#------------------------------------------------------------------------------
#$Date: 2016-03-23 16:46:31 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179393 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/90/4329040.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_4329040
loop_
_publ_author_name
'Daniel J. Hutchinson'
'Scott A. Cameron'
'Lyall R. Hanton'
'Stephen C. Moratti'
_publ_contact_author             'Hanton, Lyall R.'
_publ_contact_author_email       lhanton@Chemistry.otago.ac.nz
_publ_section_title
;
 Sensitivity of Silver(I) Complexes of a Pyrimidine-Hydrazone Ligand to
 Solvent, Counteranion, and Metal-to-Ligand Ratio Changes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5070
_journal_page_last               5081
_journal_paper_doi               10.1021/ic2025582
_journal_volume                  51
_journal_year                    2012
_chemical_formula_moiety
'C50.58 H60 Ag4 F1.73 N20 O5.73 S0.58, 3.42(C F3 O3 S),O'
_chemical_formula_sum            'C54 H60 Ag4 F12 N20 O17 S4'
_chemical_formula_weight         2048.94
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.000
_cell_angle_beta                 127.895(6)
_cell_angle_gamma                90.000
_cell_formula_units_Z            4
_cell_length_a                   21.065(4)
_cell_length_b                   27.459(5)
_cell_length_c                   15.881(3)
_cell_measurement_reflns_used    9739
_cell_measurement_temperature    90(2)
_cell_measurement_theta_max      28.66
_cell_measurement_theta_min      2.45
_cell_volume                     7249(2)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_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    'SIR97 (Altomare et al., 1999)'
_diffrn_ambient_temperature      90(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker APEXII CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0332
_diffrn_reflns_av_sigmaI/netI    0.0223
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       33
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            43788
_diffrn_reflns_theta_full        25.50
_diffrn_reflns_theta_max         25.50
_diffrn_reflns_theta_min         1.50
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.291
_exptl_absorpt_correction_T_max  0.9500
_exptl_absorpt_correction_T_min  0.7230
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2004)'
_exptl_crystal_colour            'light yellow'
_exptl_crystal_density_diffrn    1.877
_exptl_crystal_description       plate
_exptl_crystal_F_000             4080
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.04
_refine_diff_density_max         2.604
_refine_diff_density_min         -1.591
_refine_diff_density_rms         0.152
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     650
_refine_ls_number_reflns         6732
_refine_ls_number_restraints     358
_refine_ls_restrained_S_all      1.072
_refine_ls_R_factor_all          0.0842
_refine_ls_R_factor_gt           0.0782
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1108P)²+101.9079P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2057
_refine_ls_wR_factor_ref         0.2127
_reflns_number_gt                6107
_reflns_number_total             6732
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic2025582_si_001_3.cif
_cod_data_source_block           djh123_complex3
_cod_database_code               4329040
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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
C1 C 1.1262(5) 0.3252(3) 1.3630(7) 0.052(2) Uani 1 1 d . . .
H1A H 1.1031 0.3184 1.2894 0.062 Uiso 1 1 calc R . .
H1B H 1.1668 0.3008 1.4080 0.062 Uiso 1 1 calc R . .
O1 O 1.0654(4) 0.3241(2) 1.3762(5) 0.0603(16) Uani 1 1 d . . .
H1 H 1.0530 0.2942 1.3904 0.072 Uiso 1 1 calc R . .
C2 C 1.1628(5) 0.3744(3) 1.3935(6) 0.0499(19) Uani 1 1 d . . .
C3 C 1.2358(5) 0.3848(5) 1.4905(7) 0.069(3) Uani 1 1 d . . .
H3 H 1.2664 0.3597 1.5382 0.082 Uiso 1 1 calc R . .
C4 C 1.2629(6) 0.4305(6) 1.5166(8) 0.080(4) Uani 1 1 d . . .
H4 H 1.3122 0.4371 1.5819 0.096 Uiso 1 1 calc R . .
C5 C 1.2185(6) 0.4671(5) 1.4476(8) 0.070(3) Uani 1 1 d . . .
H5 H 1.2362 0.4992 1.4654 0.084 Uiso 1 1 calc R . .
C6 C 1.1449(5) 0.4558(3) 1.3480(6) 0.0464(18) Uani 1 1 d . . .
C7 C 1.0959(5) 0.4940(3) 1.2712(7) 0.048(2) Uani 1 1 d . . .
