#------------------------------------------------------------------------------
#$Date: 2016-03-23 03:28:27 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179247 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/67/4316748.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_4316748
loop_
_publ_author_name
'Svetlana V. Eliseeva'
'Dmitry N. Pleshkov'
'Konstantin A. Lyssenko'
'Leonid S. Lepnev'
'Jean-Claude G. Bünzli'
'Natalia P. Kuzmina'
_publ_section_title
;
 Highly Luminescent and Triboluminescent Coordination Polymers Assembled
 from Lanthanide β-Diketonates and Aromatic Bidentate O-Donor Ligands
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              9300
_journal_page_last               9311
_journal_paper_doi               10.1021/ic100974e
_journal_volume                  49
_journal_year                    2010
_chemical_formula_moiety         'C25 H13 F18 O8 Tb'
_chemical_formula_sum            'C25 H13 F18 O8 Tb'
_chemical_formula_weight         942.27
_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                92.6746(8)
_cell_angle_beta                 103.2727(7)
_cell_angle_gamma                103.7836(8)
_cell_formula_units_Z            2
_cell_length_a                   8.7036(3)
_cell_length_b                   11.9310(5)
_cell_length_c                   16.0130(6)
_cell_measurement_reflns_used    769
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      29
_cell_measurement_theta_min      3
_cell_volume                     1562.75(10)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX II'
_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, 1997)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX II CCD area detector''
_diffrn_measurement_method       '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  0.0399
_diffrn_reflns_av_sigmaI/netI    0.0549
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            19245
_diffrn_reflns_theta_full        29.00
_diffrn_reflns_theta_max         29.00
_diffrn_reflns_theta_min         1.31
_exptl_absorpt_coefficient_mu    2.417
_exptl_absorpt_correction_T_max  0.644
_exptl_absorpt_correction_T_min  0.445
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorles
_exptl_crystal_density_diffrn    2.002
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             908
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.282
_refine_diff_density_min         -1.472
_refine_diff_density_rms         0.128
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.028
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     470
_refine_ls_number_reflns         8306
_refine_ls_number_restraints     9
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0411
_refine_ls_R_factor_gt           0.0327
_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)+(0.0197P)²+1.2535P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0626
_refine_ls_wR_factor_ref         0.0664
_reflns_number_gt                7257
_reflns_number_total             8306
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            ic100974e_si_003_3.cif
_cod_data_source_block           tbhfa3_acbz
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to the built-in table from CIF Core dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_database_code               4316748
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
TB1 Tb 0.715623(18) 0.738729(13) 0.726906(9) 0.01219(4) Uani 1 1 d . . .
O1 O 0.9831(3) 0.79178(19) 0.82284(14) 0.0176(5) Uani 1 1 d . . .
C1 C 1.0240(4) 0.9070(3) 0.95368(19) 0.0159(6) Uani 1 1 d . . .
C2 C 1.0452(4) 0.9097(3) 1.0428(2) 0.0176(6) Uani 1 1 d . . .
H2A H 1.0762 0.8478 1.0718 0.021 Uiso 1 1 calc R . .
C3 C 1.0212(4) 1.0020(3) 1.0891(2) 0.0176(6) Uani 1 1 d . . .
H3A H 1.0354 1.0035 1.1498 0.021 Uiso 1 1 calc R . .
C4 C 1.0431(4) 0.8066(3) 0.9013(2) 0.0169(6) Uani 1 1 d . . .
C5 C 1.1291(4) 0.7215(3) 0.9433(2) 0.0251(7) Uani 1 1 d . . .
H5A H 1.1542 0.6740 0.8992 0.038 Uiso 1 1 calc R . .
H5B H 1.0587 0.6712 0.9737 0.038 Uiso 1 1 calc R . .
H5C H 1.2308 0.7635 0.9846 0.038 Uiso 1 1 calc R . .
O1A O 0.8771(3) 0.69805(19) 0.63387(14) 0.0182(5) Uani 1 1 d . . .
C1A C 1.0037(4) 0.5944(3) 0.55500(18) 0.0134(6) Uani 1 1 d . . .
C2A C 0.8596(4) 0.5077(3) 0.52502(19) 0.0166(6) Uani 1 1 d . . .
