#------------------------------------------------------------------------------
#$Date: 2019-11-17 14:00:44 +0200 (Sun, 17 Nov 2019) $
#$Revision: 230347 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/05/75/7057575.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_7057575
loop_
_publ_author_name
'Marchetti, Fabio'
'Pettinari, Riccardo'
'Di Nicola, Corrado'
'Pettinari, Claudio'
'Paul, Anup'
'Crispini, Alessandra'
'Giorno, Eugenia'
'Lelj, Francesco'
'Stoia, Sonia'
'Amati, Mario'
_publ_section_title
;
 Effects of methyl groups in a pyrimidine-based flexible ligand on the
 formation of silver(i) coordination networks
;
_journal_issue                   16
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              13998
_journal_paper_doi               10.1039/C8NJ02823K
_journal_volume                  42
_journal_year                    2018
_chemical_formula_moiety         'C29 H30 Ag F3 N6 O2 S3, 0.5(H2 O)'
_chemical_formula_sum            'C29 H31 Ag F3 N6 O2.5 S3'
_chemical_formula_weight         764.65
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2018-07-09 deposited with the CCDC.
2018-07-17 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 100.308(14)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   20.058(4)
_cell_length_b                   11.420(2)
_cell_length_c                   15.067(3)
_cell_measurement_reflns_used    9506
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      22.59
_cell_measurement_theta_min      2.25
_cell_volume                     3395.6(11)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'omega scan'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1010
_diffrn_reflns_av_unetI/netI     0.0562
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            55350
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        24.121
_diffrn_reflns_theta_max         24.121
_diffrn_reflns_theta_min         2.060
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    0.832
_exptl_absorpt_correction_T_max  0.9593
_exptl_absorpt_correction_T_min  0.8560
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Bruker SADABS'
_exptl_crystal_colour            white
_exptl_crystal_density_diffrn    1.496
_exptl_crystal_description       parallelepiped
_exptl_crystal_F_000             1556
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.09
_refine_diff_density_max         0.668
_refine_diff_density_min         -0.565
_refine_diff_density_rms         0.079
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.065
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     469
_refine_ls_number_reflns         5383
_refine_ls_number_restraints     115
_refine_ls_restrained_S_all      1.070
_refine_ls_R_factor_all          0.1108
_refine_ls_R_factor_gt           0.0552
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0156P)²+14.0959P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0993
_refine_ls_wR_factor_ref         0.1221
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3329
_reflns_number_total             5383
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8nj02823k2.cif
_cod_data_source_block           5
_cod_depositor_comments
'Adding full bibliography for 7057574--7057575.cif.'
_cod_original_cell_volume        3395.7(12)
_cod_original_formula_sum        'C29 H31 Ag F3 N6 O2.50 S3'
_cod_database_code               7057575
_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.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_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
Ag Ag 0.16593(3) 1.14171(5) 0.81786(4) 0.0623(2) Uani 1 1 d . . . . .
S1 S 0.23147(10) 0.93248(16) 0.71990(12) 0.0626(5) Uani 1 1 d . . . . .
S2 S 0.24591(10) 0.37467(15) 0.87786(11) 0.0565(5) Uani 1 1 d . . . . .
S3 S 0.49622(9) 0.47277(15) 0.73521(11) 0.0535(5) Uani 1 1 d . . . . .
N1 N 0.1526(3) 1.1110(5) 0.6712(4) 0.0544(15) Uani 1 1 d . . . . .
N2 N 0.1529(3) 0.9633(5) 0.5587(4) 0.0572(15) Uani 1 1 d . . . . .
N4 N 0.2926(3) 0.3182(5) 1.0509(3) 0.0490(14) Uani 1 1 d . . . . .
N3 N 0.2287(3) 0.1759(4) 0.9539(3) 0.0453(13) Uani 1 1 d . . . . .
