# Electronic Supplementary Material (ESI) for Dalton Transactions
# This journal is © The Royal Society of Chemistry 2013

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# 
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#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
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#  fide research purposes only. It may contain copyright material
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data_962763

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_sum            'C40 H32 Ag2 F6 N4 O8'
_chemical_formula_weight         1026.44

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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   P21/c
_symmetry_space_group_name_Hall  '-P 2ybc'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   14.7044(15)
_cell_length_b                   15.9797(16)
_cell_length_c                   16.2718(17)
_cell_angle_alpha                90.00
_cell_angle_beta                 91.634(2)
_cell_angle_gamma                90.00
_cell_volume                     3821.9(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    6025
_cell_measurement_theta_min      2.24
_cell_measurement_theta_max      25.24

_exptl_crystal_description       ?
_exptl_crystal_colour            ?
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.11
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.784
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2048
_exptl_absorpt_coefficient_mu    1.114
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8246
_exptl_absorpt_correction_T_max  0.8872
_exptl_absorpt_process_details   sadabs

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            19508
_diffrn_reflns_av_R_equivalents  0.0731
_diffrn_reflns_av_unetI/netI     0.0558
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_theta_min         1.79
_diffrn_reflns_theta_max         25.50
_reflns_number_total             7085
_reflns_number_gt                5358
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker SMART'
_computing_cell_refinement       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F^2^ against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F^2^, conventional R-factors R are based 
 on F, with F set to zero for negative F^2^. The threshold expression of 
 F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F^2^ are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.1115P)^2^+5.9486P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         7085
_refine_ls_number_parameters     469
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0910
_refine_ls_R_factor_gt           0.0711
_refine_ls_wR_factor_ref         0.1998
_refine_ls_wR_factor_gt          0.1859
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_restrained_S_all      1.038
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
Ag1 Ag -0.08026(4) 0.92015(4) 0.13984(3) 0.0619(2) Uani 1 1 d . B .
Ag2 Ag 0.47515(4) 0.86907(4) -0.31915(3) 0.0649(2) Uani 1 1 d . . .
C1 C -0.3921(5) 1.0028(5) 0.5809(4) 0.0624(18) Uani 1 1 d . . .
C2 C -0.3744(4) 1.0455(4) 0.6522(4) 0.0490(14) Uani 1 1 d . . .
C3 C -0.2937(6) 1.0886(5) 0.6592(5) 0.077(2) Uani 1 1 d . . .
C4 C -0.4385(4) 1.0436(4) 0.7211(4) 0.0496(14) Uani 1 1 d . . .
C5 C -0.4983(6) 1.0952(5) 0.8354(4) 0.069(2) Uani 1 1 d . . .
H5A H -0.5417 1.1409 0.8324 0.083 Uiso 1 1 calc R . .
H5B H -0.4727 1.0919 0.8909 0.083 Uiso 1 1 calc R . .
C6 C -0.5430(6) 1.0133(5) 0.8103(5) 0.081(2) Uani 1 1 d . . .
H6A H -0.5317 0.9705 0.8516 0.098 Uiso 1 1 calc R . .
H6B H -0.6081 1.0201 0.8020 0.098 Uiso 1 1 calc R . .
C7 C 0.4467(5) 0.7730(5) -0.4866(4) 0.0629(18) Uani 1 1 d . . .
H7A H 0.5011 0.7396 -0.4773 0.075 Uiso 1 1 calc R . .
H7B H 0.4627 0.8240 -0.5151 0.075 Uiso 1 1 calc R . .
C8 C 0.3754(5) 0.7247(6) -0.5345(5) 0.080(2) Uani 1 1 d . . .
H8A H 0.3578 0.7538 -0.5848 0.096 Uiso 1 1 calc R . .
H8B H 0.3973 0.6694 -0.5483 0.096 Uiso 1 1 calc R . .