H2AA H 0.7641 0.5135 0.5423 0.020 Uiso 1 1 calc R . .
C3A C 0.8547(4) 0.4129(3) 0.46997(19) 0.0163(6) Uani 1 1 d . . .
H3AA H 0.7564 0.3536 0.4495 0.020 Uiso 1 1 calc R . .
C4A C 1.0039(4) 0.6938(3) 0.61515(18) 0.0134(6) Uani 1 1 d . . .
C5A C 1.1587(4) 0.7850(3) 0.6526(2) 0.0209(7) Uani 1 1 d . . .
H5AA H 1.1398 0.8398 0.6943 0.031 Uiso 1 1 calc R . .
H5AB H 1.1948 0.8265 0.6063 0.031 Uiso 1 1 calc R . .
H5AC H 1.2430 0.7485 0.6817 0.031 Uiso 1 1 calc R . .
O2 O 0.6948(3) 0.70960(18) 0.87054(13) 0.0160(4) Uani 1 1 d . . .
O3 O 0.5818(3) 0.87162(18) 0.77156(13) 0.0164(4) Uani 1 1 d . . .
O4 O 0.5719(3) 0.75878(19) 0.58942(13) 0.0176(5) Uani 1 1 d . . .
O5 O 0.8451(3) 0.92269(18) 0.69202(14) 0.0176(5) Uani 1 1 d . . .
O6 O 0.4617(3) 0.60548(19) 0.71327(14) 0.0181(5) Uani 1 1 d . . .
O7 O 0.7677(3) 0.55858(18) 0.75039(14) 0.0187(5) Uani 1 1 d . . .
F1 F 0.4988(3) 0.6224(2) 1.00490(16) 0.0490(7) Uani 1 1 d . . .
F2 F 0.6753(3) 0.7718(2) 1.07667(13) 0.0427(6) Uani 1 1 d . . .
F3 F 0.7524(3) 0.6349(2) 1.02108(14) 0.0441(6) Uani 1 1 d . . .
F4 F 0.4370(3) 1.0394(2) 0.76198(13) 0.0380(6) Uani 1 1 d . . .
F5 F 0.5607(2) 1.08724(16) 0.89531(14) 0.0298(5) Uani 1 1 d . . .
F6 F 0.3217(2) 0.97193(18) 0.85963(16) 0.0359(5) Uani 1 1 d . . .
F7 F 0.3491(5) 0.8078(7) 0.4537(4) 0.0412(7) Uani 0.470(5) 1 d PD A 1
F8 F 0.4458(7) 0.6693(4) 0.4197(5) 0.0412(7) Uani 0.470(5) 1 d PD A 1
F9 F 0.5549(7) 0.8215(5) 0.3779(3) 0.0412(7) Uani 0.470(5) 1 d PD A 1
F10 F 0.9630(3) 1.15649(18) 0.69066(16) 0.0440(6) Uani 1 1 d . . .
F11 F 0.9585(3) 1.1314(2) 0.55679(15) 0.0412(6) Uani 1 1 d . . .
F12 F 1.1180(2) 1.06187(19) 0.64991(16) 0.0385(6) Uani 1 1 d . . .
F13 F 0.2187(2) 0.3952(2) 0.80172(14) 0.0350(5) Uani 1 1 d . . .
F14 F 0.1616(2) 0.40288(18) 0.66482(14) 0.0320(5) Uani 1 1 d . . .
F15 F 0.1733(2) 0.55106(19) 0.75046(14) 0.0320(5) Uani 1 1 d . . .
F16 F 0.7104(3) 0.2888(2) 0.83020(19) 0.0487(7) Uani 1 1 d . . .
F17 F 0.9192(3) 0.4343(2) 0.86988(15) 0.0383(5) Uani 1 1 d . . .
F18 F 0.8535(3) 0.35112(19) 0.74071(15) 0.0384(6) Uani 1 1 d . . .
C6 C 0.6341(4) 0.7524(3) 0.92359(19) 0.0164(6) Uani 1 1 d . . .
C7 C 0.5593(4) 0.8433(3) 0.9145(2) 0.0204(7) Uani 1 1 d . . .
H7A H 0.5200 0.8696 0.9605 0.025 Uiso 1 1 calc R . .
