8 99.5(3) . . ?
B12 B14 B8 103.5(3) . . ?
C26 C21 C22 117.5(3) . . ?
C26 C21 C27 122.0(4) . . ?
C22 C21 C27 120.5(4) . . ?
C26 C21 Ru1 71.30(19) . . ?
C22 C21 Ru1 69.5(2) . . ?
C27 C21 Ru1 128.9(3) . . ?
C23 C22 C21 121.2(3) . . ?
C23 C22 Ru1 71.43(19) . . ?
C21 C22 Ru1 74.2(2) . . ?
C22 C23 C24 121.6(3) . . ?
C22 C23 Ru1 71.73(19) . . ?
C24 C23 Ru1 74.8(2) . . ?
C25 C24 C23 117.2(3) . . ?
C25 C24 C28 124.5(4) . . ?
C23 C24 C28 118.2(4) . . ?
C25 C24 Ru1 71.09(19) . . ?
C23 C24 Ru1 68.7(2) . . ?
C28 C24 Ru1 134.1(2) . . ?
C24 C25 C26 121.0(3) . . ?
C24 C25 Ru1 73.3(2) . . ?
C26 C25 Ru1 71.44(18) . . ?
C21 C26 C25 121.4(3) . . ?
C21 C26 Ru1 72.86(19) . . ?
C25 C26 Ru1 71.95(18) . . ?
C24 C28 C29 115.4(4) . . ?
C24 C28 C30 107.9(3) . . ?
C29 C28 C30 110.4(4) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ru1 B3 2.194(4) . ?
Ru1 C23 2.220(3) . ?
Ru1 C22 2.224(3) . ?
Ru1 B4 2.235(4) . ?
Ru1 C2 2.247(3) . ?
Ru1 B7 2.265(4) . ?
Ru1 C26 2.265(3) . ?
Ru1 C25 2.272(3) . ?
Ru1 B5 2.275(4) . ?
Ru1 B6 2.279(4) . ?
Ru1 C21 2.285(3) . ?
Ru1 C24 2.300(4) . ?
C2 C3 1.526(5) . ?
C2 B3 1.688(5) . ?
C2 B8 1.706(5) . ?
C2 B13 1.711(5) . ?
C2 B7 1.712(5) . ?
B3 C9 1.690(6) . ?
B3 B8 1.778(6) . ?
B3 B4 1.784(6) . ?
B4 C9 1.691(6) . ?
B4 B10 1.763(6) . ?
B4 B5 1.766(6) . ?
B5 B6 1.780(6) . ?
B5 B11 1.782(6) . ?
B5 B10 1.782(7) . ?
B6 B12 1.749(6) . ?
B6 B11 1.771(6) . ?
B6 B7 1.790(6) . ?
B7 B12 1.742(6) . ?
B7 B13 1.763(5) . ?
B8 C9 1.645(5) . ?
B8 B13 1.703(6) . ?
B8 B14 1.904(6) . ?
C9 C10 1.532(5) . ?
C9 B10 1.657(6) . ?
B10 B11 1.745(7) . ?
B10 B14 1.882(6) . ?
B11 B12 1.742(6) . ?
B11 B14 1.847(6) . ?
B12 B13 1.722(6) . ?
B12 B14 1.890(6) . ?
B13 B14 1.862(6) . ?
C21 C26 1.400(5) . ?
C21 C22 1.407(5) . ?
C21 C27 1.517(5) . ?
C22 C23 1.404(5) . ?
C23 C24 1.417(5) . ?
C24 C25 1.398(5) . ?
C24 C28 1.514(5) . ?
C25 C26 1.425(5) . ?
C28 C29 1.523(7) . ?
C28 C30 1.548(5) . ?