N5 N 0.4651(3) 0.3470(4) 0.5898(3) 0.0472(13) Uani 1 1 d . . . . .
N6 N 0.4267(3) 0.5459(4) 0.5770(3) 0.0460(13) Uani 1 1 d . . . . .
C1 C 0.1099(4) 1.1781(7) 0.6104(6) 0.067(2) Uani 1 1 d . . . . .
C2 C 0.0876(4) 1.1358(8) 0.5259(5) 0.075(2) Uani 1 1 d . . . . .
H2 H 0.0585 1.1809 0.4845 0.090 Uiso 1 1 calc R U . . .
C3 C 0.1074(4) 1.0275(8) 0.5009(5) 0.065(2) Uani 1 1 d . . . . .
C4 C 0.1718(3) 1.0082(6) 0.6401(4) 0.0485(17) Uani 1 1 d . . . . .
C5 C 0.0894(5) 1.2941(7) 0.6430(6) 0.101(3) Uani 1 1 d . . . . .
H5A H 0.1112 1.3057 0.7044 0.151 Uiso 1 1 calc R U . . .
H5B H 0.1026 1.3553 0.6060 0.151 Uiso 1 1 calc R U . . .
H5C H 0.0411 1.2959 0.6393 0.151 Uiso 1 1 calc R U . . .
C6 C 0.0817(4) 0.9738(9) 0.4107(5) 0.102(3) Uani 1 1 d . . . . .
H6A H 0.0500 1.0261 0.3755 0.152 Uiso 1 1 calc R U . . .
H6B H 0.1190 0.9598 0.3801 0.152 Uiso 1 1 calc R U . . .
H6C H 0.0596 0.9010 0.4187 0.152 Uiso 1 1 calc R U . . .
C7 C 0.2381(4) 0.7955(5) 0.6631(4) 0.0578(19) Uani 1 1 d . . . . .
H7A H 0.1938 0.7594 0.6478 0.069 Uiso 1 1 calc R U . . .
H7B H 0.2552 0.8090 0.6076 0.069 Uiso 1 1 calc R U . . .
C8 C 0.2858(4) 0.7149(5) 0.7241(4) 0.0468(17) Uani 1 1 d . . . . .
C9 C 0.3522(3) 0.7035(5) 0.7136(4) 0.0445(16) Uani 1 1 d . . . . .
H9 H 0.3674 0.7454 0.6683 0.053 Uiso 1 1 calc R U . . .
C10 C 0.3971(3) 0.6305(5) 0.7695(4) 0.0428(15) Uani 1 1 d . . . . .
C11 C 0.3732(4) 0.5703(5) 0.8375(4) 0.0475(17) Uani 1 1 d . . . . .
H11 H 0.4027 0.5217 0.8756 0.057 Uiso 1 1 calc R U . . .
C12 C 0.3064(4) 0.5806(5) 0.8504(4) 0.0449(16) Uani 1 1 d . . . . .
C13 C 0.2631(3) 0.6534(5) 0.7926(4) 0.0481(16) Uani 1 1 d . . . . .
H13 H 0.2182 0.6610 0.7999 0.058 Uiso 1 1 calc R U . . .
C14 C 0.2825(4) 0.5131(5) 0.9244(4) 0.0559(19) Uani 1 1 d . . . . .
H14A H 0.2487 0.5581 0.9483 0.067 Uiso 1 1 calc R U . . .
H14B H 0.3202 0.4981 0.9730 0.067 Uiso 1 1 calc R U . . .
C15 C 0.2572(3) 0.2814(5) 0.9723(4) 0.0447(16) Uani 1 1 d . . . . .
C16 C 0.2364(3) 0.0984(5) 1.0219(5) 0.0512(18) Uani 1 1 d . . . . .
C17 C 0.2727(4) 0.1286(7) 1.1059(5) 0.061(2) Uani 1 1 d . . . . .
H17 H 0.2782 0.0750 1.1532 0.074 Uiso 1 1 calc R U . . .