H7 H 1.1096 0.5266 1.2899 0.057 Uiso 1 1 calc R . .
C8 C 0.9974(7) 0.5673(3) 1.1257(9) 0.061(2) Uani 1 1 d . . .
H8A H 0.9698 0.5778 1.1531 0.091 Uiso 1 1 calc R . .
H8B H 0.9771 0.5849 1.0613 0.091 Uiso 1 1 calc R . .
H8C H 1.0540 0.5735 1.1777 0.091 Uiso 1 1 calc R . .
C9 C 0.9189(5) 0.4981(2) 1.0055(7) 0.0421(17) Uani 1 1 d . . .
C10 C 0.8621(6) 0.5298(3) 0.9287(8) 0.050(2) Uani 1 1 d . . .
H10 H 0.8655 0.5631 0.9416 0.060 Uiso 1 1 calc R . .
C11 C 0.7997(5) 0.5103(3) 0.8315(7) 0.048(2) Uani 1 1 d . . .
C12 C 0.8502(5) 0.4340(3) 0.8935(6) 0.0414(16) Uani 1 1 d . . .
C13 C 0.8450(5) 0.3810(3) 0.8735(6) 0.0407(15) Uani 1 1 d . . .
H13A H 0.8459 0.3750 0.8147 0.061 Uiso 1 1 calc R . .
H13B H 0.7958 0.3687 0.8568 0.061 Uiso 1 1 calc R . .
H13C H 0.8898 0.3650 0.9362 0.061 Uiso 1 1 calc R . .
C14 C 0.7429(7) 0.5917(4) 0.7539(11) 0.078(3) Uani 1 1 d . . .
H14A H 0.7890 0.6016 0.8237 0.116 Uiso 1 1 calc R . .
H14B H 0.6948 0.6033 0.7416 0.116 Uiso 1 1 calc R . .
H14C H 0.7465 0.6051 0.7011 0.116 Uiso 1 1 calc R . .
C15 C 0.6278(7) 0.5402(5) 0.5701(10) 0.085(4) Uani 1 1 d . . .
H15 H 0.6273 0.5741 0.5695 0.102 Uiso 1 1 calc R . .
C16 C 0.5658(7) 0.5116(8) 0.4733(9) 0.102(6) Uani 1 1 d . . .
C17 C 0.5067(9) 0.5391(9) 0.3860(12) 0.154(10) Uani 1 1 d . . .
H17 H 0.5061 0.5730 0.3861 0.185 Uiso 1 1 calc R . .
C18 C 0.4479(14) 0.5108(14) 0.2972(19) 0.190(17) Uani 1 1 d . . .
H18 H 0.4051 0.5263 0.2358 0.228 Uiso 1 1 calc R . .
C19 C 0.4517(9) 0.4648(14) 0.2990(13) 0.188(17) Uani 1 1 d . . .
H19 H 0.4119 0.4476 0.2381 0.226 Uiso 1 1 calc R . .
C20 C 0.5141(7) 0.4383(10) 0.3900(10) 0.129(9) Uani 1 1 d . . .
C21 C 0.5200(11) 0.3879(11) 0.3960(11) 0.168(12) Uani 1 1 d . . .
H21A H 0.5730 0.3781 0.4199 0.202 Uiso 1 1 calc R . .
H21B H 0.5129 0.3761 0.4472 0.202 Uiso 1 1 calc R . .
C22 C 1.0823(8) 0.3101(4) 1.0629(11) 0.085(3) Uani 1 1 d . . .
C23 C 1.1082(17) 0.2651(7) 1.038(2) 0.185(11) Uani 1 1 d . . .
H23A H 1.1261 0.2412 1.0926 0.278 Uiso 1 1 calc R . .
H23B H 1.1514 0.2729 1.0355 0.278 Uiso 1 1 calc R . .
H23C H 1.0636 0.2523 0.9703 0.278 Uiso 1 1 calc R . .
N1 N 1.1186(3) 0.4098(2) 1.3223(5) 0.0388(13) Uani 1 1 d . . .
N2 N 1.0338(4) 0.4823(2) 1.1776(5) 0.0400(13) Uani 1 1 d . . .
N3 N 0.9844(4) 0.5156(2) 1.1028(6) 0.0451(15) Uani 1 1 d . . .
N4 N 0.9135(4) 0.4497(2) 0.9890(5) 0.0363(12) Uani 1 1 d . . .
