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#$Date: 2015-08-05 22:56:51 +0300 (Wed, 05 Aug 2015) $
#$Revision: 152906 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/05/1520559.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_1520559
loop_
_publ_author_name
'Laird, Rebecca C.'
'Sinnwell, Michael A.'
'Nguyen, Nam P.'
'Swenson, Dale C.'
'Mariappan, S. V. Santhana'
'MacGillivray, Leonard R.'
_publ_section_title
;
 Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via
 Coordination-Driven Self-Assembly.
;
_journal_issue                   13
_journal_name_full               'Organic letters'
_journal_page_first              3233
_journal_page_last               3235
_journal_paper_doi               10.1021/acs.orglett.5b00527
_journal_volume                  17
_journal_year                    2015
_chemical_formula_sum            'C50 H36 Ag2 F6 N4 O6 S2'
_chemical_formula_weight         1182.69
_chemical_name_common            'Ag triflate DEPN'
_chemical_name_systematic
;
 Silver trifluoromethanesulfonate 1,8-bis[(E)-2-(4-pyridyl)ethenyl] naphthalene
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                109.671(5)
_cell_angle_beta                 96.586(5)
_cell_angle_gamma                97.962(5)
_cell_formula_units_Z            1
_cell_length_a                   10.4495(10)
_cell_length_b                   11.0503(11)
_cell_length_c                   11.0576(11)
_cell_measurement_reflns_used    3831
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.35
_cell_measurement_theta_min      1.00
_cell_volume                     1172.8(2)
_computing_cell_refinement       'HKL Scalepack (Otwinwski & Minor, 1997)'
_computing_data_collection       'CCD phi and omega scans'
_computing_data_reduction
'HKL Denzo, Scalepack (Otwinwski & Minor, 1997)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.959
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Nonius Kappa CCD'
_diffrn_measurement_method       'CCD phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0164
_diffrn_reflns_av_unetI/netI     0.0289
_diffrn_reflns_laue_measured_fraction_full 0.959
_diffrn_reflns_laue_measured_fraction_max 0.987
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            15549
_diffrn_reflns_point_group_measured_fraction_full 0.959
_diffrn_reflns_point_group_measured_fraction_max 0.987
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         24.996
_diffrn_reflns_theta_min         2.990
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    1.003
_exptl_absorpt_correction_T_max  0.9978
_exptl_absorpt_correction_T_min  0.9653
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'HKL Scalepack (Otwinwski & Minor, 1997)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.675
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             592
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.085
_exptl_crystal_size_min          0.070
_refine_diff_density_max         0.415
_refine_diff_density_min         -0.418
_refine_diff_density_rms         0.052
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.129
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     332
_refine_ls_number_reflns         4073
_refine_ls_number_restraints     48
_refine_ls_restrained_S_all      1.374
_refine_ls_R_factor_all          0.0432
_refine_ls_R_factor_gt           0.0323
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0355P)²+0.4884P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0762
_refine_ls_wR_factor_ref         0.0822
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3410
_reflns_number_total             4073
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ol5b00527_si_002.cif
_cod_data_source_block           mcg13112
_cod_depositor_comments
'Adding full bibliography for 1520555--1520560.cif.'
_cod_database_code               1520559
_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   0.906
_shelx_estimated_absorpt_t_max   0.906
_shelxl_version_number           2013-4
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 0.63001(2) 0.62366(2) 0.59172(2) 0.06153(12) Uani 1 1 d . . . . .
N1 N 0.7657(2) 0.5648(2) 0.4605(2) 0.0512(6) Uani 1 1 d . . . . .
N2 N 0.5191(2) 0.7205(3) 0.7348(2) 0.0507(6) Uani 1 1 d . . . . .
C15 C 0.8073(3) 0.4511(3) 0.4375(3) 0.0530(7) Uani 1 1 d . . . . .
H15 H 0.7790 0.3981 0.4827 0.064 Uiso 1 1 calc R U . . .
C14 C 0.8894(3) 0.4092(3) 0.3505(3) 0.0537(7) Uani 1 1 d . . . . .
H14 H 0.9142 0.3286 0.3370 0.064 Uiso 1 1 calc R U . . .
C10 C 1.0424(3) 0.1561(3) -0.0956(3) 0.0483(7) Uani 1 1 d . . . . .
