#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/14/7001489.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_7001489
loop_
_publ_author_name
'Li, Hao-Hong'
'Chen, Zhi-Rong'
'Cheng, Li-Chuan'
'Feng, Miao'
'Zheng, Hui-Dong'
'Li, Jun-Qian'
_publ_section_title
;
 Three silver iodides with zero and one-dimensional hybrid structures
 directed by conjugated organic templates: synthesis and theoretical
 study
;
_journal_issue                   25
_journal_name_full               'Dalton Transactions'
_journal_page_first              4888
_journal_page_last               4895
_journal_paper_doi               10.1039/b902465d
_journal_year                    2009
_chemical_formula_moiety         '2(C14 H18 N), 0.5(Ag2 I10)'
_chemical_formula_sum            'C28 H36 Ag I5 N2'
_chemical_formula_weight         1142.96
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                96.627(2)
_cell_angle_beta                 101.964(2)
_cell_angle_gamma                113.395(4)
_cell_formula_units_Z            2
_cell_length_a                   10.4611(12)
_cell_length_b                   12.2477(14)
_cell_length_c                   15.6559(14)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      18
_cell_measurement_theta_min      12
_cell_volume                     1756.8(3)
_computing_cell_refinement       'TEXRAY software'
_computing_data_collection
'TEXRAY software (Molecular Structure Corporation, 1999)'
_computing_data_reduction
'TEXSAN (Molecular Structure Corporation, 1999)'
_computing_molecular_graphics    'ORTEX (P.McArdle, 1995)'
_computing_publication_material  'SHELXL-97/2 (Sheldrick,1997)')'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean None
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'Rigaku Weissenberg IP'
_diffrn_measurement_method       'scintillation counter'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotor target'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0252
_diffrn_reflns_av_sigmaI/netI    0.0395
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            13577
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         2.46
_diffrn_standards_decay_%        'not measured'
_diffrn_standards_interval_count 'not measured'
_diffrn_standards_interval_time  'not measured'
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    4.986
_exptl_absorpt_correction_T_max  1.00
_exptl_absorpt_correction_T_min  0.25
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'TEXRAY software (Molecular Structure Corporation, 1999)'
_exptl_crystal_colour            Colourless
_exptl_crystal_density_diffrn    2.161
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             1060
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.240
_refine_diff_density_min         -1.326
_refine_diff_density_rms         0.144
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     329
_refine_ls_number_reflns         7924
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.022
_refine_ls_R_factor_all          0.0554
_refine_ls_R_factor_gt           0.0389
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0510P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0971
_refine_ls_wR_factor_ref         0.1038
_reflns_number_gt                5726
_reflns_number_total             7924
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b902465d.txt
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-Scan' changed
to 'multi-scan' 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_Hall     -P1
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7001489
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.50571(5) 0.06807(5) 0.42305(4) 0.06438(15) Uani 1 1 d . . .
I1 I 0.26189(4) -0.01379(4) 0.49354(3) 0.05610(12) Uani 1 1 d . . .
I2 I 0.59974(3) 0.29778(3) 0.38591(2) 0.04372(10) Uani 1 1 d . . .
I3 I 0.39925(4) -0.08931(3) 0.23791(3) 0.05873(12) Uani 1 1 d . . .
I4 I 0.09590(5) -0.27286(4) 0.12944(3) 0.05743(12) Uani 1 1 d . . .
I5 I -0.18193(5) -0.44960(5) 0.02578(3) 0.07393(15) Uani 1 1 d . . .
N1 N 0.7163(4) 0.4154(4) 0.6280(3) 0.0391(9) Uani 1 1 d . . .
N2 N 0.9033(5) 0.8837(4) 0.7775(3) 0.0463(10) Uani 1 1 d . . .
C1 C 0.7918(6) 0.3508(5) 0.6393(4) 0.0510(13) Uani 1 1 d . . .
H1 H 0.7479 0.2741 0.6515 0.061 Uiso 1 1 calc R . .
C2 C 0.9316(6) 0.3916(6) 0.6339(4) 0.0559(15) Uani 1 1 d . . .
H2 H 0.9830 0.3455 0.6451 0.067 Uiso 1 1 calc R . .
C3 C 0.9932(6) 0.5005(6) 0.6118(4) 0.0523(14) Uani 1 1 d . . .
H3 H 1.0877 0.5291 0.6072 0.063 Uiso 1 1 calc R . .
C4 C 0.9165(5) 0.5706(5) 0.5956(3) 0.0404(11) Uani 1 1 d . . .
C5 C 0.9742(6) 0.6824(5) 0.5681(4) 0.0503(13) Uani 1 1 d . . .
H5 H 1.0670 0.7118 0.5606 0.060 Uiso 1 1 calc R . .
