#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:35:19 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179852 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/48/7014859.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_7014859
loop_
_publ_author_name
'Long, Ying-Yun'
'Ye, Wei-Ping'
'Tao, Ping'
'Li, Yue-Sheng'
_publ_section_title
;
 Novel heteroligated titanium complexes with fluorinated
 salicylaldiminato and β-enaminoketonato ligands: synthesis,
 characterization and catalytic behavior in vinyl addition
 polymerization of norbornene.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1610
_journal_page_last               1618
_journal_paper_doi               10.1039/c0dt01225d
_journal_volume                  40
_journal_year                    2011
_chemical_formula_sum            'C33 H22 Cl4 F8 N2 O2 Ti'
_chemical_formula_weight         820.23
_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                 99.9460(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.5344(5)
_cell_length_b                   12.2293(4)
_cell_length_c                   20.8540(8)
_cell_measurement_reflns_used    7615
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      26.06
_cell_measurement_theta_min      2.36
_cell_volume                     3399.8(2)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_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 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEXII CCD'
_diffrn_measurement_method       'φ and ω 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  0.0338
_diffrn_reflns_av_sigmaI/netI    0.0407
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            18614
_diffrn_reflns_theta_full        26.07
_diffrn_reflns_theta_max         26.07
_diffrn_reflns_theta_min         1.94
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.645
_exptl_absorpt_correction_T_max  0.9324
_exptl_absorpt_correction_T_min  0.8105
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   (SADABS)
_exptl_crystal_density_diffrn    1.602
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1648
_exptl_crystal_size_max          0.34
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.11
_refine_diff_density_max         0.296
_refine_diff_density_min         -0.355
_refine_diff_density_rms         0.053
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     454
_refine_ls_number_reflns         6720
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.026
_refine_ls_R_factor_all          0.0523
_refine_ls_R_factor_gt           0.0354
_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)+(0.0331P)²+1.2333P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0774
_refine_ls_wR_factor_ref         0.0855
_reflns_number_gt                5093
_reflns_number_total             6720
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0DT01225D.TXT
_cod_data_source_block           lyy5
_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 1555 2011-01-17 13:19:09Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7014859
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
Ti1 Ti 0.22155(3) 0.15160(3) 0.115619(18) 0.02291(10) Uani 1 1 d . . .
C1 C 0.38516(15) 0.31356(16) 0.09946(10) 0.0225(5) Uani 1 1 d . . .
C2 C 0.47431(16) 0.31883(17) 0.07337(10) 0.0248(5) Uani 1 1 d . . .
C3 C 0.52181(17) 0.42012(18) 0.07793(11) 0.0324(5) Uani 1 1 d . . .
H3 H 0.5798 0.4275 0.0600 0.039 Uiso 1 1 calc R . .
C4 C 0.48769(18) 0.51089(19) 0.10775(12) 0.0380(6) Uani 1 1 d . . .
H4 H 0.5208 0.5776 0.1079 0.046 Uiso 1 1 calc R . .
C5 C 0.40491(18) 0.50131(18) 0.13695(12) 0.0347(6) Uani 1 1 d . . .
H5 H 0.3836 0.5603 0.1592 0.042 Uiso 1 1 calc R . .
C6 C 0.35256(16) 0.40193(17) 0.13312(10) 0.0253(5) Uani 1 1 d . . .
C7 C 0.51887(16) 0.21822(18) 0.04460(11) 0.0279(5) Uani 1 1 d . . .
C8 C 0.53844(18) 0.12819(19) 0.09685(12) 0.0352(6) Uani 1 1 d . . .
H8A H 0.4758 0.1048 0.1080 0.053 Uiso 1 1 calc R . .
H8B H 0.5808 0.1565 0.1349 0.053 Uiso 1 1 calc R . .
H8C H 0.5709 0.0672 0.0802 0.053 Uiso 1 1 calc R . .