C11 C 1.0298(3) 0.3226(3) 0.1233(3) 0.0506(11) Uani 0.946(10) 1 d D . P A 1
H11 H 0.9956 0.2617 0.1579 0.061 Uiso 0.946(10) 1 calc R U P A 1
C12 C 1.0147(3) 0.4455(3) 0.1791(3) 0.0534(11) Uani 0.946(10) 1 d D . P A 1
H12 H 1.0561 0.5089 0.1513 0.064 Uiso 0.946(10) 1 calc R U P A 1
C11' C 1.021(11) 0.371(11) 0.082(9) 0.15(6) Uiso 0.054(10) 1 d D . P A 2
H11' H 0.9622 0.4005 0.0341 0.183 Uiso 0.054(10) 1 calc R U P A 2
C12' C 1.031(11) 0.418(14) 0.212(10) 0.153 Uiso 0.054(10) 1 d D U P A 2
H12' H 1.1033 0.4061 0.2606 0.183 Uiso 0.054(10) 1 calc R U P A 2
C17 C 0.8958(3) 0.6055(3) 0.3098(3) 0.0567(8) Uani 1 1 d . . . . .
H17 H 0.9264 0.6626 0.2695 0.068 Uiso 1 1 calc R U . . .
C9 C 1.0966(3) 0.2756(3) 0.0106(3) 0.0535(7) Uani 1 1 d D . . . .
C6 C 1.2451(3) 0.1815(4) -0.1839(3) 0.0636(9) Uani 1 1 d . . . . .
H6 H 1.2958 0.1495 -0.2471 0.076 Uiso 1 1 calc R U . . .
C13 C 0.9361(3) 0.4863(3) 0.2823(3) 0.0475(7) Uani 1 1 d D . . . .
C4 C 1.0753(4) -0.0152(4) -0.2915(3) 0.0696(10) Uani 1 1 d . . . . .
H4 H 1.1269 -0.0470 -0.3539 0.084 Uiso 1 1 calc R U . . .
C5 C 1.1217(3) 0.1076(3) -0.1913(3) 0.0543(8) Uani 1 1 d . . . . .
C19 C 0.4723(3) 0.6708(3) 0.8188(3) 0.0546(8) Uani 1 1 d . . . . .
H19 H 0.4918 0.5913 0.8190 0.066 Uiso 1 1 calc R U . . .
C16 C 0.8111(3) 0.6401(3) 0.3960(3) 0.0570(8) Uani 1 1 d . . . . .
H16 H 0.7839 0.7196 0.4104 0.068 Uiso 1 1 calc R U . . .
C20 C 0.3960(3) 0.7325(3) 0.9054(3) 0.0578(8) Uani 1 1 d . . . . .
H20 H 0.3666 0.6950 0.9633 0.069 Uiso 1 1 calc R U . . .
C1 C 0.9131(3) 0.0830(3) -0.1118(3) 0.0531(7) Uani 1 1 d D . . . .
C21 C 0.3629(3) 0.8510(3) 0.9065(3) 0.0527(8) Uani 1 1 d . . . . .
C22 C 0.4159(3) 0.9027(3) 0.8217(3) 0.0589(8) Uani 1 1 d . . . . .
H22 H 0.4007 0.9835 0.8212 0.071 Uiso 1 1 calc R U . . .
C23 C 0.4901(3) 0.8362(3) 0.7387(3) 0.0588(8) Uani 1 1 d . . . . .
H23 H 0.5227 0.8730 0.6815 0.071 Uiso 1 1 calc R U . . .
C7 C 1.2917(3) 0.2983(4) -0.0864(4) 0.0693(10) Uani 1 1 d . . . . .
H7 H 1.3720 0.3475 -0.0850 0.083 Uiso 1 1 calc R U . . .
C8 C 1.2186(3) 0.3447(4) 0.0122(3) 0.0667(9) Uani 1 1 d . . . . .
H8 H 1.2526 0.4237 0.0803 0.080 Uiso 1 1 calc R U . . .
C2 C 0.8753(3) -0.0378(4) -0.2097(3) 0.0674(9) Uani 1 1 d . . . . .
H2 H 0.7935 -0.0876 -0.2171 0.081 Uiso 1 1 calc R U . . .
C3 C 0.9576(4) -0.0874(4) -0.2987(4) 0.0757(11) Uani 1 1 d . . . . .
H3 H 0.9310 -0.1703 -0.3627 0.091 Uiso 1 1 calc R U . . .