C9 C 0.3241(4) 0.7606(4) -0.4097(4) 0.0476(14) Uani 1 1 d . . .
C10 C 0.2560(4) 0.7627(4) -0.3449(3) 0.0425(13) Uani 1 1 d . . .
C11 C 0.1687(5) 0.7340(5) -0.3601(4) 0.067(2) Uani 1 1 d . . .
H11 H 0.1528 0.7134 -0.4120 0.080 Uiso 1 1 calc R . .
C12 C 0.1058(4) 0.7352(5) -0.3012(4) 0.066(2) Uani 1 1 d . . .
H12 H 0.0477 0.7147 -0.3133 0.079 Uiso 1 1 calc R . .
H3 H -0.2808 1.1178 0.7071 0.079 Uiso 1 1 d R . .
C13 C 0.1255(3) 0.7663(3) -0.2232(3) 0.0382(12) Uani 1 1 d . . .
C14 C 0.2117(4) 0.7970(4) -0.2084(4) 0.0541(16) Uani 1 1 d . . .
H14 H 0.2268 0.8206 -0.1576 0.065 Uiso 1 1 calc R . .
H1 H -0.4468 0.9740 0.5758 0.065 Uiso 1 1 d R . .
C15 C 0.2764(4) 0.7932(5) -0.2686(4) 0.0600(17) Uani 1 1 d . . .
H15 H 0.3352 0.8120 -0.2565 0.072 Uiso 1 1 calc R . .
C16 C 0.0576(4) 0.7652(3) -0.1563(3) 0.0385(12) Uani 1 1 d . . .
C17 C -0.0090(4) 0.7031(4) -0.1539(4) 0.0469(14) Uani 1 1 d . . .
H17 H -0.0127 0.6635 -0.1957 0.056 Uiso 1 1 calc R . .
C18 C -0.0690(4) 0.6994(4) -0.0911(4) 0.0465(14) Uani 1 1 d . . .
H18 H -0.1123 0.6570 -0.0904 0.056 Uiso 1 1 calc R . .
C19 C -0.0655(4) 0.7586(4) -0.0283(3) 0.0421(13) Uani 1 1 d . . .
C20 C 0.0000(4) 0.8213(4) -0.0310(4) 0.0464(14) Uani 1 1 d . . .
H20 H 0.0029 0.8618 0.0101 0.056 Uiso 1 1 calc R . .
C21 C 0.0604(4) 0.8242(4) -0.0939(4) 0.0469(14) Uani 1 1 d . . .
H21 H 0.1039 0.8664 -0.0945 0.056 Uiso 1 1 calc R . .
C22 C -0.1302(4) 0.7530(4) 0.0386(3) 0.0435(13) Uani 1 1 d . . .
C23 C -0.2491(5) 0.6953(5) 0.1025(4) 0.0656(19) Uani 1 1 d . . .
H23A H -0.2490 0.6447 0.1354 0.079 Uiso 1 1 calc R . .
H23B H -0.3109 0.7068 0.0831 0.079 Uiso 1 1 calc R . .
C24 C -0.2104(5) 0.7684(5) 0.1514(4) 0.0635(18) Uani 1 1 d . . .
H24A H -0.2563 0.8111 0.1589 0.076 Uiso 1 1 calc R . .
H24B H -0.1875 0.7502 0.2049 0.076 Uiso 1 1 calc R . .
C25 C 0.1027(5) 1.0122(5) 0.1660(5) 0.074(2) Uani 1 1 d . . .
H25A H 0.0935 1.0299 0.1093 0.089 Uiso 1 1 calc R . .
H25B H 0.1394 0.9617 0.1671 0.089 Uiso 1 1 calc R . .
C26 C 0.1470(6) 1.0790(5) 0.2154(5) 0.080(2) Uani 1 1 d . . .
H26A H 0.2083 1.0630 0.2324 0.096 Uiso 1 1 calc R . .