C6 C 0.8951(6) 0.7470(5) 0.5526(4) 0.0537(14) Uani 1 1 d . . .
H6 H 0.9332 0.8195 0.5336 0.064 Uiso 1 1 calc R . .
C7 C 0.7559(6) 0.7040(5) 0.5652(4) 0.0512(13) Uani 1 1 d . . .
H7 H 0.7034 0.7496 0.5556 0.061 Uiso 1 1 calc R . .
C8 C 0.6960(5) 0.5966(5) 0.5914(3) 0.0415(12) Uani 1 1 d . . .
H8 H 0.6039 0.5696 0.5997 0.050 Uiso 1 1 calc R . .
C9 C 0.7746(5) 0.5275(4) 0.6054(3) 0.0370(11) Uani 1 1 d . . .
C10 C 0.5672(5) 0.3621(5) 0.6383(4) 0.0453(12) Uani 1 1 d . . .
H10A H 0.5273 0.2738 0.6227 0.054 Uiso 1 1 calc R . .
H10B H 0.5062 0.3870 0.5974 0.054 Uiso 1 1 calc R . .
C11 C 0.5661(6) 0.4021(5) 0.7326(4) 0.0502(13) Uani 1 1 d . . .
H11A H 0.5928 0.4889 0.7450 0.060 Uiso 1 1 calc R . .
H11B H 0.6379 0.3880 0.7739 0.060 Uiso 1 1 calc R . .
C12 C 0.4176(6) 0.3341(6) 0.7480(4) 0.0568(15) Uani 1 1 d . . .
H12 H 0.3812 0.2478 0.7196 0.068 Uiso 1 1 calc R . .
C13 C 0.3089(7) 0.3774(8) 0.7057(5) 0.081(2) Uani 1 1 d . . .
H13A H 0.2205 0.3377 0.7218 0.122 Uiso 1 1 calc R . .
H13B H 0.2897 0.3581 0.6418 0.122 Uiso 1 1 calc R . .
H13C H 0.3470 0.4641 0.7265 0.122 Uiso 1 1 calc R . .
C14 C 0.4309(9) 0.3420(9) 0.8462(5) 0.093(3) Uani 1 1 d . . .
H14A H 0.4603 0.4249 0.8754 0.139 Uiso 1 1 calc R . .
H14B H 0.5020 0.3151 0.8717 0.139 Uiso 1 1 calc R . .
H14C H 0.3389 0.2910 0.8541 0.139 Uiso 1 1 calc R . .
C15 C 0.9382(8) 0.9777(6) 0.7375(4) 0.0641(17) Uani 1 1 d . . .
H15 H 0.8742 1.0129 0.7255 0.077 Uiso 1 1 calc R . .
C16 C 1.0636(8) 1.0242(6) 0.7134(5) 0.0708(19) Uani 1 1 d . . .
H16 H 1.0855 1.0907 0.6865 0.085 Uiso 1 1 calc R . .
C17 C 1.1571(7) 0.9718(7) 0.7293(4) 0.0681(18) Uani 1 1 d . . .
H17 H 1.2430 1.0026 0.7129 0.082 Uiso 1 1 calc R . .
C18 C 1.1245(6) 0.8716(5) 0.7704(4) 0.0490(13) Uani 1 1 d D . .
C19 C 1.2149(7) 0.8127(7) 0.7853(4) 0.0699(19) Uani 1 1 d D . .
H19 H 1.3014 0.8415 0.7695 0.084 Uiso 1 1 calc R . .
C20 C 1.1771(8) 0.7125(8) 0.8232(5) 0.079(2) Uani 1 1 d D . .
H20 H 1.2359 0.6720 0.8313 0.095 Uiso 1 1 calc R . .
C21 C 1.0476(8) 0.6720(7) 0.8496(5) 0.0708(19) Uani 1 1 d . . .
H21 H 1.0233 0.6058 0.8769 0.085 Uiso 1 1 calc R . .
C22 C 0.9586(6) 0.7271(6) 0.8362(4) 0.0557(15) Uani 1 1 d . . .
H22 H 0.8741 0.6992 0.8543 0.067 Uiso 1 1 calc R . .
C23 C 0.9933(5) 0.8257(5) 0.7952(4) 0.0448(12) Uani 1 1 d . . .
C24 C 0.7654(6) 0.8434(6) 0.8041(4) 0.0539(14) Uani 1 1 d . . .
H24A H 0.7200 0.7551 0.7939 0.065 Uiso 1 1 calc R . .
H24B H 0.6995 0.8676 0.7667 0.065 Uiso 1 1 calc R . .
C25 C 0.7896(6) 0.8967(6) 0.9010(4) 0.0534(14) Uani 1 1 d . . .
H25A H 0.8421 0.9848 0.9125 0.064 Uiso 1 1 calc R . .
