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#$Date: 2025-03-21 01:39:27 +0200 (Fri, 21 Mar 2025) $
#$Revision: 298545 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/25/01/7250144.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_7250144
loop_
_publ_author_name
'Schöbinger, Matthias'
'Huber, Martin'
'Stöger, Berthold'
'Hametner, Christian'
'Weinberger, Peter'
_publ_section_title
;
 Structural Tuning of Tetrazole-BODIPY Ag(I) Coordination Compounds via
 Co-Ligand Addition and Counterion Variation
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/D5CE00197H
_journal_year                    2025
_chemical_formula_sum            'C60 H68 Ag2 B4 F12 N24 O4 P2'
_chemical_formula_weight         1738.30
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2024-12-11 deposited with the CCDC.	2025-03-20 downloaded from the CCDC.
;
_cell_angle_alpha                77.995(6)
_cell_angle_beta                 89.089(6)
_cell_angle_gamma                85.412(6)
_cell_formula_units_Z            1
_cell_length_a                   4.8187(10)
_cell_length_b                   18.098(4)
_cell_length_c                   20.308(4)
_cell_measurement_reflns_used    4040
_cell_measurement_temperature    100
_cell_measurement_theta_max      22.65
_cell_measurement_theta_min      2.32
_cell_volume                     1726.8(6)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Bruker KAPPA APEX II CCD'
_diffrn_measurement_method       'ω- and φ-scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0987
_diffrn_reflns_av_unetI/netI     0.1079
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            30152
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.994
_diffrn_reflns_theta_min         2.308
_exptl_absorpt_coefficient_mu    0.713
_exptl_absorpt_correction_T_max  0.746
_exptl_absorpt_correction_T_min  0.592
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.672
_exptl_crystal_description       plate
_exptl_crystal_F_000             880
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.830
_refine_diff_density_min         -1.375
_refine_diff_density_rms         0.115
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.994
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     495
_refine_ls_number_reflns         8302
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.994
_refine_ls_R_factor_all          0.1026
_refine_ls_R_factor_gt           0.0513
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0451P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0982
_refine_ls_wR_factor_ref         0.1139
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5316
_reflns_number_total             8302
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5ce00197h2.cif
_cod_data_source_block           5
_cod_original_cell_volume        1726.7(6)
_cod_database_code               7250144
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.870
_shelx_estimated_absorpt_t_max   0.965
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.72773(7) 0.93082(2) 0.45075(2) 0.02159(10) Uani 1 1 d . . . . .
P1 P 0.5212(2) 0.76486(6) 0.54780(6) 0.0228(3) Uani 1 1 d . . . . .
F1 F 0.1350(5) 0.79098(14) 0.91518(12) 0.0292(6) Uani 1 1 d . . . . .
F2 F 0.5438(5) 0.76567(13) 0.97111(11) 0.0241(5) Uani 1 1 d . . . . .
F3 F 0.8647(5) 0.48626(11) 0.20842(11) 0.0213(5) Uani 1 1 d . . . . .
F4 F 0.4470(5) 0.55383(12) 0.19207(11) 0.0217(5) Uani 1 1 d . . . . .
F5 F 0.8397(5) 0.74518(17) 0.54202(14) 0.0418(7) Uani 1 1 d . . . . .
F6 F 0.4224(5) 0.68717(14) 0.54116(14) 0.0394(7) Uani 1 1 d . . . . .
O1 O 0.4619(6) 0.77863(16) 0.61478(14) 0.0265(7) Uani 1 1 d . . . . .
O2 O 0.4302(7) 0.82102(19) 0.48717(15) 0.0380(9) Uani 1 1 d . . . . .
N1 N 0.7917(7) 0.93458(17) 0.56008(16) 0.0186(7) Uani 1 1 d . . . . .
N10 N 1.0269(7) 0.77521(17) 0.32520(16) 0.0171(7) Uani 1 1 d . . . . .
N11 N 0.8613(7) 0.62270(17) 0.17702(16) 0.0169(7) Uani 1 1 d . . . . .
N12 N 0.7116(7) 0.55950(18) 0.29103(17) 0.0185(7) Uani 1 1 d . . . . .