H26B H 0.1493 1.1308 0.1846 0.096 Uiso 1 1 calc R . .
C27 C 0.0155(4) 1.0407(4) 0.2708(4) 0.0498(14) Uani 1 1 d . . .
C28 C -0.0550(4) 1.0424(4) 0.3336(4) 0.0461(13) Uani 1 1 d . . .
C29 C -0.1424(4) 1.0168(4) 0.3179(4) 0.0585(17) Uani 1 1 d . . .
H29 H -0.1598 0.9986 0.2655 0.070 Uiso 1 1 calc R . .
C30 C -0.2049(5) 1.0179(5) 0.3789(4) 0.0624(18) Uani 1 1 d . . .
H30 H -0.2638 0.9997 0.3664 0.075 Uiso 1 1 calc R . .
C31 C -0.1846(4) 1.0443(4) 0.4574(4) 0.0485(14) Uani 1 1 d . . .
C32 C -0.0965(5) 1.0723(6) 0.4720(5) 0.085(3) Uani 1 1 d . . .
H32 H -0.0796 1.0921 0.5240 0.101 Uiso 1 1 calc R . .
C33 C -0.0321(5) 1.0716(6) 0.4101(5) 0.083(3) Uani 1 1 d . . .
H33 H 0.0266 1.0912 0.4213 0.099 Uiso 1 1 calc R . .
C34 C -0.2504(4) 1.0456(4) 0.5238(4) 0.0483(14) Uani 1 1 d . . .
C35 C -0.3326(5) 1.0036(5) 0.5179(4) 0.0641(18) Uani 1 1 d . . .
H35 H -0.3479 0.9751 0.4696 0.077 Uiso 1 1 calc R . .
C36 C -0.2333(5) 1.0874(5) 0.5974(5) 0.077(2) Uani 1 1 d . . .
H36 H -0.1783 1.1156 0.6048 0.093 Uiso 1 1 calc R . .
C37 C 0.6423(5) 0.7191(6) -0.1495(5) 0.081(2) Uani 1 1 d . . .
C38 C -0.3067(9) 0.9714(8) -0.0130(9) 0.118 Uani 1 1 d . . .
C39 C 0.5803(5) 0.7723(5) -0.2020(4) 0.0603(17) Uani 1 1 d . A .
C40 C -0.2320(5) 0.9853(5) 0.0469(4) 0.0654(19) Uani 1 1 d . B .
N1 N -0.4993(4) 0.9913(3) 0.7323(3) 0.0559(13) Uani 1 1 d . . .
N2 N 0.4022(3) 0.7922(3) -0.4075(3) 0.0499(12) Uani 1 1 d . . .
N3 N -0.1358(3) 0.8005(3) 0.1012(3) 0.0505(12) Uani 1 1 d . . .
N4 N 0.0149(4) 0.9977(3) 0.2050(3) 0.0528(13) Uani 1 1 d . . .
O1 O -0.4272(4) 1.1065(3) 0.7760(3) 0.074 Uani 1 1 d . . .
O2 O 0.2989(3) 0.7194(4) -0.4791(3) 0.076 Uani 1 1 d . . .
O3 O -0.1881(3) 0.6874(3) 0.0338(3) 0.060 Uani 1 1 d . . .
O4 O 0.0889(3) 1.0879(3) 0.2870(3) 0.070 Uani 1 1 d . . .
O5 O 0.5073(3) 0.7906(4) -0.1735(3) 0.079 Uani 1 1 d . . .
O6 O 0.6104(4) 0.7914(4) -0.2697(3) 0.085 Uani 1 1 d . . .
O7 O -0.2519(4) 0.9802(6) 0.1190(4) 0.112 Uani 1 1 d . . .
O8 O -0.1566(4) 0.9937(4) 0.0194(4) 0.085 Uani 1 1 d . . .