N5 N 0.7929(4) 0.4613(2) 0.8119(5) 0.0424(14) Uani 1 1 d . A .
N6 N 0.7406(5) 0.5391(3) 0.7471(8) 0.065(2) Uani 1 1 d . . .
N7 N 0.6825(5) 0.5161(3) 0.6551(7) 0.063(2) Uani 1 1 d . A .
N8 N 0.5713(5) 0.4650(6) 0.4778(7) 0.093(4) Uani 1 1 d . A .
N9 N 1.0619(4) 0.3419(2) 1.0817(6) 0.0493(15) Uani 1 1 d . . .
O2 O 0.4639(14) 0.3690(10) 0.3003(9) 0.338(19) Uani 1 1 d . . .
H2 H 0.4674 0.3392 0.3039 0.507 Uiso 1 1 calc R . .
Ag1 Ag 1.00907(3) 0.396332(18) 1.13613(4) 0.0394(2) Uani 1 1 d . . .
Ag2 Ag 0.67462(4) 0.42924(3) 0.64334(5) 0.0670(3) Uani 1 1 d . . .
N10 N 0.6340(6) 0.3670(4) 0.6958(9) 0.108(4) Uani 1 1 d . A .
C24 C 0.6228(10) 0.3331(5) 0.7200(13) 0.140(8) Uani 1 1 d . . .
C25 C 0.6074(17) 0.2898(8) 0.752(2) 0.228(15) Uani 1 1 d . A .
H25A H 0.5506 0.2868 0.7156 0.342 Uiso 1 1 calc R . .
H25B H 0.6351 0.2907 0.8278 0.342 Uiso 1 1 calc R . .
H25C H 0.6260 0.2624 0.7352 0.342 Uiso 1 1 calc R . .
S1 S 0.7674(3) 0.38825(17) 0.5355(4) 0.0651(13) Uani 0.712(9) 1 d PD A 3
O12 O 0.7099(6) 0.4159(4) 0.4503(10) 0.083(3) Uani 0.712(9) 1 d P A 3
F13 F 0.7904(10) 0.2951(5) 0.5745(13) 0.135(5) Uani 0.712(9) 1 d PDU A 3
O13 O 0.8320(9) 0.3732(6) 0.5199(16) 0.159(9) Uani 0.712(9) 1 d P A 3
O11 O 0.8509(13) 0.3894(6) 0.6581(17) 0.141(7) Uani 0.712(9) 1 d P A 3
F12 F 0.6684(11) 0.3266(6) 0.5073(16) 0.195(7) Uani 0.712(9) 1 d PDU A 3
F11 F 0.6926(10) 0.3149(5) 0.4093(11) 0.144(5) Uani 0.712(9) 1 d PDU A 3
C26 C 0.7370(16) 0.3274(6) 0.502(2) 0.151(9) Uani 0.712(9) 1 d PDU A 3
S1A S 0.8061(7) 0.3727(4) 0.5771(9) 0.055(3) Uani 0.288(9) 1 d PD A 4
O11A O 0.7823(11) 0.4034(5) 0.6247(14) 0.047(4) Uani 0.288(9) 1 d PDU A 4
O12A O 0.770(2) 0.3779(11) 0.4658(14) 0.155(12) Uani 0.288(9) 1 d PDU A 4
O13A O 0.8914(9) 0.3606(10) 0.644(2) 0.153(12) Uani 0.288(9) 1 d PDU A 4
C26A C 0.7649(11) 0.3129(6) 0.5750(16) 0.057(8) Uani 0.288(9) 1 d PDU A 4
F11A F 0.7386(10) 0.3171(6) 0.6325(14) 0.067(5) Uani 0.288(9) 1 d PDU A 4
F12A F 0.7029(12) 0.2997(7) 0.4763(13) 0.081(6) Uani 0.288(9) 1 d PDU A 4
F13A F 0.8224(12) 0.2804(7) 0.6181(18) 0.082(6) Uani 0.288(9) 1 d PDU A 4
O1W O 0.5000 0.2462(17) 0.2500 0.289(19) Uani 1 2 d S . .