H25B H 0.8486 0.8669 0.9386 0.064 Uiso 1 1 calc R . .
C26 C 0.6464(8) 0.8634(6) 0.9254(4) 0.0697(18) Uani 1 1 d D . .
H26 H 0.5853 0.8902 0.8852 0.084 Uiso 1 1 calc R . .
C27 C 0.5644(8) 0.7274(7) 0.9181(5) 0.085(2) Uani 1 1 d D . .
H27A H 0.5262 0.6860 0.8561 0.128 Uiso 1 1 calc R . .
H27B H 0.4861 0.7126 0.9449 0.128 Uiso 1 1 calc R . .
H27C H 0.6290 0.6975 0.9485 0.128 Uiso 1 1 calc R . .
C28 C 0.6815(12) 0.9323(10) 1.0204(6) 0.139(5) Uani 1 1 d D . .
H28A H 0.5931 0.9197 1.0355 0.209 Uiso 1 1 calc R . .
H28B H 0.7375 1.0177 1.0251 0.209 Uiso 1 1 calc R . .
H28C H 0.7363 0.9030 1.0608 0.209 Uiso 1 1 calc R . .
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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
I I -0.4742 1.8119 '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
I2 Ag1 I1 117.93(2) . . ?
I2 Ag1 I1 113.31(2) . 2_656 ?
I1 Ag1 I1 114.80(2) . 2_656 ?
I2 Ag1 I3 100.89(2) . . ?
I1 Ag1 I3 104.81(2) . . ?
I1 Ag1 I3 102.15(2) 2_656 . ?
I2 Ag1 Ag1 143.29(3) . 2_656 ?
I1 Ag1 Ag1 57.692(17) . 2_656 ?
I1 Ag1 Ag1 57.111(18) 2_656 2_656 ?
I3 Ag1 Ag1 115.63(3) . 2_656 ?
Ag1 I1 Ag1 65.20(2) . 2_656 ?
Ag1 I3 I4 130.596(19) . . ?
I5 I4 I3 177.772(19) . . ?
C1 N1 C9 120.5(4) . . ?
C1 N1 C10 117.7(4) . . ?
C9 N1 C10 121.8(4) . . ?
C15 N2 C23 121.2(5) . . ?
C15 N2 C24 118.1(5) . . ?
C23 N2 C24 120.7(5) . . ?
N1 C1 C2 123.1(5) . . ?
N1 C1 H1 118.5 . . ?
C2 C1 H1 118.5 . . ?
C3 C2 C1 118.6(5) . . ?
C3 C2 H2 120.7 . . ?
C1 C2 H2 120.7 . . ?
C2 C3 C4 120.8(5) . . ?
C2 C3 H3 119.6 . . ?
C4 C3 H3 119.6 . . ?
C3 C4 C9 118.9(5) . . ?
C3 C4 C5 122.7(5) . . ?
C9 C4 C5 118.4(5) . . ?
C6 C5 C4 120.6(5) . . ?
C6 C5 H5 119.7 . . ?
C4 C5 H5 119.7 . . ?
C5 C6 C7 119.9(5) . . ?
C5 C6 H6 120.0 . . ?
C7 C6 H6 120.0 . . ?
C8 C7 C6 121.4(5) . . ?
C8 C7 H7 119.3 . . ?
C6 C7 H7 119.3 . . ?
C7 C8 C9 119.4(5) . . ?
C7 C8 H8 120.3 . . ?
C9 C8 H8 120.3 . . ?
N1 C9 C8 121.7(4) . . ?
N1 C9 C4 118.1(4) . . ?
C8 C9 C4 120.3(5) . . ?
N1 C10 C11 111.4(4) . . ?
N1 C10 H10A 109.3 . . ?
C11 C10 H10A 109.3 . . ?
N1 C10 H10B 109.3 . . ?
C11 C10 H10B 109.3 . . ?
H10A C10 H10B 108.0 . . ?
C10 C11 C12 112.2(5) . . ?
C10 C11 H11A 109.2 . . ?
C12 C11 H11A 109.2 . . ?
C10 C11 H11B 109.2 . . ?
C12 C11 H11B 109.2 . . ?
H11A C11 H11B 107.9 . . ?
C14 C12 C13 111.2(6) . . ?
C14 C12 C11 110.7(5) . . ?
C13 C12 C11 112.5(5) . . ?
C14 C12 H12 107.4 . . ?
C13 C12 H12 107.4 . . ?
C11 C12 H12 107.4 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
N2 C15 C16 122.7(6) . . ?
N2 C15 H15 118.7 . . ?
C16 C15 H15 118.7 . . ?
C15 C16 C17 119.1(6) . . ?
C15 C16 H16 120.5 . . ?