C9 C 0.44705(18) 0.1760(2) -0.01519(12) 0.0398(6) Uani 1 1 d . . .
H9A H 0.4321 0.2339 -0.0464 0.060 Uiso 1 1 calc R . .
H9B H 0.3861 0.1512 -0.0023 0.060 Uiso 1 1 calc R . .
H9C H 0.4779 0.1165 -0.0343 0.060 Uiso 1 1 calc R . .
C10 C 0.61904(17) 0.2456(2) 0.02370(12) 0.0353(6) Uani 1 1 d . . .
H10A H 0.6455 0.1813 0.0065 0.053 Uiso 1 1 calc R . .
H10B H 0.6656 0.2714 0.0607 0.053 Uiso 1 1 calc R . .
H10C H 0.6088 0.3015 -0.0091 0.053 Uiso 1 1 calc R . .
C11 C 0.26889(16) 0.39384(17) 0.16658(10) 0.0256(5) Uani 1 1 d . . .
H11 H 0.2538 0.4559 0.1888 0.031 Uiso 1 1 calc R . .
C12 C 0.13513(16) 0.32652(17) 0.20778(10) 0.0242(5) Uani 1 1 d . . .
C13 C 0.04872(17) 0.38391(18) 0.18375(10) 0.0292(5) Uani 1 1 d . . .
C14 C -0.02479(17) 0.4015(2) 0.22097(12) 0.0346(6) Uani 1 1 d . . .
C15 C -0.01281(18) 0.36105(19) 0.28298(12) 0.0349(6) Uani 1 1 d . . .
C16 C 0.07264(19) 0.30504(19) 0.30813(11) 0.0340(6) Uani 1 1 d . . .
C17 C 0.14550(18) 0.28796(18) 0.27075(11) 0.0308(5) Uani 1 1 d . . .
C18 C 0.15517(16) 0.29334(18) -0.00760(10) 0.0270(5) Uani 1 1 d . . .
C19 C 0.17569(17) 0.40339(19) 0.00218(11) 0.0328(5) Uani 1 1 d . . .
H19 H 0.1585 0.4390 0.0381 0.039 Uiso 1 1 calc R . .
C20 C 0.22200(19) 0.4604(2) -0.04178(12) 0.0401(6) Uani 1 1 d . . .
H20 H 0.2355 0.5346 -0.0356 0.048 Uiso 1 1 calc R . .
C21 C 0.24797(18) 0.4074(2) -0.09446(12) 0.0421(6) Uani 1 1 d . . .
H21 H 0.2794 0.4456 -0.1238 0.051 Uiso 1 1 calc R . .
C22 C 0.22761(19) 0.2977(2) -0.10390(12) 0.0421(6) Uani 1 1 d . . .
H22 H 0.2451 0.2624 -0.1398 0.051 Uiso 1 1 calc R . .
C23 C 0.18158(18) 0.2396(2) -0.06058(11) 0.0351(6) Uani 1 1 d . . .
H23 H 0.1685 0.1653 -0.0669 0.042 Uiso 1 1 calc R . .
C24 C 0.01255(17) 0.22232(17) 0.03229(10) 0.0266(5) Uani 1 1 d . . .
C25 C -0.05558(18) 0.2754(2) -0.02592(12) 0.0345(6) Uani 1 1 d . . .
C26 C -0.03956(17) 0.16243(18) 0.07442(11) 0.0306(5) Uani 1 1 d . . .
H26 H -0.1090 0.1570 0.0635 0.037 Uiso 1 1 calc R . .
C27 C 0.00668(16) 0.11256(17) 0.12986(11) 0.0264(5) Uani 1 1 d . . .
C28 C -0.04834(16) 0.04299(19) 0.17057(10) 0.0284(5) Uani 1 1 d . . .
C29 C -0.13709(18) 0.0709(2) 0.19168(12) 0.0364(6) Uani 1 1 d . . .