C18 C 0.3003(3) 0.2392(6) 1.1187(4) 0.0518(18) Uani 1 1 d . . . . .
C19 C 0.2036(4) -0.0195(6) 1.0027(5) 0.082(3) Uani 1 1 d . . . . .
H19A H 0.2126 -0.0669 1.0561 0.123 Uiso 1 1 calc R U . . .
H19B H 0.1556 -0.0098 0.9844 0.123 Uiso 1 1 calc R U . . .
H19C H 0.2218 -0.0571 0.9552 0.123 Uiso 1 1 calc R U . . .
C20 C 0.3405(4) 0.2794(7) 1.2074(4) 0.072(2) Uani 1 1 d . . . . .
H20A H 0.3430 0.2172 1.2507 0.108 Uiso 1 1 calc R U . . .
H20B H 0.3854 0.3005 1.1996 0.108 Uiso 1 1 calc R U . . .
H20C H 0.3188 0.3461 1.2285 0.108 Uiso 1 1 calc R U . . .
C21 C 0.4700(3) 0.6202(5) 0.7589(4) 0.0544(18) Uani 1 1 d . . . . .
H21A H 0.4984 0.6477 0.8138 0.065 Uiso 1 1 calc R U . . .
H21B H 0.4775 0.6714 0.7102 0.065 Uiso 1 1 calc R U . . .
C22 C 0.4577(3) 0.4548(6) 0.6212(4) 0.0416(15) Uani 1 1 d . . . . .
C23 C 0.4380(4) 0.3294(6) 0.5029(5) 0.0553(19) Uani 1 1 d . . . . .
C24 C 0.4039(4) 0.4195(7) 0.4505(4) 0.0581(19) Uani 1 1 d . . . . .
H24 H 0.3846 0.4068 0.3904 0.070 Uiso 1 1 calc R U . . .
C25 C 0.3997(3) 0.5264(6) 0.4894(5) 0.0533(18) Uani 1 1 d . . . . .
C26 C 0.4486(4) 0.2108(6) 0.4652(5) 0.076(2) Uani 1 1 d . . . . .
H26A H 0.4272 0.2079 0.4029 0.114 Uiso 1 1 calc R U . . .
H26B H 0.4962 0.1963 0.4701 0.114 Uiso 1 1 calc R U . . .
H26C H 0.4291 0.1522 0.4985 0.114 Uiso 1 1 calc R U . . .
C27 C 0.3654(4) 0.6296(7) 0.4384(5) 0.081(2) Uani 1 1 d . . . . .
H27A H 0.3480 0.6070 0.3773 0.121 Uiso 1 1 calc R U . . .
H27B H 0.3287 0.6557 0.4666 0.121 Uiso 1 1 calc R U . . .
H27C H 0.3975 0.6920 0.4388 0.121 Uiso 1 1 calc R U . . .