F3 F 0.6662(6) 0.6471(5) -0.1900(5) 0.116 Uani 0.80 1 d P A 1
F4 F -0.3864(7) 1.0140(6) 0.0063(6) 0.138 Uani 0.80 1 d P B 1
F5 F -0.3438(7) 0.8952(6) -0.0033(6) 0.142 Uani 0.80 1 d P B 1
F6 F -0.3028(6) 0.9874(7) -0.0868(6) 0.137 Uani 0.80 1 d P B 1
F1 F 0.6205(6) 0.6926(7) -0.0819(6) 0.114 Uani 0.70 1 d P A 1
F2 F 0.7275(5) 0.7494(5) -0.1455(5) 0.115 Uani 0.80 1 d P A 1
F4' F -0.2890(11) 0.9150(10) -0.0688(11) 0.048 Uani 0.20 1 d P B 2
F6' F -0.2956(10) 1.0427(10) -0.0794(10) 0.042 Uani 0.20 1 d P B 2
F5' F -0.3901(11) 0.9633(11) 0.0030(10) 0.047 Uani 0.20 1 d P B 2
F1' F 0.5961(18) 0.6436(14) -0.131(2) 0.111 Uani 0.20 1 d P A 2
F2' F 0.6404(8) 0.7422(7) -0.0677(6) 0.044 Uani 0.30 1 d P A 2
F3' F 0.7195(12) 0.6936(11) -0.1722(11) 0.050 Uani 0.20 1 d P A 2

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.0660(4) 0.0711(4) 0.0492(3) -0.0156(2) 0.0102(2) 0.0004(3)
Ag2 0.0563(3) 0.0756(4) 0.0636(4) -0.0020(3) 0.0164(3) -0.0194(3)
C1 0.054(4) 0.084(5) 0.050(4) -0.010(3) 0.011(3) -0.021(3)
C2 0.057(4) 0.041(3) 0.049(3) 0.003(3) 0.013(3) -0.003(3)
C3 0.082(5) 0.092(6) 0.058(4) -0.037(4) 0.027(4) -0.032(4)
C4 0.057(4) 0.048(3) 0.044(3) -0.001(3) 0.010(3) 0.007(3)
C5 0.081(5) 0.078(5) 0.048(4) -0.003(3) 0.019(4) 0.011(4)
C6 0.089(6) 0.087(6) 0.070(5) -0.005(4) 0.041(4) -0.004(5)
C7 0.058(4) 0.082(5) 0.051(4) 0.012(3) 0.023(3) 0.003(4)
C8 0.069(5) 0.118(7) 0.053(4) -0.006(4) 0.029(4) -0.009(5)
C9 0.050(3) 0.052(3) 0.041(3) 0.005(3) 0.007(3) 0.001(3)
C10 0.039(3) 0.052(3) 0.037(3) 0.001(2) 0.009(2) -0.002(3)
C11 0.053(4) 0.106(6) 0.042(4) -0.020(4) 0.012(3) -0.022(4)
C12 0.040(3) 0.104(6) 0.054(4) -0.017(4) 0.010(3) -0.027(4)
C13 0.035(3) 0.041(3) 0.039(3) 0.003(2) 0.006(2) 0.008(2)
C14 0.045(3) 0.075(4) 0.043(3) -0.009(3) 0.011(3) -0.014(3)
C15 0.041(3) 0.086(5) 0.054(4) -0.007(3) 0.008(3) -0.017(3)
C16 0.036(3) 0.042(3) 0.037(3) 0.007(2) 0.002(2) 0.004(2)
C17 0.043(3) 0.050(3) 0.048(3) -0.009(3) 0.008(3) -0.006(3)
C18 0.042(3) 0.054(4) 0.044(3) -0.007(3) 0.012(3) -0.007(3)
C19 0.034(3) 0.054(3) 0.039(3) 0.002(3) 0.006(2) 0.005(2)
C20 0.048(3) 0.045(3) 0.046(3) -0.007(3) 0.008(3) 0.000(3)
C21 0.045(3) 0.045(3) 0.050(3) -0.005(3) 0.011(3) -0.005(3)
