#------------------------------------------------------------------------------
#$Date: 2016-03-26 02:49:11 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180156 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/52/7105233.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_7105233
loop_
_publ_author_name
'Huh, Jung Oh'
'Kim, Hyungjun'
'Lee, Kang Mun'
'Lee, Yoon Sup'
'Do, Youngkyu'
'Lee, Min Hyung'
_publ_section_title
;
 o-Carborane-assisted Lewis acidity enhancement of triarylboranes.
;
_journal_issue                   7
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              1138
_journal_page_last               1140
_journal_paper_doi               10.1039/b918263b
_journal_volume                  46
_journal_year                    2010
_chemical_formula_moiety         C27H39B11
_chemical_formula_sum            'C27 H39 B11'
_chemical_formula_weight         482.49
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_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                 93.533(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.9560(4)
_cell_length_b                   27.7402(15)
_cell_length_c                   13.6954(8)
_cell_measurement_reflns_used    6956
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.60
_cell_measurement_theta_min      1.47
_cell_volume                     3016.8(3)
_computing_cell_refinement       'Bruker APEX II'
_computing_data_collection       'Bruker APEX II'
_computing_data_reduction        'Bruker APEX II'
_computing_molecular_graphics    ORTEP3
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0437
_diffrn_reflns_av_sigmaI/netI    0.0297
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       36
_diffrn_reflns_limit_k_min       -35
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            56299
_diffrn_reflns_theta_full        27.60
_diffrn_reflns_theta_max         27.60
_diffrn_reflns_theta_min         1.47
_exptl_absorpt_coefficient_mu    0.054
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.062
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       cubic
_exptl_crystal_F_000             1024
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.2
_refine_diff_density_max         0.208
_refine_diff_density_min         -0.191
_refine_diff_density_rms         0.041
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     390
_refine_ls_number_reflns         6956
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0900
_refine_ls_R_factor_gt           0.0597
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1028P)²+0.5314P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1658
_refine_ls_wR_factor_ref         0.1886
_reflns_number_gt                4803
_reflns_number_total             6956
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b918263b.txt
_cod_data_source_block           2
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7105233
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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
B1 B 0.1713(2) 0.09893(6) 0.22537(13) 0.0407(4) Uani 1 1 d . . .
C3 C 0.24747(19) 0.08490(5) 0.12501(11) 0.0388(3) Uani 1 1 d . . .
C4 C 0.1442(2) 0.07438(6) 0.03988(12) 0.0418(4) Uani 1 1 d . . .
C5 C 0.2165(2) 0.06277(6) -0.04723(12) 0.0482(4) Uani 1 1 d . . .
H5 H 0.1459 0.0553 -0.1018 0.058 Uiso 1 1 calc R . .
C6 C 0.3881(2) 0.06191(6) -0.05585(13) 0.0517(4) Uani 1 1 d . . .
C7 C 0.4889(2) 0.07209(7) 0.02751(13) 0.0537(4) Uani 1 1 d . . .
H7 H 0.6052 0.0719 0.0236 0.064 Uiso 1 1 calc R . .
C8 C 0.4234(2) 0.08267(6) 0.11699(12) 0.0441(4) Uani 1 1 d . . .
C9 C 0.2109(2) 0.06953(6) 0.32276(12) 0.0431(4) Uani 1 1 d . . .
C10 C 0.1712(2) 0.01989(6) 0.32731(13) 0.0488(4) Uani 1 1 d . . .
C11 C 0.1968(3) -0.00527(7) 0.41498(15) 0.0610(5) Uani 1 1 d . . .
H11 H 0.1673 -0.0377 0.4169 0.073 Uiso 1 1 calc R . .
C12 C 0.2647(3) 0.01644(8) 0.49920(14) 0.0634(5) Uani 1 1 d . . .
C13 C 0.3061(3) 0.06455(8) 0.49470(13) 0.0624(5) Uani 1 1 d . . .
H13 H 0.3529 0.0796 0.5507 0.075 Uiso 1 1 calc R . .
C14 C 0.2804(2) 0.09158(7) 0.40902(12) 0.0513(4) Uani 1 1 d . . .
C15 C 0.0456(2) 0.14304(6) 0.22769(11) 0.0422(4) Uani 1 1 d . . .
C16 C -0.0636(2) 0.14832(6) 0.30344(12) 0.0471(4) Uani 1 1 d . . .