C18 C 0.8142(3) 0.1409(4) -0.0374(3) 0.0506(10) Uani 0.914(8) 1 d D . P B 1
H18 H 0.8119 0.2280 -0.0254 0.061 Uiso 0.914(8) 1 calc R U P B 1
C24 C 0.7281(3) 0.0820(4) 0.0143(3) 0.0516(10) Uani 0.914(8) 1 d D . P B 1
H24 H 0.7251 -0.0063 -0.0004 0.062 Uiso 0.914(8) 1 calc R U P B 1
C24' C 0.746(5) 0.158(5) -0.025(5) 0.080(17) Uiso 0.086(8) 1 d D . P B 2
H24' H 0.7407 0.2019 -0.0830 0.096 Uiso 0.086(8) 1 calc R U P B 2
C18' C 0.834(4) 0.086(5) -0.008(3) 0.080 Uiso 0.086(8) 1 d D U P B 2
H18' H 0.8444 0.0474 0.0540 0.096 Uiso 0.086(8) 1 calc R U P B 2
S1 S 0.56499(9) 0.29722(9) 0.66609(9) 0.0643(2) Uani 1 1 d . U . . .
O1 O 0.6180(3) 0.3991(3) 0.6261(3) 0.1089(9) Uani 1 1 d . U . . .
O2 O 0.4435(3) 0.2181(3) 0.5858(3) 0.0965(8) Uani 1 1 d . U . . .
O3 O 0.5689(3) 0.3344(3) 0.8022(3) 0.0989(9) Uani 1 1 d . U . . .
C25 C 0.6792(4) 0.1851(4) 0.6299(5) 0.0802(8) Uani 1 1 d . U . . .
F1 F 0.6906(3) 0.1461(3) 0.5065(3) 0.1198(9) Uani 1 1 d . U . . .
F2 F 0.7976(2) 0.2421(3) 0.6998(3) 0.1188(9) Uani 1 1 d . U . . .
F3 F 0.6432(3) 0.0835(2) 0.6607(3) 0.1214(9) Uani 1 1 d . U . . .
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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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
N2 Ag1 N1 168.51(9) . .
C16 N1 C15 116.7(2) . .
C16 N1 Ag1 121.19(19) . .
C15 N1 Ag1 122.1(2) . .
C19 N2 C23 116.8(3) . .
C19 N2 Ag1 124.1(2) . .
C23 N2 Ag1 119.1(2) . .
N1 C15 C14 123.2(3) . .
N1 C15 H15 118.4 . .
C14 C15 H15 118.4 . .
C15 C14 C13 120.4(3) . .
C15 C14 H14 119.8 . .
C13 C14 H14 119.8 . .
C5 C10 C9 117.8(3) . .
C5 C10 C1 118.4(3) . .
C9 C10 C1 123.8(3) . .
C12 C11 C9 124.9(3) . .
C12 C11 H11 117.6 . .
C9 C11 H11 117.6 . .
C11 C12 C13 123.4(3) . .
C11 C12 H12 118.3 . .
C13 C12 H12 118.3 . .
C12' C11' C9 124(5) . .
C12' C11' H11' 117.8 . .
C9 C11' H11' 117.7 . .
C11' C12' C13 125(5) . .
C11' C12' H12' 117.5 . .
C13 C12' H12' 117.5 . .
C16 C17 C13 120.5(3) . .
C16 C17 H17 119.8 . .
C13 C17 H17 119.8 . .
C8 C9 C10 119.5(3) . .
C8 C9 C11 119.0(3) . .
C10 C9 C11 121.3(3) . .
C8 C9 C11' 108(6) . .
C10 C9 C11' 125(5) . .
C7 C6 C5 121.3(3) . .
C7 C6 H6 119.3 . .
C5 C6 H6 119.3 . .
C17 C13 C14 115.9(3) . .
C17 C13 C12 119.3(3) . .
C14 C13 C12 124.6(3) . .
C17 C13 C12' 139(6) . .
C14 C13 C12' 105(6) . .
C3 C4 C5 121.3(3) . .
C3 C4 H4 119.4 . .
C5 C4 H4 119.4 . .
C6 C5 C4 120.9(3) . .
C6 C5 C10 119.9(3) . .
C4 C5 C10 119.2(3) . .
N2 C19 C20 122.7(3) . .
N2 C19 H19 118.6 . .
C20 C19 H19 118.6 . .
N1 C16 C17 123.2(3) . .
N1 C16 H16 118.4 . .
C17 C16 H16 118.4 . .
C19 C20 C21 120.3(3) . .
C19 C20 H20 119.9 . .
C21 C20 H20 119.9 . .
C2 C1 C10 119.1(3) . .
C2 C1 C18 118.9(3) . .
C10 C1 C18 121.5(3) . .
C2 C1 C18' 108(2) . .
C10 C1 C18' 127(2) . .