C17 C16 H16 120.5 . . ?
C16 C17 C18 120.5(6) . . ?
C16 C17 H17 119.8 . . ?
C18 C17 H17 119.8 . . ?
C17 C18 C19 122.4(6) . . ?
C17 C18 C23 119.1(6) . . ?
C19 C18 C23 118.5(6) . . ?
C20 C19 C18 120.7(6) . . ?
C20 C19 H19 119.7 . . ?
C18 C19 H19 119.7 . . ?
C19 C20 C21 119.1(6) . . ?
C19 C20 H20 120.5 . . ?
C21 C20 H20 120.5 . . ?
C22 C21 C20 121.4(7) . . ?
C22 C21 H21 119.3 . . ?
C20 C21 H21 119.3 . . ?
C21 C22 C23 119.9(6) . . ?
C21 C22 H22 120.0 . . ?
C23 C22 H22 120.0 . . ?
C22 C23 N2 122.2(5) . . ?
C22 C23 C18 120.3(5) . . ?
N2 C23 C18 117.5(5) . . ?
N2 C24 C25 112.3(4) . . ?
N2 C24 H24A 109.1 . . ?
C25 C24 H24A 109.1 . . ?
N2 C24 H24B 109.1 . . ?
C25 C24 H24B 109.1 . . ?
H24A C24 H24B 107.9 . . ?
C24 C25 C26 111.8(5) . . ?
C24 C25 H25A 109.3 . . ?
C26 C25 H25A 109.3 . . ?
C24 C25 H25B 109.3 . . ?
C26 C25 H25B 109.3 . . ?
H25A C25 H25B 107.9 . . ?
C28 C26 C27 110.1(7) . . ?
C28 C26 C25 107.6(6) . . ?
C27 C26 C25 112.5(6) . . ?
C28 C26 H26 108.8 . . ?
C27 C26 H26 108.8 . . ?
C25 C26 H26 108.8 . . ?
C26 C27 H27A 109.5 . . ?
C26 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C26 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C26 C28 H28A 109.5 . . ?
C26 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C26 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
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 I2 2.7637(7) . ?
Ag1 I1 2.8496(7) . ?
Ag1 I1 2.8681(7) 2_656 ?
Ag1 I3 3.0041(7) . ?
Ag1 Ag1 3.0804(10) 2_656 ?
I1 Ag1 2.8681(7) 2_656 ?
I3 I4 3.0376(6) . ?
I4 I5 2.8292(7) . ?
N1 C1 1.324(7) . ?
N1 C9 1.385(6) . ?
N1 C10 1.485(6) . ?
N2 C15 1.334(8) . ?
N2 C23 1.392(7) . ?
N2 C24 1.493(7) . ?
C1 C2 1.369(7) . ?
C1 H1 0.9300 . ?
C2 C3 1.353(8) . ?
C2 H2 0.9300 . ?
C3 C4 1.399(7) . ?
C3 H3 0.9300 . ?
C4 C9 1.413(6) . ?
C4 C5 1.418(8) . ?
C5 C6 1.360(8) . ?
C5 H5 0.9300 . ?
C6 C7 1.405(8) . ?
C6 H6 0.9300 . ?
C7 C8 1.366(8) . ?
C7 H7 0.9300 . ?
C8 C9 1.401(7) . ?
C8 H8 0.9300 . ?
C10 C11 1.504(7) . ?
C10 H10A 0.9700 . ?
C10 H10B 0.9700 . ?
C11 C12 1.530(7) . ?
C11 H11A 0.9700 . ?
C11 H11B 0.9700 . ?
C12 C14 1.502(9) . ?
C12 C13 1.504(9) . ?
C12 H12 0.9800 . ?
C13 H13A 0.9600 . ?
C13 H13B 0.9600 . ?
C13 H13C 0.9600 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 C16 1.360(9) . ?
C15 H15 0.9300 . ?
C16 C17 1.365(10) . ?
C16 H16 0.9300 . ?
C17 C18 1.406(9) . ?
C17 H17 0.9300 . ?
C18 C19 1.400(8) . ?
C18 C23 1.417(7) . ?
C19 C20 1.376(9) . ?
C19 H19 0.9300 . ?
C20 C21 1.413(10) . ?
C20 H20 0.9300 . ?
C21 C22 1.348(8) . ?
C21 H21 0.9300 . ?
C22 C23 1.389(8) . ?
C22 H22 0.9300 . ?
C24 C25 1.507(7) . ?
C24 H24A 0.9700 . ?
C24 H24B 0.9700 . ?
C25 C26 1.531(8) . ?
C25 H25A 0.9700 . ?
C25 H25B 0.9700 . ?
C26 C28 1.515(9) . ?
C26 C27 1.518(9) . ?
C26 H26 0.9800 . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