C8 C 0.5416(4) 0.8961(3) 0.8388(2) 0.0154(6) Uani 1 1 d . . .
C9 C 0.6412(4) 0.6945(3) 1.0081(2) 0.0229(7) Uani 1 1 d . . .
C10 C 0.4635(4) 0.9998(3) 0.8372(2) 0.0178(6) Uani 1 1 d . . .
C11 C 0.6061(4) 0.8230(3) 0.5329(2) 0.0201(7) Uani 1 1 d . A .
C12 C 0.7314(4) 0.9231(3) 0.5426(2) 0.0238(7) Uani 1 1 d . . .
H12A H 0.7444 0.9629 0.4936 0.029 Uiso 1 1 calc R . .
C13 C 0.8383(4) 0.9663(3) 0.6225(2) 0.0174(6) Uani 1 1 d . . .
C14 C 0.4889(4) 0.7843(3) 0.4431(2) 0.0363(10) Uani 1 1 d D . .
C15 C 0.9704(4) 1.0810(3) 0.6296(2) 0.0241(7) Uani 1 1 d . . .
C16 C 0.4247(4) 0.5102(3) 0.74346(19) 0.0171(6) Uani 1 1 d . . .
C17 C 0.5261(4) 0.4400(3) 0.7763(2) 0.0203(7) Uani 1 1 d . . .
H17A H 0.4833 0.3718 0.8004 0.024 Uiso 1 1 calc R . .
C18 C 0.6891(4) 0.4688(3) 0.7742(2) 0.0181(6) Uani 1 1 d . . .
C19 C 0.2423(4) 0.4643(3) 0.7404(2) 0.0222(7) Uani 1 1 d . . .
C20 C 0.7929(4) 0.3841(3) 0.8038(2) 0.0247(7) Uani 1 1 d . . .
F7' F 0.3359(5) 0.7922(7) 0.4361(3) 0.0412(7) Uani 0.53 1 d PD A 2
F8' F 0.4846(6) 0.6724(3) 0.4242(5) 0.0412(7) Uani 0.53 1 d PD A 2
F9' F 0.5232(6) 0.8561(4) 0.3840(3) 0.0412(7) Uani 0.53 1 d PD A 2
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'
F F 0.0171 0.0103 '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'
Tb Tb -0.1723 4.1537 '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
O4 TB1 O7 117.08(8) . . ?
O4 TB1 O6 77.56(7) . . ?
O7 TB1 O6 73.10(8) . . ?
O4 TB1 O3 83.98(7) . . ?
O7 TB1 O3 142.75(7) . . ?
O6 TB1 O3 83.10(7) . . ?
O4 TB1 O5 73.38(7) . . ?
O7 TB1 O5 139.64(7) . . ?
O6 TB1 O5 144.16(7) . . ?
O3 TB1 O5 73.51(7) . . ?
O4 TB1 O1A 74.99(7) . . ?
O7 TB1 O1A 71.20(7) . . ?
O6 TB1 O1A 116.94(8) . . ?
O3 TB1 O1A 146.05(7) . . ?
O5 TB1 O1A 75.07(7) . . ?
O4 TB1 O2 144.47(7) . . ?
O7 TB1 O2 74.46(7) . . ?
O6 TB1 O2 74.22(7) . . ?
O3 TB1 O2 71.68(7) . . ?
O5 TB1 O2 121.19(7) . . ?
O1A TB1 O2 137.76(7) . . ?
O4 TB1 O1 142.57(7) . . ?
O7 TB1 O1 77.82(8) . . ?
O6 TB1 O1 139.01(7) . . ?
O3 TB1 O1 104.58(7) . . ?
O5 TB1 O1 74.41(7) . . ?
O1A TB1 O1 78.74(7) . . ?
O2 TB1 O1 70.54(7) . . ?
C4 O1 TB1 137.5(2) . . ?
C2 C1 C3 120.0(3) . 2_777 ?
C2 C1 C4 121.6(3) . . ?
C3 C1 C4 118.4(3) 2_777 . ?
C3 C2 C1 120.3(3) . . ?
C3 C2 H2A 119.9 . . ?
C1 C2 H2A 119.9 . . ?
C2 C3 C1 119.8(3) . 2_777 ?