C30 C -0.1845(2) -0.0017(2) 0.22738(12) 0.0472(7) Uani 1 1 d . . .
H30 H -0.2437 0.0184 0.2412 0.057 Uiso 1 1 calc R . .
C31 C -0.1439(2) -0.1034(2) 0.24226(13) 0.0498(7) Uani 1 1 d . . .
H31 H -0.1760 -0.1528 0.2657 0.060 Uiso 1 1 calc R . .
C32 C -0.0555(2) -0.1319(2) 0.22234(11) 0.0397(6) Uani 1 1 d . . .
C33 C -0.00726(18) -0.05929(19) 0.18771(11) 0.0318(5) Uani 1 1 d . . .
H33 H 0.0534 -0.0789 0.1757 0.038 Uiso 1 1 calc R . .
Cl1 Cl 0.31306(4) 0.06681(5) 0.20370(3) 0.03594(15) Uani 1 1 d . . .
Cl2 Cl 0.21501(5) 0.00922(5) 0.04583(3) 0.04215(16) Uani 1 1 d . . .
Cl3 Cl -0.18945(5) 0.20069(6) 0.17745(3) 0.04976(18) Uani 1 1 d . . .
Cl4 Cl -0.00293(7) -0.25925(6) 0.24106(3) 0.0591(2) Uani 1 1 d . . .
F1 F 0.03573(10) 0.42530(12) 0.12345(6) 0.0434(4) Uani 1 1 d . . .
F2 F -0.10816(11) 0.45667(14) 0.19633(7) 0.0554(4) Uani 1 1 d . . .
F3 F -0.08474(11) 0.37719(13) 0.31891(7) 0.0530(4) Uani 1 1 d . . .
F4 F 0.08586(13) 0.26834(12) 0.36947(7) 0.0557(4) Uani 1 1 d . . .
F5 F 0.22979(11) 0.23672(12) 0.29759(7) 0.0491(4) Uani 1 1 d . . .
F6 F -0.15228(10) 0.26626(13) -0.02232(7) 0.0512(4) Uani 1 1 d . . .
F7 F -0.03870(12) 0.38131(12) -0.03039(8) 0.0589(5) Uani 1 1 d . . .
F8 F -0.04370(12) 0.22932(15) -0.08141(7) 0.0634(5) Uani 1 1 d . . .
N1 N 0.21200(13) 0.30937(14) 0.16913(8) 0.0230(4) Uani 1 1 d . . .
N2 N 0.10996(13) 0.23248(14) 0.03976(8) 0.0252(4) Uani 1 1 d . . .
O1 O 0.32824(10) 0.22304(11) 0.09323(7) 0.0233(3) Uani 1 1 d . . .
O2 O 0.10271(11) 0.11603(12) 0.15011(7) 0.0282(3) 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'
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ti Ti 0.2776 0.4457 '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'
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
O1 Ti1 O2 163.53(6) . . ?
O1 Ti1 N2 94.34(6) . . ?
O2 Ti1 N2 81.79(6) . . ?
O1 Ti1 N1 80.26(6) . . ?
O2 Ti1 N1 83.38(6) . . ?
N2 Ti1 N1 83.16(6) . . ?
O1 Ti1 Cl2 98.59(5) . . ?
O2 Ti1 Cl2 97.14(5) . . ?
N2 Ti1 Cl2 86.46(5) . . ?
N1 Ti1 Cl2 169.43(5) . . ?
O1 Ti1 Cl1 94.62(5) . . ?
O2 Ti1 Cl1 88.22(5) . . ?
N2 Ti1 Cl1 169.75(5) . . ?
N1 Ti1 Cl1 93.46(5) . . ?
Cl2 Ti1 Cl1 97.11(3) . . ?
O1 C1 C6 117.36(18) . . ?
O1 C1 C2 121.08(18) . . ?
C6 C1 C2 121.57(19) . . ?