C22 0.039(3) 0.054(3) 0.037(3) 0.008(3) 0.007(2) 0.006(3)
C23 0.054(4) 0.100(6) 0.044(4) -0.003(4) 0.016(3) -0.014(4)
C24 0.069(4) 0.074(5) 0.049(4) 0.003(3) 0.028(3) 0.003(4)
C25 0.074(5) 0.091(6) 0.058(4) -0.006(4) 0.031(4) -0.002(4)
C26 0.071(5) 0.096(6) 0.073(5) -0.012(4) 0.037(4) -0.022(4)
C27 0.056(4) 0.046(3) 0.048(4) 0.005(3) 0.009(3) -0.001(3)
C28 0.055(4) 0.044(3) 0.039(3) -0.003(3) 0.008(3) -0.001(3)
C29 0.058(4) 0.074(4) 0.044(3) -0.018(3) 0.011(3) -0.005(3)
C30 0.051(4) 0.079(5) 0.058(4) -0.014(4) 0.007(3) -0.012(3)
C31 0.061(4) 0.043(3) 0.042(3) -0.005(3) 0.009(3) -0.004(3)
C32 0.069(5) 0.134(8) 0.051(4) -0.030(4) 0.020(4) -0.044(5)
C33 0.064(5) 0.126(7) 0.059(5) -0.023(5) 0.021(4) -0.042(5)
C34 0.054(4) 0.043(3) 0.049(3) -0.001(3) 0.011(3) -0.007(3)
C35 0.067(4) 0.079(5) 0.047(4) -0.008(3) 0.004(3) -0.019(4)
C36 0.070(5) 0.091(6) 0.072(5) -0.034(4) 0.025(4) -0.038(4)
C37 0.067(5) 0.117(7) 0.061(5) 0.023(5) 0.032(4) 0.015(5)
C38 0.112 0.110 0.132 -0.004 0.002 0.006
C39 0.053(4) 0.071(4) 0.058(4) 0.000(3) 0.011(3) 0.003(3)
C40 0.064(4) 0.081(5) 0.051(4) -0.009(3) 0.003(3) 0.019(4)
N1 0.056(3) 0.056(3) 0.057(3) 0.001(3) 0.025(3) -0.001(3)
N2 0.043(3) 0.063(3) 0.044(3) 0.008(2) 0.013(2) -0.003(2)
N3 0.050(3) 0.060(3) 0.043(3) -0.002(2) 0.013(2) 0.007(2)
N4 0.058(3) 0.054(3) 0.047(3) -0.003(2) 0.016(2) 0.003(2)
O1 0.091 0.071 0.062 -0.015 0.030 -0.013
O2 0.062 0.118 0.048 -0.023 0.017 -0.021
O3 0.052 0.079 0.049 -0.007 0.018 -0.017
O4 0.070 0.083 0.059 -0.014 0.026 -0.023
O5 0.054 0.112 0.072 0.009 0.029 0.017
O6 0.083 0.113 0.062 0.022 0.035 0.028
O7 0.088 0.193 0.055 0.002 0.026 0.026
O8 0.070 0.112 0.075 0.004 0.020 -0.001
F3 0.118 0.115 0.116 -0.001 0.004 0.004
F4 0.136 0.140 0.138 0.000 0.005 0.001
F5 0.143 0.140 0.143 0.001 0.003 -0.002
F6 0.136 0.139 0.135 -0.001 0.003 0.001
F1 0.114 0.115 0.112 0.003 0.005 0.001
F2 0.111 0.117 0.115 0.003 0.003 -0.001
F4' 0.048 0.048 0.048 -0.010 0.001 0.000
F6' 0.042 0.042 0.042 0.001 0.001 0.000
F5' 0.046 0.047 0.047 0.000 0.001 0.000
F1' 0.097 0.046 0.186 0.071 -0.046 -0.016
F2' 0.065 0.047 0.021 -0.015 -0.017 0.006
F3' 0.050 0.050 0.050 0.000 0.001 0.000

_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Ag1 N4 2.129(6) . ?