C1 C 0.9632(8) 0.8925(2) 0.6059(2) 0.0189(9) Uani 1 1 d . . . . .
H1 H 1.1295 0.8646 0.5967 0.023 Uiso 1 1 calc R U . . .
N2 N 0.5852(7) 0.96384(18) 0.59608(17) 0.0200(8) Uani 1 1 d . . . . .
N3 N 0.6260(7) 0.94145(18) 0.66048(17) 0.0193(7) Uani 1 1 d . . . . .
N4 N 0.8635(7) 0.89592(17) 0.66736(16) 0.0162(7) Uani 1 1 d . . . . .
N5 N 0.5311(7) 0.74338(18) 0.85772(17) 0.0197(7) Uani 1 1 d . . . . .
N6 N 0.4990(7) 0.87401(18) 0.87844(17) 0.0228(8) Uani 1 1 d . . . . .
N7 N 0.8668(7) 0.86753(18) 0.37037(16) 0.0190(7) Uani 1 1 d . . . . .
N8 N 0.6909(7) 0.86062(18) 0.32050(17) 0.0216(8) Uani 1 1 d . . . . .
N9 N 0.7869(7) 0.80520(18) 0.29218(17) 0.0212(8) Uani 1 1 d . . . . .
C2 C 0.9962(8) 0.8634(2) 0.73294(19) 0.0185(9) Uani 1 1 d . . . . .
H2A H 1.1121 0.9011 0.7455 0.022 Uiso 1 1 calc R U . . .
H2B H 1.1209 0.8184 0.7287 0.022 Uiso 1 1 calc R U . . .
C11 C 0.6804(9) 0.8942(2) 0.8246(2) 0.0209(9) Uani 1 1 d . . . . .
C12 C 0.9853(9) 0.6934(2) 0.7182(2) 0.0253(10) Uani 1 1 d . . . . .
H12A H 0.9880 0.6420 0.7097 0.038 Uiso 1 1 calc R U . . .
H12B H 1.1739 0.7038 0.7290 0.038 Uiso 1 1 calc R U . . .
H12C H 0.9181 0.7300 0.6780 0.038 Uiso 1 1 calc R U . . .
C13 C 0.3100(10) 0.6262(2) 0.9133(2) 0.0305(11) Uani 1 1 d . . . . .
H13A H 0.1236 0.6283 0.8941 0.046 Uiso 1 1 calc R U . . .
H13B H 0.2985 0.6484 0.9535 0.046 Uiso 1 1 calc R U . . .
H13C H 0.3857 0.5733 0.9258 0.046 Uiso 1 1 calc R U . . .
C14 C 0.2401(10) 0.9336(3) 0.9642(2) 0.0391(13) Uani 1 1 d . . . . .
H14A H 0.2534 0.9795 0.9820 0.059 Uiso 1 1 calc R U . . .
H14B H 0.2948 0.8889 0.9991 0.059 Uiso 1 1 calc R U . . .
H14C H 0.0479 0.9310 0.9502 0.059 Uiso 1 1 calc R U . . .
C15 C 0.8974(10) 1.0234(2) 0.7701(2) 0.0319(11) Uani 1 1 d . . . . .
H15A H 0.8469 1.0216 0.7240 0.048 Uiso 1 1 calc R U . . .
H15B H 1.0945 1.0063 0.7779 0.048 Uiso 1 1 calc R U . . .
H15C H 0.8648 1.0755 0.7768 0.048 Uiso 1 1 calc R U . . .
C16 C 1.0717(8) 0.8149(2) 0.3718(2) 0.0188(9) Uani 1 1 d . . . . .
H16 H 1.2271 0.8065 0.4014 0.023 Uiso 1 1 calc R U . . .
C17 C 1.1976(8) 0.7114(2) 0.3063(2) 0.0198(9) Uani 1 1 d . . . . .
H17A H 1.2934 0.6805 0.3467 0.024 Uiso 1 1 calc R U . . .
H17B H 1.3417 0.7315 0.2736 0.024 Uiso 1 1 calc R U . . .
C18 C 1.0211(8) 0.6616(2) 0.2754(2) 0.0175(9) Uani 1 1 d . . . . .