C2 C3 H3A 120.1 . . ?
C1 C3 H3A 120.1 2_777 . ?
O1 C4 C1 119.6(3) . . ?
O1 C4 C5 119.6(3) . . ?
C1 C4 C5 120.8(3) . . ?
C4 C5 H5A 109.5 . . ?
C4 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
C4 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
C4A O1A TB1 155.2(2) . . ?
C2A C1A C3A 120.4(3) . 2_766 ?
C2A C1A C4A 118.4(3) . . ?
C3A C1A C4A 121.2(3) 2_766 . ?
C3A C2A C1A 120.2(3) . . ?
C3A C2A H2AA 119.9 . . ?
C1A C2A H2AA 119.9 . . ?
C2A C3A C1A 119.3(3) . 2_766 ?
C2A C3A H3AA 120.3 . . ?
C1A C3A H3AA 120.3 2_766 . ?
O1A C4A C1A 119.1(3) . . ?
O1A C4A C5A 121.0(3) . . ?
C1A C4A C5A 119.9(3) . . ?
C4A C5A H5AA 109.5 . . ?
C4A C5A H5AB 109.5 . . ?
H5AA C5A H5AB 109.5 . . ?
C4A C5A H5AC 109.5 . . ?
H5AA C5A H5AC 109.5 . . ?
H5AB C5A H5AC 109.5 . . ?
C6 O2 TB1 135.6(2) . . ?
C8 O3 TB1 135.9(2) . . ?
C11 O4 TB1 133.2(2) . . ?
C13 O5 TB1 132.5(2) . . ?
C16 O6 TB1 131.2(2) . . ?
C18 O7 TB1 132.6(2) . . ?
O2 C6 C7 127.7(3) . . ?
O2 C6 C9 115.1(3) . . ?
C7 C6 C9 117.2(3) . . ?
C8 C7 C6 120.5(3) . . ?
C8 C7 H7A 119.8 . . ?
C6 C7 H7A 119.8 . . ?
O3 C8 C7 128.6(3) . . ?
O3 C8 C10 115.4(3) . . ?
C7 C8 C10 116.1(3) . . ?
F3 C9 F1 107.9(3) . . ?
F3 C9 F2 107.7(3) . . ?
F1 C9 F2 107.3(3) . . ?
F3 C9 C6 111.7(3) . . ?
F1 C9 C6 110.0(3) . . ?
F2 C9 C6 112.1(3) . . ?
F4 C10 F6 107.8(3) . . ?
F4 C10 F5 108.0(3) . . ?
F6 C10 F5 106.0(3) . . ?
F4 C10 C8 113.2(3) . . ?
F6 C10 C8 111.5(3) . . ?
F5 C10 C8 110.0(3) . . ?
O4 C11 C12 128.2(3) . . ?
O4 C11 C14 113.9(3) . . ?
C12 C11 C14 117.9(3) . . ?
C11 C12 C13 121.3(3) . . ?
C11 C12 H12A 119.4 . . ?
C13 C12 H12A 119.4 . . ?
O5 C13 C12 128.1(3) . . ?
O5 C13 C15 113.2(3) . . ?
C12 C13 C15 118.7(3) . . ?
F7' C14 F8' 108.2(4) . . ?
F7' C14 F9' 97.0(5) . . ?
F8' C14 F9' 116.3(5) . . ?
F7' C14 F8 94.6(5) . . ?
F9' C14 F8 118.4(5) . . ?
F7' C14 F9 115.5(5) . . ?
F8' C14 F9 94.4(5) . . ?
F8 C14 F9 99.7(5) . . ?
F8' C14 F7 117.2(5) . . ?
F9' C14 F7 100.3(5) . . ?
F8 C14 F7 103.9(5) . . ?
F9 C14 F7 121.8(5) . . ?
F7' C14 C11 115.7(3) . . ?
F8' C14 C11 106.4(4) . . ?
F9' C14 C11 113.3(3) . . ?
F8 C14 C11 114.9(4) . . ?
F9 C14 C11 113.8(3) . . ?
F7 C14 C11 102.8(3) . . ?
F10 C15 F12 107.8(3) . . ?
F10 C15 F11 107.6(3) . . ?