C3 C2 C1 115.5(2) . . ?
C3 C2 C7 122.11(19) . . ?
C1 C2 C7 122.30(19) . . ?
C4 C3 C2 123.8(2) . . ?
C4 C3 H3 118.1 . . ?
C2 C3 H3 118.1 . . ?
C5 C4 C3 119.4(2) . . ?
C5 C4 H4 120.3 . . ?
C3 C4 H4 120.3 . . ?
C4 C5 C6 119.5(2) . . ?
C4 C5 H5 120.2 . . ?
C6 C5 H5 120.2 . . ?
C5 C6 C1 119.82(19) . . ?
C5 C6 C11 117.80(19) . . ?
C1 C6 C11 122.33(19) . . ?
C9 C7 C10 108.10(18) . . ?
C9 C7 C2 110.54(19) . . ?
C10 C7 C2 111.23(18) . . ?
C9 C7 C8 110.03(19) . . ?
C10 C7 C8 107.79(19) . . ?
C2 C7 C8 109.11(17) . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C7 C10 H10A 109.5 . . ?
C7 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C7 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
N1 C11 C6 126.93(19) . . ?
N1 C11 H11 116.5 . . ?
C6 C11 H11 116.5 . . ?
C17 C12 C13 117.36(19) . . ?
C17 C12 N1 121.30(19) . . ?
C13 C12 N1 121.34(19) . . ?
F1 C13 C14 118.6(2) . . ?
F1 C13 C12 119.89(19) . . ?
C14 C13 C12 121.5(2) . . ?
F2 C14 C15 120.0(2) . . ?
F2 C14 C13 120.3(2) . . ?
C15 C14 C13 119.7(2) . . ?
F3 C15 C14 119.7(2) . . ?
F3 C15 C16 120.4(2) . . ?
C14 C15 C16 119.9(2) . . ?
F4 C16 C15 119.9(2) . . ?
F4 C16 C17 120.0(2) . . ?
C15 C16 C17 120.0(2) . . ?
F5 C17 C16 118.5(2) . . ?
F5 C17 C12 119.86(19) . . ?
C16 C17 C12 121.5(2) . . ?
C19 C18 C23 120.5(2) . . ?
C19 C18 N2 119.72(19) . . ?
C23 C18 N2 119.7(2) . . ?
C18 C19 C20 119.7(2) . . ?
C18 C19 H19 120.2 . . ?
C20 C19 H19 120.2 . . ?
C21 C20 C19 120.0(2) . . ?
C21 C20 H20 120.0 . . ?
C19 C20 H20 120.0 . . ?
C20 C21 C22 120.2(2) . . ?
C20 C21 H21 119.9 . . ?
C22 C21 H21 119.9 . . ?
C21 C22 C23 120.7(2) . . ?
C21 C22 H22 119.7 . . ?
C23 C22 H22 119.7 . . ?
C22 C23 C18 119.1(2) . . ?
C22 C23 H23 120.5 . . ?
C18 C23 H23 120.5 . . ?
N2 C24 C26 125.0(2) . . ?
N2 C24 C25 120.65(19) . . ?
C26 C24 C25 114.3(2) . . ?
F8 C25 F7 107.9(2) . . ?
F8 C25 F6 106.5(2) . . ?
F7 C25 F6 105.68(19) . . ?
F8 C25 C24 111.40(19) . . ?
F7 C25 C24 112.5(2) . . ?
F6 C25 C24 112.51(19) . . ?
C27 C26 C24 123.5(2) . . ?
C27 C26 H26 118.3 . . ?
C24 C26 H26 118.3 . . ?
O2 C27 C26 123.4(2) . . ?
O2 C27 C28 113.90(19) . . ?
C26 C27 C28 122.6(2) . . ?
C33 C28 C29 117.9(2) . . ?
C33 C28 C27 116.3(2) . . ?
C29 C28 C27 125.8(2) . . ?