C22 C21 C20 116.0(3) . .
C22 C21 C24 119.5(3) . 2_666
C20 C21 C24 124.5(3) . 2_666
C22 C21 C24' 154.5(15) . 2_666
C20 C21 C24' 89.2(15) . 2_666
C23 C22 C21 120.5(3) . .
C23 C22 H22 119.8 . .
C21 C22 H22 119.8 . .
N2 C23 C22 123.7(3) . .
N2 C23 H23 118.2 . .
C22 C23 H23 118.2 . .
C6 C7 C8 119.8(3) . .
C6 C7 H7 120.1 . .
C8 C7 H7 120.1 . .
C9 C8 C7 121.5(3) . .
C9 C8 H8 119.3 . .
C7 C8 H8 119.3 . .
C1 C2 C3 121.5(3) . .
C1 C2 H2 119.3 . .
C3 C2 H2 119.3 . .
C4 C3 C2 120.1(3) . .
C4 C3 H3 119.9 . .
C2 C3 H3 119.9 . .
C24 C18 C1 127.0(4) . .
C24 C18 H18 116.5 . .
C1 C18 H18 116.5 . .
C18 C24 C21 123.6(3) . 2_666
C18 C24 H24 118.2 . .
C21 C24 H24 118.2 2_666 .
C18' C24' C21 104(3) . 2_666
C18' C24' H24' 127.8 . .
C21 C24' H24' 127.8 2_666 .
C24' C18' C1 104(4) . .
C24' C18' H18' 128.1 . .
C1 C18' H18' 128.1 . .
O1 S1 O3 114.3(2) . .
O1 S1 O2 114.1(2) . .
O3 S1 O2 115.65(18) . .
O1 S1 C25 103.42(18) . .
O3 S1 C25 104.5(2) . .
O2 S1 C25 102.7(2) . .
F3 C25 F1 109.2(4) . .
F3 C25 F2 106.2(3) . .
F1 C25 F2 107.8(3) . .
F3 C25 S1 111.2(3) . .
F1 C25 S1 111.6(3) . .
F2 C25 S1 110.7(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N2 2.148(2) .
Ag1 N1 2.152(2) .
N1 C16 1.339(4) .
N1 C15 1.340(4) .
N2 C19 1.333(4) .
N2 C23 1.342(4) .
C15 C14 1.370(4) .
C15 H15 0.9300 .
C14 C13 1.391(4) .
C14 H14 0.9300 .
C10 C5 1.427(4) .
C10 C9 1.428(4) .
C10 C1 1.434(4) .
C11 C12 1.330(5) .
C11 C9 1.474(4) .
C11 H11 0.9300 .
C12 C13 1.466(4) .
C12 H12 0.9300 .
C11' C12' 1.330(11) .
C11' C9 1.477(11) .
C11' H11' 0.9300 .
C12' C13 1.467(11) .
C12' H12' 0.9300 .
C17 C16 1.371(4) .
C17 C13 1.386(4) .
C17 H17 0.9300 .
C9 C8 1.388(5) .
C6 C7 1.355(5) .
C6 C5 1.406(5) .
C6 H6 0.9300 .
C4 C3 1.349(5) .
C4 C5 1.409(5) .
C4 H4 0.9300 .
C19 C20 1.379(4) .
C19 H19 0.9300 .
C16 H16 0.9300 .
C20 C21 1.397(4) .
C20 H20 0.9300 .
C1 C2 1.376(5) .
C1 C18 1.475(4) .
C1 C18' 1.477(11) .
C21 C22 1.380(4) .
C21 C24 1.473(4) 2_666
C21 C24' 1.85(6) 2_666
C22 C23 1.360(5) .
C22 H22 0.9300 .
C23 H23 0.9300 .
C7 C8 1.400(5) .
C7 H7 0.9300 .
C8 H8 0.9300 .
C2 C3 1.404(5) .
C2 H2 0.9300 .
C3 H3 0.9300 .
C18 C24 1.328(5) .
C18 H18 0.9300 .
C24 C21 1.472(4) 2_666
C24 H24 0.9300 .
C24' C18' 1.328(11) .
C24' C21 1.85(6) 2_666
C24' H24' 0.9300 .
C18' H18' 0.9300 .
S1 O1 1.410(3) .
S1 O3 1.415(3) .
S1 O2 1.441(3) .
S1 C25 1.818(4) .
C25 F3 1.299(4) .
C25 F1 1.310(5) .
C25 F2 1.327(5) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
C16 N1 C15 C14 -1.7(5) . .