C19 C 1.0136(8) 0.6702(2) 0.2062(2) 0.0187(9) Uani 1 1 d . . . . .
C20 C 1.1379(8) 0.7223(2) 0.1516(2) 0.0206(9) Uani 1 1 d . . . . .
C21 C 1.0540(9) 0.7040(2) 0.0933(2) 0.0227(9) Uani 1 1 d . . . . .
H21 H 1.0994 0.7292 0.0491 0.027 Uiso 1 1 calc R U . . .
C22 C 0.8896(9) 0.6418(2) 0.1095(2) 0.0217(9) Uani 1 1 d . . . . .
C23 C 0.5879(9) 0.5128(2) 0.3419(2) 0.0217(9) Uani 1 1 d . . . . .
C24 C 0.6672(9) 0.5294(2) 0.4029(2) 0.0230(9) Uani 1 1 d . . . . .
H24 H 0.6091 0.5046 0.4462 0.028 Uiso 1 1 calc R U . . .
C25 C 0.8432(9) 0.5875(2) 0.3902(2) 0.0212(9) Uani 1 1 d . . . . .
C26 C 0.8721(8) 0.6067(2) 0.3185(2) 0.0188(9) Uani 1 1 d . . . . .
C27 C 1.3220(9) 0.7843(2) 0.1543(2) 0.0287(10) Uani 1 1 d . . . . .
H27A H 1.3685 0.8095 0.1084 0.043 Uiso 1 1 calc R U . . .
H27B H 1.4933 0.7627 0.1787 0.043 Uiso 1 1 calc R U . . .
H27C H 1.2249 0.8211 0.1775 0.043 Uiso 1 1 calc R U . . .
C28 C 0.7693(9) 0.5997(2) 0.0626(2) 0.0270(10) Uani 1 1 d . . . . .
H28A H 0.7870 0.6279 0.0162 0.041 Uiso 1 1 calc R U . . .
H28B H 0.5722 0.5939 0.0733 0.041 Uiso 1 1 calc R U . . .
H28C H 0.8695 0.5496 0.0675 0.041 Uiso 1 1 calc R U . . .
C29 C 0.4039(9) 0.4540(2) 0.3311(2) 0.0246(10) Uani 1 1 d . . . . .
H29A H 0.2638 0.4768 0.2969 0.037 Uiso 1 1 calc R U . . .
H29B H 0.3109 0.4334 0.3734 0.037 Uiso 1 1 calc R U . . .
H29C H 0.5161 0.4132 0.3159 0.037 Uiso 1 1 calc R U . . .
C30 C 0.9674(9) 0.6198(3) 0.4440(2) 0.0267(10) Uani 1 1 d . . . . .
H30A H 1.1706 0.6107 0.4433 0.040 Uiso 1 1 calc R U . . .
H30B H 0.8965 0.5955 0.4880 0.040 Uiso 1 1 calc R U . . .
H30C H 0.9166 0.6745 0.4359 0.040 Uiso 1 1 calc R U . . .
B016 B 0.7139(10) 0.5528(2) 0.2160(2) 0.0177(10) Uani 1 1 d . . . . .
C3 C 0.7880(8) 0.8405(2) 0.78824(19) 0.0169(8) Uani 1 1 d . . . . .
C4 C 0.7146(8) 0.7657(2) 0.80453(19) 0.0173(9) Uani 1 1 d . . . . .
C5 C 0.7950(8) 0.7001(2) 0.7763(2) 0.0195(9) Uani 1 1 d . . . . .
C6 C 0.6562(9) 0.6419(2) 0.8132(2) 0.0207(9) Uani 1 1 d . . . . .
H6 H 0.6669 0.5914 0.8064 0.025 Uiso 1 1 calc R U . . .
C7 C 0.4951(9) 0.6694(2) 0.8628(2) 0.0238(10) Uani 1 1 d . . . . .
C8 C 0.4293(9) 0.9355(2) 0.9050(2) 0.0270(10) Uani 1 1 d . . . . .
C9 C 0.5620(10) 0.9964(2) 0.8685(2) 0.0302(11) Uani 1 1 d . . . . .