F12 C15 F11 106.8(3) . . ?
F10 C15 C13 110.7(3) . . ?
F12 C15 C13 110.1(3) . . ?
F11 C15 C13 113.6(3) . . ?
O6 C16 C17 128.4(3) . . ?
O6 C16 C19 115.1(3) . . ?
C17 C16 C19 116.5(3) . . ?
C18 C17 C16 120.6(3) . . ?
C18 C17 H17A 119.7 . . ?
C16 C17 H17A 119.7 . . ?
O7 C18 C17 128.1(3) . . ?
O7 C18 C20 112.9(3) . . ?
C17 C18 C20 119.0(3) . . ?
F13 C19 F14 107.2(3) . . ?
F13 C19 F15 107.6(3) . . ?
F14 C19 F15 107.7(3) . . ?
F13 C19 C16 112.0(3) . . ?
F14 C19 C16 110.7(3) . . ?
F15 C19 C16 111.4(3) . . ?
F18 C20 F17 107.2(3) . . ?
F18 C20 F16 108.0(3) . . ?
F17 C20 F16 106.6(3) . . ?
F18 C20 C18 110.8(3) . . ?
F17 C20 C18 110.7(3) . . ?
F16 C20 C18 113.3(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
TB1 O4 2.323(2) . ?
TB1 O7 2.330(2) . ?
TB1 O6 2.352(2) . ?
TB1 O3 2.354(2) . ?
TB1 O5 2.372(2) . ?
TB1 O1A 2.377(2) . ?
TB1 O2 2.383(2) . ?
TB1 O1 2.397(2) . ?
O1 C4 1.231(4) . ?
C1 C2 1.394(4) . ?
C1 C3 1.398(4) 2_777 ?
C1 C4 1.493(4) . ?
C2 C3 1.382(4) . ?
C2 H2A 0.9500 . ?
C3 C1 1.398(4) 2_777 ?
C3 H3A 0.9500 . ?
C4 C5 1.497(4) . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 H5C 0.9800 . ?
O1A C4A 1.220(4) . ?
C1A C2A 1.391(4) . ?
C1A C3A 1.400(4) 2_766 ?
C1A C4A 1.491(4) . ?
C2A C3A 1.388(4) . ?
C2A H2AA 0.9500 . ?
C3A C1A 1.400(4) 2_766 ?
C3A H3AA 0.9500 . ?
C4A C5A 1.492(4) . ?
C5A H5AA 0.9800 . ?
C5A H5AB 0.9800 . ?
C5A H5AC 0.9800 . ?
O2 C6 1.247(4) . ?
O3 C8 1.248(4) . ?
O4 C11 1.254(4) . ?
O5 C13 1.247(4) . ?
O6 C16 1.257(4) . ?
O7 C18 1.252(4) . ?
F1 C9 1.318(4) . ?
F2 C9 1.331(4) . ?
F3 C9 1.317(4) . ?
F4 C10 1.306(4) . ?
F5 C10 1.340(4) . ?
F6 C10 1.335(4) . ?
F7 C14 1.357(4) . ?
F8 C14 1.344(4) . ?
F9 C14 1.347(4) . ?
F10 C15 1.321(4) . ?
F11 C15 1.331(4) . ?
F12 C15 1.328(4) . ?
F13 C19 1.332(4) . ?
F14 C19 1.332(4) . ?
F15 C19 1.336(4) . ?
F16 C20 1.336(4) . ?
F17 C20 1.334(4) . ?
F18 C20 1.326(4) . ?
C6 C7 1.390(4) . ?
C6 C9 1.543(4) . ?
C7 C8 1.386(4) . ?
C7 H7A 0.9500 . ?
C8 C10 1.547(4) . ?
C11 C12 1.387(5) . ?
C11 C14 1.537(5) . ?
C12 C13 1.390(5) . ?
C12 H12A 0.9500 . ?
C13 C15 1.544(5) . ?
C14 F7' 1.336(4) . ?
C14 F8' 1.345(4) . ?
C14 F9' 1.344(4) . ?
C16 C17 1.391(4) . ?
C16 C19 1.539(4) . ?
C17 C18 1.386(4) . ?
C17 H17A 0.9500 . ?
C18 C20 1.532(5) . ?