F1 F -0.0733(9) 1.2416(18) 0.7935(16) 0.213(9) Uani 0.5 1 d D U P A 1
F2 F -0.0946(13) 1.071(2) 0.8276(19) 0.164(14) Uani 0.5 1 d D U P A 1
F3 F -0.0558(12) 1.182(2) 0.9282(14) 0.137(9) Uani 0.5 1 d D U P A 1
O1 O 0.0661(7) 1.1794(17) 0.8701(12) 0.113(7) Uani 0.5 1 d D U P A 1
O2 O 0.0242(8) 1.0332(14) 0.7891(11) 0.132(6) Uani 0.5 1 d D U P A 1
C28 C 0.0205(9) 1.1210(16) 0.8343(12) 0.070(8) Uani 0.5 1 d D U P A 1
C29 C -0.0514(10) 1.1562(16) 0.8464(12) 0.091(7) Uani 0.5 1 d D U P A 1
F1A F -0.0953(8) 1.086(2) 0.8196(16) 0.143(13) Uani 0.5 1 d D U P A 2
F2A F -0.0365(7) 1.0462(14) 0.9563(9) 0.146(5) Uani 0.5 1 d D U P A 2
F3A F -0.0597(13) 1.232(2) 0.9068(19) 0.190(15) Uani 0.5 1 d D U P A 2
O1A O 0.0640(10) 1.0496(19) 0.8704(15) 0.172(7) Uani 0.5 1 d D U P A 2
O2A O 0.0352(13) 1.210(2) 0.8111(17) 0.207(13) Uani 0.5 1 d D U P A 2
C28A C 0.0232(13) 1.1269(17) 0.8520(14) 0.104(10) Uani 0.5 1 d D U P A 2
C29A C -0.0443(13) 1.1212(16) 0.8861(13) 0.115(10) Uani 0.5 1 d D U P A 2
O0AA O -0.0926(10) 1.3173(19) 0.6949(19) 0.261(13) Uani 0.5 1 d D . P B 2
H0AA H -0.0504 1.3133 0.6942 0.391 Uiso 0.5 1 d DR U P B 2
H0AB H -0.1027 1.3887 0.6837 0.391 Uiso 0.5 1 d R U P B 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'
Ag Ag -0.8971 1.1015 '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'
S S 0.1246 0.1234 '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
N1 Ag N3 153.12(19) . 1_565
N1 Ag O1 114.3(4) . .
N3 Ag O1 92.0(4) 1_565 .
N1 Ag O1A 106.6(6) . .
N3 Ag O1A 98.0(5) 1_565 .
C4 S1 C7 101.6(3) . .
C15 S2 C14 103.2(3) . .
C22 S3 C21 101.9(3) . .
C4 N1 C1 116.0(6) . .
C4 N1 Ag 119.8(4) . .
C1 N1 Ag 122.0(5) . .
C4 N2 C3 115.7(6) . .
C15 N4 C18 115.5(6) . .
C15 N3 C16 116.6(6) . .
C15 N3 Ag 119.7(4) . 1_545
C16 N3 Ag 123.6(5) . 1_545
C22 N5 C23 115.6(6) . .
C22 N6 C25 115.5(6) . .
C2 C1 N1 119.2(7) . .
C2 C1 C5 124.0(8) . .
N1 C1 C5 116.9(7) . .
C1 C2 C3 121.0(7) . .
N2 C3 C2 120.3(7) . .
N2 C3 C6 116.3(8) . .
C2 C3 C6 123.4(8) . .
N2 C4 N1 127.6(6) . .
N2 C4 S1 119.3(5) . .
N1 C4 S1 113.1(5) . .
C8 C7 S1 109.4(4) . .
C9 C8 C13 119.3(6) . .
C9 C8 C7 120.5(6) . .
C13 C8 C7 120.2(6) . .
C8 C9 C10 121.5(6) . .
C11 C10 C9 118.1(6) . .
C11 C10 C21 120.6(6) . .
C9 C10 C21 121.2(6) . .
C10 C11 C12 121.9(6) . .
C13 C12 C11 118.2(6) . .
C13 C12 C14 121.6(6) . .
C11 C12 C14 120.2(6) . .
C12 C13 C8 121.0(6) . .
C12 C14 S2 108.6(4) . .
N4 C15 N3 127.3(6) . .
N4 C15 S2 119.8(5) . .
N3 C15 S2 112.8(5) . .
N3 C16 C17 120.2(6) . .
N3 C16 C19 117.2(6) . .
C17 C16 C19 122.6(6) . .
C18 C17 C16 119.1(6) . .
N4 C18 C17 121.2(7) . .
N4 C18 C20 116.0(6) . .
C17 C18 C20 122.8(6) . .
C10 C21 S3 114.5(4) . .
N6 C22 N5 128.1(6) . .
N6 C22 S3 118.8(5) . .