H16 H -0.0551 0.1269 0.3557 0.057 Uiso 1 1 calc R . .
C17 C -0.1837(2) 0.18439(6) 0.30305(12) 0.0479(4) Uani 1 1 d . . .
H17 H -0.2547 0.1865 0.3544 0.057 Uiso 1 1 calc R . .
C18 C -0.1994(2) 0.21751(6) 0.22656(12) 0.0427(4) Uani 1 1 d . . .
C19 C -0.0885(2) 0.21378(6) 0.15180(13) 0.0497(4) Uani 1 1 d . . .
H19 H -0.0946 0.2360 0.1008 0.060 Uiso 1 1 calc R . .
C20 C 0.0306(2) 0.17736(6) 0.15287(12) 0.0487(4) Uani 1 1 d . . .
H20 H 0.1030 0.1757 0.1022 0.058 Uiso 1 1 calc R . .
C21 C -0.1744(3) 0.30845(8) 0.36377(17) 0.0743(6) Uani 1 1 d . . .
H21A H -0.1661 0.2803 0.4045 0.112 Uiso 1 1 calc R . .
H21B H -0.1863 0.3365 0.4038 0.112 Uiso 1 1 calc R . .
H21C H -0.0744 0.3114 0.3284 0.112 Uiso 1 1 calc R . .
C22 C -0.0456(2) 0.07241(7) 0.03983(14) 0.0546(4) Uani 1 1 d . . .
H22A H -0.0935 0.0963 -0.0044 0.082 Uiso 1 1 calc R . .
H22B H -0.0798 0.0787 0.1046 0.082 Uiso 1 1 calc R . .
H22C H -0.0840 0.0410 0.0193 0.082 Uiso 1 1 calc R . .
C23 C 0.4648(3) 0.05045(10) -0.15147(16) 0.0798(7) Uani 1 1 d . . .
H23A H 0.3803 0.0369 -0.1964 0.120 Uiso 1 1 calc R . .
H23B H 0.5548 0.0277 -0.1400 0.120 Uiso 1 1 calc R . .
H23C H 0.5081 0.0795 -0.1787 0.120 Uiso 1 1 calc R . .
C24 C 0.5467(2) 0.09186(8) 0.20275(14) 0.0619(5) Uani 1 1 d . . .
H24A H 0.6571 0.0819 0.1866 0.093 Uiso 1 1 calc R . .
H24B H 0.5135 0.0739 0.2583 0.093 Uiso 1 1 calc R . .
H24C H 0.5479 0.1256 0.2180 0.093 Uiso 1 1 calc R . .
C25 C 0.0924(3) -0.00675(7) 0.23994(15) 0.0652(5) Uani 1 1 d . . .
H25A H 0.0902 -0.0406 0.2539 0.098 Uiso 1 1 calc R . .
H25B H 0.1575 -0.0012 0.1843 0.098 Uiso 1 1 calc R . .
H25C H -0.0204 0.0046 0.2261 0.098 Uiso 1 1 calc R . .
C26 C 0.2932(4) -0.01215(11) 0.59251(17) 0.0926(8) Uani 1 1 d . . .
H26A H 0.4093 -0.0096 0.6157 0.139 Uiso 1 1 calc R . .
H26B H 0.2657 -0.0454 0.5801 0.139 Uiso 1 1 calc R . .
H26C H 0.2230 0.0004 0.6411 0.139 Uiso 1 1 calc R . .
C27 C 0.3358(3) 0.14371(8) 0.41087(15) 0.0679(6) Uani 1 1 d . . .
H27A H 0.2575 0.1626 0.4454 0.102 Uiso 1 1 calc R . .
H27B H 0.3390 0.1554 0.3451 0.102 Uiso 1 1 calc R . .
H27C H 0.4459 0.1462 0.4433 0.102 Uiso 1 1 calc R . .
B2 B -0.4352(3) 0.26933(8) 0.10845(17) 0.0573(5) Uani 1 1 d . . .
B3 B -0.2937(3) 0.31025(8) 0.16972(17) 0.0561(5) Uani 1 1 d . . .
B4 B -0.4712(3) 0.25981(8) 0.31471(18) 0.0579(5) Uani 1 1 d . . .
B5 B -0.5455(3) 0.23799(8) 0.19846(19) 0.0597(6) Uani 1 1 d . . .