H9 H 0.5444 1.0464 0.8766 0.036 Uiso 1 1 calc R U . . .
C10 C 0.7243(9) 0.9730(2) 0.8183(2) 0.0250(10) Uani 1 1 d . . . . .
B01I B 0.4210(10) 0.7923(3) 0.9081(2) 0.0224(11) Uani 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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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
N7 Ag1 N1 142.97(12) . . ?
N7 Ag1 N2 109.63(12) . 2_676 ?
N1 Ag1 N2 107.31(11) . 2_676 ?
N7 Ag1 O2 83.14(12) . . ?
N1 Ag1 O2 89.46(11) . . ?
N2 Ag1 O2 105.66(12) 2_676 . ?
O1 P1 O2 121.22(19) . . ?
O1 P1 F6 110.50(18) . . ?
O2 P1 F6 107.88(17) . . ?
O1 P1 F5 108.60(17) . . ?
O2 P1 F5 108.21(19) . . ?
F6 P1 F5 97.88(15) . . ?
P1 O2 Ag1 116.56(17) . . ?
C1 N1 N2 105.0(3) . . ?
C1 N1 Ag1 130.5(3) . . ?
N2 N1 Ag1 120.9(2) . . ?
C16 N10 N9 108.1(3) . . ?
C16 N10 C17 130.0(3) . . ?
N9 N10 C17 121.9(3) . . ?
C22 N11 C19 108.6(3) . . ?
C22 N11 B016 125.3(3) . . ?
C19 N11 B016 125.7(3) . . ?
C23 N12 C26 108.6(3) . . ?
C23 N12 B016 125.3(3) . . ?
C26 N12 B016 125.3(3) . . ?
N1 C1 N4 108.8(3) . . ?
N3 N2 N1 111.6(3) . . ?
N3 N2 Ag1 122.7(2) . 2_676 ?
N1 N2 Ag1 123.4(2) . 2_676 ?
N2 N3 N4 105.9(3) . . ?
C1 N4 N3 108.7(3) . . ?
C1 N4 C2 127.8(3) . . ?
N3 N4 C2 123.2(3) . . ?
C7 N5 C4 108.3(3) . . ?
C7 N5 B01I 125.6(4) . . ?
C4 N5 B01I 125.6(3) . . ?
C8 N6 C11 108.7(3) . . ?
C8 N6 B01I 125.7(4) . . ?
C11 N6 B01I 125.1(3) . . ?
C16 N7 N8 106.6(3) . . ?
C16 N7 Ag1 129.0(3) . . ?
N8 N7 Ag1 121.4(2) . . ?
N9 N8 N7 109.9(3) . . ?
N8 N9 N10 106.3(3) . . ?
N4 C2 C3 112.8(3) . . ?
N6 C11 C3 120.7(4) . . ?
N6 C11 C10 107.8(4) . . ?
C3 C11 C10 131.6(4) . . ?
N7 C16 N10 109.1(4) . . ?
N10 C17 C18 111.5(3) . . ?
C19 C18 C26 121.9(4) . . ?
C19 C18 C17 119.3(4) . . ?
C26 C18 C17 118.8(3) . . ?
C18 C19 N11 120.0(4) . . ?
C18 C19 C20 132.8(4) . . ?
N11 C19 C20 107.2(3) . . ?
C21 C20 C19 106.1(4) . . ?
C21 C20 C27 124.2(4) . . ?
C19 C20 C27 129.7(4) . . ?
C20 C21 C22 109.0(4) . . ?
N11 C22 C21 109.0(4) . . ?
N11 C22 C28 123.1(4) . . ?
C21 C22 C28 127.8(4) . . ?
N12 C23 C24 108.4(4) . . ?
N12 C23 C29 123.3(4) . . ?
C24 C23 C29 128.2(4) . . ?
C25 C24 C23 109.4(4) . . ?
C24 C25 C26 105.7(4) . . ?
C24 C25 C30 123.9(4) . . ?
C26 C25 C30 130.4(4) . . ?
N12 C26 C18 119.6(3) . . ?
N12 C26 C25 107.8(3) . . ?
C18 C26 C25 132.6(4) . . ?
F4 B016 F3 109.5(3) . . ?