C30 C29 C28 121.2(2) . . ?
C30 C29 Cl3 117.5(2) . . ?
C28 C29 Cl3 121.15(18) . . ?
C31 C30 C29 119.8(3) . . ?
C31 C30 H30 120.1 . . ?
C29 C30 H30 120.1 . . ?
C30 C31 C32 119.7(2) . . ?
C30 C31 H31 120.1 . . ?
C32 C31 H31 120.1 . . ?
C31 C32 C33 120.7(2) . . ?
C31 C32 Cl4 120.3(2) . . ?
C33 C32 Cl4 119.0(2) . . ?
C32 C33 C28 120.7(2) . . ?
C32 C33 H33 119.7 . . ?
C28 C33 H33 119.7 . . ?
C11 N1 C12 113.57(17) . . ?
C11 N1 Ti1 125.43(14) . . ?
C12 N1 Ti1 120.92(13) . . ?
C24 N2 C18 120.16(18) . . ?
C24 N2 Ti1 126.18(14) . . ?
C18 N2 Ti1 113.42(13) . . ?
C1 O1 Ti1 147.18(13) . . ?
C27 O2 Ti1 137.95(14) . . ?
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
Ti1 O1 1.8164(14) . ?
Ti1 O2 1.9218(14) . ?
Ti1 N2 2.2219(18) . ?
Ti1 N1 2.2439(17) . ?
Ti1 Cl2 2.2612(7) . ?
Ti1 Cl1 2.2797(7) . ?
C1 O1 1.342(2) . ?
C1 C6 1.401(3) . ?
C1 C2 1.408(3) . ?
C2 C3 1.391(3) . ?
C2 C7 1.537(3) . ?
C3 C4 1.390(3) . ?
C3 H3 0.9300 . ?
C4 C5 1.370(3) . ?
C4 H4 0.9300 . ?
C5 C6 1.402(3) . ?
C5 H5 0.9300 . ?
C6 C11 1.432(3) . ?
C7 C9 1.532(3) . ?
C7 C10 1.531(3) . ?
C7 C8 1.539(3) . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C11 N1 1.295(3) . ?
C11 H11 0.9300 . ?
C12 C17 1.379(3) . ?
C12 C13 1.382(3) . ?
C12 N1 1.437(2) . ?
C13 F1 1.339(2) . ?
C13 C14 1.380(3) . ?
C14 F2 1.339(3) . ?
C14 C15 1.368(3) . ?
C15 F3 1.342(2) . ?
C15 C16 1.368(3) . ?
C16 F4 1.338(2) . ?
C16 C17 1.375(3) . ?
C17 F5 1.337(3) . ?
C18 C19 1.382(3) . ?
C18 C23 1.385(3) . ?
C18 N2 1.454(3) . ?
C19 C20 1.385(3) . ?
C19 H19 0.9300 . ?
C20 C21 1.373(4) . ?
C20 H20 0.9300 . ?
C21 C22 1.377(4) . ?
C21 H21 0.9300 . ?
C22 C23 1.380(3) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 N2 1.306(3) . ?
C24 C26 1.421(3) . ?
C24 C25 1.536(3) . ?
C25 F8 1.321(3) . ?
C25 F7 1.322(3) . ?
C25 F6 1.329(3) . ?
C26 C27 1.360(3) . ?
C26 H26 0.9300 . ?
C27 O2 1.296(2) . ?
C27 C28 1.489(3) . ?
C28 C33 1.390(3) . ?
C28 C29 1.391(3) . ?
C29 C30 1.386(3) . ?
C29 Cl3 1.743(3) . ?
C30 C31 1.373(4) . ?
C30 H30 0.9300 . ?
C31 C32 1.378(4) . ?
C31 H31 0.9300 . ?
C32 C33 1.378(3) . ?
C32 Cl4 1.729(3) . ?
C33 H33 0.9300 . ?