S2 S 0.3738(6) 0.2879(3) 0.4634(9) 0.125(3) Uani 0.674(13) 1 d PD B 1
O23 O 0.4429(11) 0.2558(8) 0.5238(19) 0.191(9) Uani 0.674(13) 1 d PDU B 1
O22 O 0.3882(13) 0.3378(5) 0.4805(17) 0.168(8) Uani 0.674(13) 1 d PDU B 1
O21 O 0.3088(11) 0.2695(7) 0.467(2) 0.182(7) Uani 0.674(13) 1 d PDU B 1
F23 F 0.2615(12) 0.2969(7) 0.2606(17) 0.257(11) Uani 0.674(13) 1 d PDU B 1
F21 F 0.3191(14) 0.2273(4) 0.3077(16) 0.215(9) Uani 0.674(13) 1 d PDU B 1
F22 F 0.3826(15) 0.2903(6) 0.3119(17) 0.206(8) Uani 0.674(13) 1 d PDU B 1
C27 C 0.3315(12) 0.2747(7) 0.3276(13) 0.203(11) Uani 0.674(13) 1 d PDU B 1
S2A S 0.3868(5) 0.2990(3) 0.5023(7) 0.053(2) Uani 0.326(13) 1 d PDU B 2
C27A C 0.3172(9) 0.2764(6) 0.3655(12) 0.066(6) Uani 0.326(13) 1 d PDU B 2
O21A O 0.4492(8) 0.2621(6) 0.5496(15) 0.048(4) Uani 0.326(13) 1 d PDU B 2
O22A O 0.3405(11) 0.2975(8) 0.5401(15) 0.075(6) Uani 0.326(13) 1 d PDU B 2
O23A O 0.4069(14) 0.3459(6) 0.4871(17) 0.064(6) Uani 0.326(13) 1 d PDU B 2
F21A F 0.2527(7) 0.3039(5) 0.3116(11) 0.059(4) Uani 0.326(13) 1 d PDU B 2
F22A F 0.2938(11) 0.2318(5) 0.3644(15) 0.098(7) Uani 0.326(13) 1 d PDU B 2
F23A F 0.3584(11) 0.2739(8) 0.3266(15) 0.091(6) Uani 0.326(13) 1 d PDU 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'
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
O1 C1 C2 107.8(6) . .
O1 C1 H1A 110.1 . .
C2 C1 H1A 110.1 . .
O1 C1 H1B 110.1 . .
C2 C1 H1B 110.1 . .
H1A C1 H1B 108.5 . .
C1 O1 Ag1 124.1(5) . 2_757
C1 O1 H1 118.0 . .
Ag1 O1 H1 118.0 2_757 .
N1 C2 C3 120.9(9) . .
N1 C2 C1 115.7(7) . .
C3 C2 C1 123.4(9) . .
C4 C3 C2 120.7(11) . .
C4 C3 H3 119.7 . .
C2 C3 H3 119.7 . .
C3 C4 C5 119.8(9) . .
C3 C4 H4 120.1 . .
C5 C4 H4 120.1 . .
C4 C5 C6 118.7(10) . .
C4 C5 H5 120.6 . .
C6 C5 H5 120.6 . .
N1 C6 C5 121.0(9) . .
N1 C6 C7 118.6(7) . .
C5 C6 C7 120.4(9) . .
N2 C7 C6 119.1(7) . .
N2 C7 H7 120.5 . .
C6 C7 H7 120.5 . .
N3 C8 H8A 109.5 . .
N3 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
N3 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
N4 C9 C10 122.0(8) . .
N4 C9 N3 118.0(7) . .
C10 C9 N3 120.0(7) . .
C9 C10 C11 117.4(7) . .
C9 C10 H10 121.3 . .
C11 C10 H10 121.3 . .
N5 C11 C10 122.0(7) . .
N5 C11 N6 115.8(9) . .
C10 C11 N6 122.2(8) . .
N5 C12 N4 126.8(7) . .
N5 C12 C13 116.2(7) . .
N4 C12 C13 116.9(6) . .
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 . .
N6 C14 H14A 109.5 . .
N6 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
N6 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
N7 C15 C16 117.5(12) . .
N7 C15 H15 121.2 . .
C16 C15 H15 121.2 . .
N8 C16 C17 126.4(19) . .
N8 C16 C15 118.4(9) . .
C17 C16 C15 115.1(19) . .
C16 C17 C18 113(2) . .
C16 C17 H17 123.3 . .
C18 C17 H17 123.3 . .
C19 C18 C17 121.6(17) . .
C19 C18 H18 119.2 . .
C17 C18 H18 119.2 . .