B6 B -0.6433(3) 0.28681(9) 0.1335(2) 0.0689(6) Uani 1 1 d . . .
B7 B -0.4876(3) 0.33138(9) 0.1159(2) 0.0658(6) Uani 1 1 d . . .
B8 B -0.4137(3) 0.35267(8) 0.2319(2) 0.0666(6) Uani 1 1 d . . .
B9 B -0.5228(4) 0.32170(9) 0.3214(2) 0.0703(7) Uani 1 1 d . . .
B10 B -0.6643(3) 0.28054(9) 0.2616(2) 0.0713(7) Uani 1 1 d . . .
B11 B -0.6291(3) 0.33853(9) 0.2101(2) 0.0720(7) Uani 1 1 d . . .
C1 C -0.3386(2) 0.25464(6) 0.21933(13) 0.0453(4) Uani 1 1 d . . .
C2 C -0.3256(2) 0.30401(6) 0.29248(14) 0.0553(5) Uani 1 1 d . . .
H29 H -0.160(3) 0.3161(7) 0.1525(14) 0.064(6) Uiso 1 1 d . . .
H30 H -0.448(2) 0.2397(7) 0.3796(14) 0.056(5) Uiso 1 1 d . . .
H28 H -0.393(3) 0.2504(7) 0.0448(14) 0.061(5) Uiso 1 1 d . . .
H34 H -0.356(3) 0.3872(8) 0.2454(15) 0.077(6) Uiso 1 1 d . . .
H32 H -0.749(3) 0.2820(8) 0.0817(16) 0.080(7) Uiso 1 1 d . . .
H31 H -0.569(2) 0.1995(7) 0.1904(13) 0.058(5) Uiso 1 1 d . . .
H37 H -0.731(3) 0.3659(7) 0.2071(14) 0.068(6) Uiso 1 1 d . . .
H33 H -0.489(3) 0.3527(9) 0.0517(18) 0.089(7) Uiso 1 1 d . . .
H35 H -0.530(3) 0.3368(8) 0.3926(17) 0.082(7) Uiso 1 1 d . . .
H36 H -0.782(3) 0.2691(8) 0.2963(15) 0.072(6) 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'
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
C9 B1 C15 118.44(14) . . ?
C9 B1 C3 122.62(14) . . ?
C15 B1 C3 118.91(14) . . ?
C8 C3 C4 117.07(14) . . ?
C8 C3 B1 120.82(14) . . ?
C4 C3 B1 122.11(14) . . ?
C5 C4 C3 120.24(15) . . ?
C5 C4 C22 117.16(15) . . ?
C3 C4 C22 122.52(14) . . ?
C6 C5 C4 122.74(16) . . ?
C5 C6 C7 116.94(16) . . ?
C5 C6 C23 122.21(19) . . ?
C7 C6 C23 120.85(18) . . ?
C6 C7 C8 122.67(16) . . ?
C7 C8 C3 120.29(15) . . ?
C7 C8 C24 117.49(15) . . ?
C3 C8 C24 122.22(15) . . ?
C14 C9 C10 117.48(15) . . ?
C14 C9 B1 122.04(15) . . ?
C10 C9 B1 120.44(15) . . ?
C11 C10 C9 120.30(17) . . ?
C11 C10 C25 118.01(17) . . ?
C9 C10 C25 121.62(16) . . ?
C12 C11 C10 122.03(19) . . ?
C13 C12 C11 117.87(18) . . ?
C13 C12 C26 121.5(2) . . ?
C11 C12 C26 120.6(2) . . ?
C12 C13 C14 122.33(19) . . ?
C13 C14 C9 119.98(18) . . ?
C13 C14 C27 118.17(17) . . ?
C9 C14 C27 121.80(16) . . ?
C20 C15 C16 116.27(15) . . ?
C20 C15 B1 122.51(14) . . ?
C16 C15 B1 121.14(14) . . ?
C17 C16 C15 122.16(15) . . ?
C16 C17 C18 120.64(15) . . ?
C17 C18 C19 118.12(15) . . ?
C17 C18 C1 122.00(14) . . ?
C19 C18 C1 119.76(14) . . ?
C20 C19 C18 120.62(15) . . ?
C19 C20 C15 122.14(15) . . ?
C1 B2 B3 59.62(12) . . ?
C1 B2 B7 105.94(16) . . ?
B3 B2 B7 59.78(14) . . ?
C1 B2 B6 105.50(17) . . ?