Ag1 N1 C15 C14 177.3(2) . .
N1 C15 C14 C13 1.2(5) . .
C9 C11 C12 C13 173.5(3) . .
C9 C11' C12' C13 -164(10) . .
C5 C10 C9 C8 4.8(4) . .
C1 C10 C9 C8 -174.8(3) . .
C5 C10 C9 C11 -171.0(3) . .
C1 C10 C9 C11 9.5(5) . .
C5 C10 C9 C11' 151(6) . .
C1 C10 C9 C11' -29(6) . .
C12 C11 C9 C8 48.3(5) . .
C12 C11 C9 C10 -136.0(4) . .
C12 C11 C9 C11' -28(10) . .
C12' C11' C9 C8 -83(16) . .
C12' C11' C9 C10 128(13) . .
C12' C11' C9 C11 34(12) . .
C16 C17 C13 C14 -2.3(5) . .
C16 C17 C13 C12 173.2(3) . .
C16 C17 C13 C12' -172(8) . .
C15 C14 C13 C17 0.9(4) . .
C15 C14 C13 C12 -174.3(3) . .
C15 C14 C13 C12' 174(6) . .
C11 C12 C13 C17 -162.4(4) . .
C11 C12 C13 C14 12.7(5) . .
C11 C12 C13 C12' 44(16) . .
C11' C12' C13 C17 -71(20) . .
C11' C12' C13 C14 119(15) . .
C11' C12' C13 C12 -35(9) . .
C7 C6 C5 C4 -178.6(3) . .
C7 C6 C5 C10 0.6(5) . .
C3 C4 C5 C6 179.3(3) . .
C3 C4 C5 C10 0.1(5) . .
C9 C10 C5 C6 -4.3(4) . .
C1 C10 C5 C6 175.3(3) . .
C9 C10 C5 C4 174.9(3) . .
C1 C10 C5 C4 -5.5(4) . .
C23 N2 C19 C20 0.8(5) . .
Ag1 N2 C19 C20 -176.8(2) . .
C15 N1 C16 C17 0.1(5) . .
Ag1 N1 C16 C17 -178.8(3) . .
C13 C17 C16 N1 1.9(5) . .
N2 C19 C20 C21 1.0(5) . .
C5 C10 C1 C2 7.3(4) . .
C9 C10 C1 C2 -173.1(3) . .
C5 C10 C1 C18 -164.8(3) . .
C9 C10 C1 C18 14.8(5) . .
C5 C10 C1 C18' 157(2) . .
C9 C10 C1 C18' -24(2) . .
C19 C20 C21 C22 -3.0(4) . .
C19 C20 C21 C24 173.7(3) . 2_666
C19 C20 C21 C24' 173.2(16) . 2_666
C20 C21 C22 C23 3.1(5) . .
C24 C21 C22 C23 -173.7(3) 2_666 .
C24' C21 C22 C23 -168(4) 2_666 .
C19 N2 C23 C22 -0.7(5) . .
Ag1 N2 C23 C22 177.1(3) . .
C21 C22 C23 N2 -1.4(5) . .
C5 C6 C7 C8 2.6(5) . .
C10 C9 C8 C7 -1.7(5) . .
C11 C9 C8 C7 174.1(3) . .
C11' C9 C8 C7 -153(5) . .
C6 C7 C8 C9 -2.1(5) . .
C10 C1 C2 C3 -3.8(5) . .
C18 C1 C2 C3 168.4(3) . .
C18' C1 C2 C3 -158.5(19) . .
C5 C4 C3 C2 3.6(6) . .
C1 C2 C3 C4 -1.7(6) . .
C2 C1 C18 C24 47.2(5) . .
C10 C1 C18 C24 -140.7(4) . .
C18' C1 C18 C24 -31(4) . .
C1 C18 C24 C21 176.6(3) . 2_666
C21 C24' C18' C1 175(3) 2_666 .
C2 C1 C18' C24' -104(4) . .
C10 C1 C18' C24' 104(4) . .
C18 C1 C18' C24' 12(2) . .
O1 S1 C25 F3 -179.5(3) . .
O3 S1 C25 F3 60.6(4) . .
O2 S1 C25 F3 -60.5(4) . .
O1 S1 C25 F1 -57.3(4) . .
O3 S1 C25 F1 -177.2(3) . .
O2 S1 C25 F1 61.7(4) . .
O1 S1 C25 F2 62.7(3) . .
O3 S1 C25 F2 -57.2(3) . .
O2 S1 C25 F2 -178.3(3) . .