C18 C19 C20 123(3) . .
C18 C19 H19 118.6 . .
C20 C19 H19 118.6 . .
N8 C20 C21 118.7(14) . .
N8 C20 C19 117(3) . .
C21 C20 C19 125(2) . .
O2 C21 C20 109(2) . .
O2 C21 H21A 109.8 . .
C20 C21 H21A 109.8 . .
O2 C21 H21B 109.8 . .
C20 C21 H21B 109.8 . .
H21A C21 H21B 108.2 . .
N9 C22 C23 177.2(14) . .
C22 C23 H23A 109.5 . .
C22 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C22 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C6 N1 C2 118.9(7) . .
C6 N1 Ag1 115.1(5) . .
C2 N1 Ag1 124.7(5) . .
C7 N2 N3 122.7(7) . .
C7 N2 Ag1 117.2(5) . .
N3 N2 Ag1 120.1(5) . .
N2 N3 C9 116.8(6) . .
N2 N3 C8 121.3(7) . .
C9 N3 C8 121.8(7) . .
C12 N4 C9 116.5(6) . .
C12 N4 Ag1 123.9(4) . .
C9 N4 Ag1 119.3(5) . .
C12 N5 C11 115.3(7) . .
C12 N5 Ag2 124.6(5) . .
C11 N5 Ag2 119.9(5) . .
N7 N6 C11 117.2(8) . .
N7 N6 C14 120.8(8) . .
C11 N6 C14 121.9(10) . .
C15 N7 N6 121.5(11) . .
C15 N7 Ag2 117.0(10) . .
N6 N7 Ag2 121.5(5) . .
C16 N8 C20 119.1(13) . .
C16 N8 Ag2 117.8(9) . .
C20 N8 Ag2 122.9(13) . .
C22 N9 Ag1 167.1(8) . .
C21 O2 H2 109.5 . .
N9 Ag1 N1 103.8(2) . .
N9 Ag1 N2 131.1(2) . .
N1 Ag1 N2 68.5(2) . .
N9 Ag1 N4 109.5(2) . .
N1 Ag1 N4 133.7(2) . .
N2 Ag1 N4 65.5(2) . .
N9 Ag1 O1 83.1(2) . 2_757
N1 Ag1 O1 107.7(2) . 2_757
N2 Ag1 O1 145.88(19) . 2_757
N4 Ag1 O1 107.4(2) . 2_757
N10 Ag2 N8 114.9(4) . .
N10 Ag2 N7 137.9(4) . .
N8 Ag2 N7 69.2(4) . .
N10 Ag2 N5 103.2(3) . .
N8 Ag2 N5 133.8(4) . .
N7 Ag2 N5 65.1(3) . .
N10 Ag2 O11A 113.0(5) . .
N8 Ag2 O11A 105.2(4) . .
N7 Ag2 O11A 105.1(4) . .
N5 Ag2 O11A 81.2(4) . .
C24 N10 Ag2 168.6(17) . .
N10 C24 C25 179(3) . .
C24 C25 H25A 109.5 . .
C24 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
C24 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
O12 S1 O13 108.3(8) . .
O12 S1 O11 145.0(8) . .
O13 S1 O11 78.0(10) . .
O12 S1 C26 107.1(10) . .
O13 S1 C26 83.9(12) . .
O11 S1 C26 107.7(11) . .
F11 C26 F13 117.9(19) . .
F11 C26 F12 90.7(19) . .
F13 C26 F12 106(2) . .
F11 C26 S1 120.1(18) . .
F13 C26 S1 114.7(16) . .
F12 C26 S1 100.6(16) . .
O11A S1A O12A 120.3(15) . .
O11A S1A O13A 115.3(14) . .
O12A S1A O13A 113.8(14) . .
O11A S1A C26A 102.9(9) . .
O12A S1A C26A 100.3(11) . .
O13A S1A C26A 99.5(12) . .
S1A O11A Ag2 149.0(11) . .
F13A C26A F11A 109.9(15) . .
F13A C26A F12A 110.6(15) . .
F11A C26A F12A 108.1(14) . .
F13A C26A S1A 108.8(13) . .
F11A C26A S1A 107.4(11) . .
F12A C26A S1A 111.9(13) . .
O22 S2 O23 117.4(13) . .
O22 S2 O21 114.8(11) . .
O23 S2 O21 109.9(10) . .
O22 S2 C27 108.7(9) . .