B3 B2 B6 107.80(17) . . ?
B7 B2 B6 59.99(14) . . ?
C1 B2 B5 58.86(12) . . ?
B3 B2 B5 108.07(16) . . ?
B7 B2 B5 107.80(17) . . ?
B6 B2 B5 59.75(14) . . ?
C2 B3 C1 58.79(11) . . ?
C2 B3 B8 58.69(13) . . ?
C1 B3 B8 105.88(16) . . ?
C2 B3 B7 105.24(16) . . ?
C1 B3 B7 105.28(16) . . ?
B8 B3 B7 59.80(15) . . ?
C2 B3 B2 105.66(15) . . ?
C1 B3 B2 58.34(12) . . ?
B8 B3 B2 107.97(17) . . ?
B7 B3 B2 60.19(14) . . ?
C2 B4 C1 58.69(11) . . ?
C2 B4 B10 105.89(17) . . ?
C1 B4 B10 105.82(17) . . ?
C2 B4 B9 58.69(13) . . ?
C1 B4 B9 105.84(16) . . ?
B10 B4 B9 60.21(15) . . ?
C2 B4 B5 105.94(16) . . ?
C1 B4 B5 58.64(12) . . ?
B10 B4 B5 60.29(15) . . ?
B9 B4 B5 108.20(18) . . ?
C1 B5 B4 59.65(12) . . ?
C1 B5 B10 105.94(16) . . ?
B4 B5 B10 59.44(14) . . ?
C1 B5 B6 105.35(16) . . ?
B4 B5 B6 107.59(17) . . ?
B10 B5 B6 60.35(15) . . ?
C1 B5 B2 58.42(12) . . ?
B4 B5 B2 107.69(16) . . ?
B10 B5 B2 108.24(17) . . ?
B6 B5 B2 60.01(14) . . ?
B5 B6 B7 108.14(17) . . ?
B5 B6 B11 108.06(19) . . ?
B7 B6 B11 59.92(15) . . ?
B5 B6 B2 60.24(13) . . ?
B7 B6 B2 59.92(14) . . ?
B11 B6 B2 107.93(18) . . ?
B5 B6 B10 59.73(14) . . ?
B7 B6 B10 108.04(19) . . ?
B11 B6 B10 60.23(16) . . ?
B2 B6 B10 107.93(18) . . ?
B8 B7 B3 60.06(14) . . ?
B8 B7 B11 59.89(16) . . ?
B3 B7 B11 108.06(18) . . ?
B8 B7 B2 108.06(17) . . ?
B3 B7 B2 60.04(13) . . ?
B11 B7 B2 108.16(18) . . ?
B8 B7 B6 107.92(19) . . ?
B3 B7 B6 108.07(17) . . ?
B11 B7 B6 60.05(15) . . ?
B2 B7 B6 60.08(14) . . ?
C2 B8 B7 106.06(16) . . ?
C2 B8 B11 105.73(18) . . ?
B7 B8 B11 60.41(16) . . ?
C2 B8 B3 59.41(12) . . ?
B7 B8 B3 60.14(14) . . ?
B11 B8 B3 108.53(18) . . ?
C2 B8 B9 58.99(13) . . ?
B7 B8 B9 108.13(19) . . ?
B11 B8 B9 59.75(16) . . ?
B3 B8 B9 108.27(16) . . ?
C2 B9 B11 105.91(18) . . ?
C2 B9 B8 58.88(14) . . ?
B11 B9 B8 60.08(16) . . ?
C2 B9 B10 105.91(16) . . ?
B11 B9 B10 60.82(16) . . ?
B8 B9 B10 108.62(19) . . ?
C2 B9 B4 59.42(12) . . ?
B11 B9 B4 108.29(19) . . ?
B8 B9 B4 108.09(16) . . ?
B10 B9 B4 59.52(15) . . ?
B4 B10 B9 60.27(14) . . ?
B4 B10 B5 60.27(13) . . ?
B9 B10 B5 108.23(17) . . ?
B4 B10 B6 107.89(17) . . ?
B9 B10 B6 107.29(19) . . ?
B5 B10 B6 59.91(15) . . ?
B4 B10 B11 107.71(19) . . ?
B9 B10 B11 59.36(16) . . ?
B5 B10 B11 107.82(18) . . ?
B6 B10 B11 59.75(16) . . ?