N5 C22 S3 113.2(5) . .
N5 C23 C24 120.9(6) . .
N5 C23 C26 116.5(7) . .
C24 C23 C26 122.6(7) . .
C25 C24 C23 118.5(6) . .
N6 C25 C24 121.5(6) . .
N6 C25 C27 115.9(7) . .
C24 C25 C27 122.7(7) . .
C28 O1 Ag 112.7(12) . .
O1 C28 O2 126.7(19) . .
O1 C28 C29 117.7(17) . .
O2 C28 C29 115.6(15) . .
F1 C29 F3 110.0(19) . .
F1 C29 F2 107.0(19) . .
F3 C29 F2 103.0(19) . .
F1 C29 C28 110.4(14) . .
F3 C29 C28 113.6(17) . .
F2 C29 C28 112.4(18) . .
C28A O1A Ag 100.2(17) . .
O2A C28A O1A 121(2) . .
O2A C28A C29A 119.0(19) . .
O1A C28A C29A 120(2) . .
F2A C29A F3A 114(2) . .
F2A C29A F1A 110.9(18) . .
F3A C29A F1A 105.9(19) . .
F2A C29A C28A 107.7(17) . .
F3A C29A C28A 106.7(18) . .
F1A C29A C28A 111.1(18) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag N1 2.206(5) .
Ag N3 2.239(5) 1_565
Ag O1 2.318(14) .
Ag O1A 2.55(2) .
S1 C4 1.764(7) .
S1 C7 1.800(6) .
S2 C15 1.759(6) .
S2 C14 1.829(6) .
S3 C22 1.765(6) .
S3 C21 1.819(6) .
N1 C4 1.345(8) .
N1 C1 1.372(9) .
N2 C4 1.321(8) .
N2 C3 1.359(9) .
N4 C15 1.335(8) .
N4 C18 1.351(8) .
N3 C15 1.341(8) .
N3 C16 1.342(7) .
N3 Ag 2.239(5) 1_545
N5 C22 1.337(7) .
N5 C23 1.340(8) .
N6 C22 1.328(7) .
N6 C25 1.352(8) .
C1 C2 1.360(10) .
C1 C5 1.496(10) .
C2 C3 1.372(10) .
C3 C6 1.495(10) .
C7 C8 1.514(8) .
C8 C9 1.374(8) .
C8 C13 1.391(8) .
C9 C10 1.394(8) .
C10 C11 1.388(8) .
C10 C21 1.503(8) .
C11 C12 1.393(8) .
C12 C13 1.391(8) .
C12 C14 1.503(8) .
C16 C17 1.387(9) .
C16 C19 1.503(9) .
C17 C18 1.379(9) .
C18 C20 1.504(9) .
C23 C24 1.399(9) .
C23 C26 1.499(9) .
C24 C25 1.363(9) .
C25 C27 1.505(9) .
F1 C29 1.286(18) .
F2 C29 1.301(19) .
F3 C29 1.288(18) .
O1 C28 1.182(15) .
O2 C28 1.222(16) .
C28 C29 1.539(17) .
F1A C29A 1.358(18) .
F2A C29A 1.348(17) .
F3A C29A 1.355(19) .
O1A C28A 1.202(17) .
O2A C28A 1.179(17) .
C28A C29A 1.533(18) .
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
C4 N1 C1 C2 2.9(10) .
Ag N1 C1 C2 -160.1(6) .
C4 N1 C1 C5 -178.4(7) .
Ag N1 C1 C5 18.5(9) .
N1 C1 C2 C3 -0.2(12) .
C5 C1 C2 C3 -178.7(8) .
C4 N2 C3 C2 4.8(10) .
C4 N2 C3 C6 -175.7(6) .
C1 C2 C3 N2 -3.9(12) .
C1 C2 C3 C6 176.6(7) .
C3 N2 C4 N1 -1.9(10) .