F4 B016 N12 111.1(3) . . ?
F3 B016 N12 110.3(3) . . ?
F4 B016 N11 110.5(3) . . ?
F3 B016 N11 109.7(3) . . ?
N12 B016 N11 105.7(3) . . ?
C4 C3 C11 121.0(4) . . ?
C4 C3 C2 119.9(3) . . ?
C11 C3 C2 119.1(3) . . ?
C3 C4 N5 120.1(3) . . ?
C3 C4 C5 132.2(4) . . ?
N5 C4 C5 107.7(3) . . ?
C6 C5 C4 105.8(3) . . ?
C6 C5 C12 124.8(4) . . ?
C4 C5 C12 129.3(4) . . ?
C5 C6 C7 108.9(4) . . ?
N5 C7 C6 109.2(4) . . ?
N5 C7 C13 123.6(4) . . ?
C6 C7 C13 127.2(4) . . ?
N6 C8 C9 108.7(4) . . ?
N6 C8 C14 122.9(4) . . ?
C9 C8 C14 128.4(4) . . ?
C10 C9 C8 109.6(4) . . ?
C9 C10 C11 105.2(4) . . ?
C9 C10 C15 124.1(4) . . ?
C11 C10 C15 130.7(4) . . ?
F1 B01I F2 108.6(4) . . ?
F1 B01I N5 110.8(4) . . ?
F2 B01I N5 110.8(3) . . ?
F1 B01I N6 110.2(3) . . ?
F2 B01I N6 110.3(4) . . ?
N5 B01I N6 106.3(3) . . ?
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
Ag1 N7 2.246(3) . ?
Ag1 N1 2.262(3) . ?
Ag1 N2 2.376(3) 2_676 ?
Ag1 O2 2.522(3) . ?
P1 O1 1.453(3) . ?
P1 O2 1.472(3) . ?
P1 F6 1.552(3) . ?
P1 F5 1.556(3) . ?
F1 B01I 1.385(6) . ?
F2 B01I 1.394(5) . ?
F3 B016 1.390(5) . ?
F4 B016 1.379(5) . ?
N1 C1 1.325(5) . ?
N1 N2 1.363(4) . ?
N10 C16 1.331(5) . ?
N10 N9 1.362(4) . ?
N10 C17 1.477(4) . ?
N11 C22 1.351(5) . ?
N11 C19 1.398(5) . ?
N11 B016 1.562(5) . ?
N12 C23 1.354(5) . ?
N12 C26 1.400(5) . ?
N12 B016 1.554(6) . ?
C1 N4 1.343(5) . ?
N2 N3 1.299(4) . ?
N2 Ag1 2.376(3) 2_676 ?
N3 N4 1.347(4) . ?
N4 C2 1.473(5) . ?
N5 C7 1.346(5) . ?
N5 C4 1.399(5) . ?
N5 B01I 1.547(6) . ?
N6 C8 1.351(5) . ?
N6 C11 1.396(5) . ?
N6 B01I 1.550(6) . ?
N7 C16 1.312(5) . ?
N7 N8 1.362(4) . ?
N8 N9 1.307(4) . ?
C2 C3 1.509(6) . ?
C11 C3 1.402(5) . ?
C11 C10 1.437(6) . ?
C12 C5 1.502(6) . ?
C13 C7 1.486(6) . ?
C14 C8 1.493(6) . ?
C15 C10 1.486(6) . ?
C17 C18 1.518(5) . ?
C18 C19 1.382(5) . ?
C18 C26 1.414(6) . ?
C19 C20 1.453(6) . ?
C20 C21 1.369(6) . ?
C20 C27 1.494(6) . ?
C21 C22 1.409(6) . ?
C22 C28 1.487(5) . ?
C23 C24 1.399(6) . ?
C23 C29 1.490(6) . ?
C24 C25 1.383(6) . ?
C25 C26 1.432(6) . ?
C25 C30 1.496(6) . ?
C3 C4 1.398(5) . ?
C4 C5 1.446(5) . ?
C5 C6 1.373(6) . ?
C6 C7 1.409(6) . ?
C8 C9 1.390(6) . ?
C9 C10 1.390(6) . ?