B9 B11 B8 60.17(16) . . ?
B9 B11 B7 107.91(18) . . ?
B8 B11 B7 59.71(15) . . ?
B9 B11 B6 107.87(18) . . ?
B8 B11 B6 107.77(17) . . ?
B7 B11 B6 60.04(15) . . ?
B9 B11 B10 59.82(16) . . ?
B8 B11 B10 107.90(18) . . ?
B7 B11 B10 107.97(17) . . ?
B6 B11 B10 60.02(16) . . ?
C18 C1 C2 119.61(14) . . ?
C18 C1 B2 120.57(14) . . ?
C2 C1 B2 109.87(13) . . ?
C18 C1 B5 121.27(14) . . ?
C2 C1 B5 109.77(14) . . ?
B2 C1 B5 62.72(13) . . ?
C18 C1 B3 117.71(14) . . ?
C2 C1 B3 60.39(12) . . ?
B2 C1 B3 62.04(13) . . ?
B5 C1 B3 113.13(15) . . ?
C18 C1 B4 118.97(14) . . ?
C2 C1 B4 60.41(11) . . ?
B2 C1 B4 112.84(15) . . ?
B5 C1 B4 61.72(13) . . ?
B3 C1 B4 111.79(14) . . ?
C21 C2 C1 117.75(15) . . ?
C21 C2 B8 122.42(17) . . ?
C1 C2 B8 110.04(15) . . ?
C21 C2 B9 122.21(18) . . ?
C1 C2 B9 110.14(16) . . ?
B8 C2 B9 62.13(15) . . ?
C21 C2 B3 117.63(18) . . ?
C1 C2 B3 60.82(11) . . ?
B8 C2 B3 61.90(13) . . ?
B9 C2 B3 112.84(17) . . ?
C21 C2 B4 117.47(18) . . ?
C1 C2 B4 60.90(11) . . ?
B8 C2 B4 112.73(17) . . ?
B9 C2 B4 61.89(13) . . ?
B3 C2 B4 112.56(16) . . ?
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
B1 C9 1.578(2) . ?
B1 C15 1.582(2) . ?
B1 C3 1.585(2) . ?
C3 C8 1.412(2) . ?
C3 C4 1.415(2) . ?
C4 C5 1.394(2) . ?
C4 C22 1.510(2) . ?
C5 C6 1.378(3) . ?
C6 C7 1.384(3) . ?
C6 C23 1.512(2) . ?
C7 C8 1.392(2) . ?
C8 C24 1.505(2) . ?
C9 C14 1.413(2) . ?
C9 C10 1.415(2) . ?
C10 C11 1.393(3) . ?
C10 C25 1.509(3) . ?
C11 C12 1.381(3) . ?
C12 C13 1.377(3) . ?
C12 C26 1.509(3) . ?
C13 C14 1.397(3) . ?
C14 C27 1.511(3) . ?
C15 C20 1.398(2) . ?
C15 C16 1.401(2) . ?
C16 C17 1.383(2) . ?
C17 C18 1.393(2) . ?
C18 C19 1.396(2) . ?
C18 C1 1.511(2) . ?
C19 C20 1.384(2) . ?
C21 C2 1.507(3) . ?
B2 C1 1.709(3) . ?
B2 B3 1.773(3) . ?
B2 B7 1.776(3) . ?
B2 B6 1.779(3) . ?
B2 B5 1.783(3) . ?
B3 C2 1.724(3) . ?
B3 C1 1.732(3) . ?
B3 B8 1.767(3) . ?
B3 B7 1.768(3) . ?
B4 C2 1.727(3) . ?
B4 C1 1.735(3) . ?
B4 B10 1.756(4) . ?
B4 B9 1.769(3) . ?
B4 B5 1.770(4) . ?
B5 C1 1.717(3) . ?
B5 B10 1.771(3) . ?
B5 B6 1.774(4) . ?
B6 B7 1.777(4) . ?
B6 B11 1.777(4) . ?
B6 B10 1.782(4) . ?
B7 B8 1.762(4) . ?
B7 B11 1.775(4) . ?
B8 C2 1.711(3) . ?
B8 B11 1.766(4) . ?
B8 B9 1.767(4) . ?
B9 C2 1.713(3) . ?
B9 B11 1.760(4) . ?
B9 B10 1.768(4) . ?
B10 B11 1.786(4) . ?
C1 C2 1.696(2) . ?