C3 N2 C4 S1 -179.3(5) .
C1 N1 C4 N2 -2.0(10) .
Ag N1 C4 N2 161.5(5) .
C1 N1 C4 S1 175.6(5) .
Ag N1 C4 S1 -20.9(6) .
C7 S1 C4 N2 -8.7(6) .
C7 S1 C4 N1 173.5(5) .
C4 S1 C7 C8 -177.5(5) .
S1 C7 C8 C9 -98.8(6) .
S1 C7 C8 C13 79.9(7) .
C13 C8 C9 C10 0.8(9) .
C7 C8 C9 C10 179.5(5) .
C8 C9 C10 C11 -1.0(9) .
C8 C9 C10 C21 -178.8(6) .
C9 C10 C11 C12 0.4(9) .
C21 C10 C11 C12 178.3(5) .
C10 C11 C12 C13 0.2(9) .
C10 C11 C12 C14 179.5(6) .
C11 C12 C13 C8 -0.4(9) .
C14 C12 C13 C8 -179.6(6) .
C9 C8 C13 C12 -0.1(9) .
C7 C8 C13 C12 -178.8(6) .
C13 C12 C14 S2 86.2(6) .
C11 C12 C14 S2 -93.0(6) .
C15 S2 C14 C12 153.5(5) .
C18 N4 C15 N3 0.1(9) .
C18 N4 C15 S2 -178.0(4) .
C16 N3 C15 N4 0.3(9) .
Ag N3 C15 N4 176.0(5) 1_545
C16 N3 C15 S2 178.4(4) .
Ag N3 C15 S2 -5.9(6) 1_545
C14 S2 C15 N4 -6.4(6) .
C14 S2 C15 N3 175.3(4) .
C15 N3 C16 C17 -0.4(9) .
Ag N3 C16 C17 -175.9(5) 1_545
C15 N3 C16 C19 178.8(6) .
Ag N3 C16 C19 3.3(8) 1_545
N3 C16 C17 C18 0.2(10) .
C19 C16 C17 C18 -179.0(6) .
C15 N4 C18 C17 -0.3(9) .
C15 N4 C18 C20 179.7(6) .
C16 C17 C18 N4 0.2(10) .
C16 C17 C18 C20 -179.8(6) .
C11 C10 C21 S3 61.4(7) .
C9 C10 C21 S3 -120.9(6) .
C22 S3 C21 C10 74.5(5) .
C25 N6 C22 N5 -0.3(9) .
C25 N6 C22 S3 178.6(4) .
C23 N5 C22 N6 0.3(9) .
C23 N5 C22 S3 -178.6(4) .
C21 S3 C22 N6 6.3(6) .
C21 S3 C22 N5 -174.6(4) .
C22 N5 C23 C24 -0.6(9) .
C22 N5 C23 C26 177.2(6) .
N5 C23 C24 C25 0.9(10) .
C26 C23 C24 C25 -176.7(6) .
C22 N6 C25 C24 0.7(9) .
C22 N6 C25 C27 -179.1(6) .
C23 C24 C25 N6 -0.9(10) .
C23 C24 C25 C27 178.8(6) .
Ag O1 C28 O2 15(2) .
Ag O1 C28 C29 -166.3(12) .
O1 C28 C29 F1 79(2) .
O2 C28 C29 F1 -102(2) .
O1 C28 C29 F3 -45(2) .
O2 C28 C29 F3 134(2) .
O1 C28 C29 F2 -161(2) .
O2 C28 C29 F2 18(2) .
Ag O1A C28A O2A 7(2) .
Ag O1A C28A C29A -169.6(13) .
O2A C28A C29A F2A -157(2) .
O1A C28A C29A F2A 20(2) .
O2A C28A C29A F3A -34(3) .
O1A C28A C29A F3A 143(2) .
O2A C28A C29A F1A 81(3) .
O1A C28A C29A F1A -102(2) .