O23 S2 C27 103.2(10) . .
O21 S2 C27 100.9(10) . .
F22 C27 F23 109.5(16) . .
F22 C27 F21 109.8(15) . .
F23 C27 F21 107.6(15) . .
F22 C27 S2 107.6(13) . .
F23 C27 S2 111.0(14) . .
F21 C27 S2 111.3(13) . .
O23A S2A O22A 116.8(12) . .
O23A S2A O21A 116.7(11) . .
O22A S2A O21A 113.5(11) . .
O23A S2A C27A 102.2(10) . .
O22A S2A C27A 103.5(9) . .
O21A S2A C27A 100.9(9) . .
F21A C27A F22A 107.3(14) . .
F21A C27A F23A 115.7(15) . .
F22A C27A F23A 106.8(15) . .
F21A C27A S2A 109.5(11) . .
F22A C27A S2A 110.7(12) . .
F23A C27A S2A 107.0(12) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.419(9) .
C1 C2 1.483(13) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
O1 Ag1 2.461(5) 2_757
O1 H1 0.9300 .
C2 N1 1.340(11) .
C2 C3 1.382(13) .
C3 C4 1.336(18) .
C3 H3 0.9300 .
C4 C5 1.352(17) .
C4 H4 0.9300 .
C5 C6 1.411(13) .
C5 H5 0.9300 .
C6 N1 1.337(10) .
C6 C7 1.452(13) .
C7 N2 1.280(11) .
C7 H7 0.9300 .
C8 N3 1.450(10) .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 N4 1.344(9) .
C9 C10 1.372(11) .
C9 N3 1.380(11) .
C10 C11 1.380(13) .
C10 H10 0.9300 .
C11 N5 1.368(11) .
C11 N6 1.386(11) .
C12 N5 1.333(10) .
C12 N4 1.335(10) .
C12 C13 1.478(10) .
C13 H13A 0.9600 .
C13 H13B 0.9600 .
C13 H13C 0.9600 .
C14 N6 1.446(13) .
C14 H14A 0.9600 .
C14 H14B 0.9600 .
C14 H14C 0.9600 .
C15 N7 1.294(12) .
C15 C16 1.49(2) .
C15 H15 0.9300 .
C16 N8 1.28(2) .
C16 C17 1.386(16) .
C17 C18 1.41(4) .
C17 H17 0.9300 .
C18 C19 1.27(5) .
C18 H18 0.9300 .
C19 C20 1.42(3) .
C19 H19 0.9300 .
C20 N8 1.37(2) .
C20 C21 1.39(3) .
C21 O2 1.331(19) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 N9 1.093(12) .
C22 C23 1.498(18) .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
N1 Ag1 2.412(6) .
N2 N3 1.346(9) .
N2 Ag1 2.420(6) .
N4 Ag1 2.426(6) .
N5 Ag2 2.441(7) .
N6 N7 1.355(13) .
N7 Ag2 2.391(9) .
N8 Ag2 2.363(9) .
N9 Ag1 2.324(7) .
O2 H2 0.8200 .
Ag1 O1 2.461(5) 2_757
Ag2 N10 2.286(13) .
Ag2 O11A 2.562(15) .
N10 C24 1.087(17) .
C24 C25 1.41(2) .
C25 H25A 0.9600 .
C25 H25B 0.9600 .
C25 H25C 0.9600 .
S1 O12 1.364(12) .
S1 O13 1.581(12) .
S1 O11 1.64(2) .
S1 C26 1.750(16) .
F13 C26 1.34(2) .
F12 C26 1.49(3) .
F11 C26 1.22(2) .
S1A O11A 1.412(13) .
S1A O12A 1.440(15) .
S1A O13A 1.458(16) .
S1A C26A 1.846(15) .
C26A F13A 1.310(17) .
C26A F11A 1.333(16) .
C26A F12A 1.335(17) .
S2 O22 1.395(13) .
S2 O23 1.449(12) .
S2 O21 1.494(13) .
S2 C27 1.794(14) .
F23 C27 1.324(17) .
F21 C27 1.327(17) .
F22 C27 1.317(17) .
S2A O23A 1.421(14) .
S2A O22A 1.426(14) .
S2A O21A 1.451(13) .
S2A C27A 1.828(13) .
C27A F21A 1.312(16) .
C27A F22A 1.317(16) .
C27A F23A 1.341(17) .