Ag1 N3 2.166(5) . ?
Ag1 O8 2.522(6) . ?
Ag2 N2 2.153(5) . ?
Ag2 N1 2.154(6) 1_654 ?
Ag2 O6 2.460(6) . ?
C1 C2 1.364(9) . ?
C1 C35 1.367(9) . ?
C1 H1 0.9287 . ?
C2 C3 1.374(9) . ?
C2 C4 1.486(8) . ?
C3 C36 1.360(10) . ?
C3 H3 0.9237 . ?
C4 N1 1.240(8) . ?
C4 O1 1.353(8) . ?
C5 O1 1.454(8) . ?
C5 C6 1.516(12) . ?
C5 H5A 0.9700 . ?
C5 H5B 0.9700 . ?
C6 N1 1.480(9) . ?
C6 H6A 0.9700 . ?
C6 H6B 0.9700 . ?
C7 N2 1.493(8) . ?
C7 C8 1.502(11) . ?
C7 H7A 0.9700 . ?
C7 H7B 0.9700 . ?
C8 O2 1.464(8) . ?
C8 H8A 0.9700 . ?
C8 H8B 0.9700 . ?
C9 N2 1.255(8) . ?
C9 O2 1.349(8) . ?
C9 C10 1.475(8) . ?
C10 C15 1.360(9) . ?
C10 C11 1.379(8) . ?
C11 C12 1.351(9) . ?
C11 H11 0.9300 . ?
C12 C13 1.387(8) . ?
C12 H12 0.9300 . ?
C13 C14 1.374(8) . ?
C13 C16 1.499(7) . ?
C14 C15 1.387(9) . ?
C14 H14 0.9300 . ?
C15 H15 0.9300 . ?
C16 C21 1.385(8) . ?
C16 C17 1.395(8) . ?
C17 C18 1.370(8) . ?
C17 H17 0.9300 . ?
C18 C19 1.393(8) . ?
C18 H18 0.9300 . ?
C19 C20 1.391(8) . ?
C19 C22 1.469(8) . ?
C20 C21 1.375(8) . ?
C20 H20 0.9300 . ?
C21 H21 0.9300 . ?
C22 N3 1.274(8) . ?
C22 O3 1.350(7) . ?
C23 O3 1.459(7) . ?
C23 C24 1.515(10) . ?
C23 H23A 0.9700 . ?
C23 H23B 0.9700 . ?
C24 N3 1.479(8) . ?
C24 H24A 0.9700 . ?
C24 H24B 0.9700 . ?
C25 N4 1.474(8) . ?
C25 C26 1.476(11) . ?
C25 H25A 0.9700 . ?
C25 H25B 0.9700 . ?
C26 O4 1.470(8) . ?
C26 H26A 0.9700 . ?
C26 H26B 0.9700 . ?
C27 N4 1.271(8) . ?
C27 O4 1.337(8) . ?
C27 C28 1.477(8) . ?
C28 C33 1.363(10) . ?
C28 C29 1.366(9) . ?
C29 C30 1.371(9) . ?
C29 H29 0.9300 . ?
C30 C31 1.369(9) . ?
C30 H30 0.9300 . ?
C31 C32 1.385(10) . ?
C31 C34 1.473(8) . ?
C32 C33 1.402(10) . ?
C32 H32 0.9300 . ?
C33 H33 0.9300 . ?
C34 C35 1.383(9) . ?
C34 C36 1.388(10) . ?
C35 H35 0.9300 . ?
C36 H36 0.9300 . ?
C37 F1 1.231(11) . ?
C37 F3' 1.271(18) . ?
C37 F2 1.343(11) . ?
C37 F3 1.377(12) . ?
C37 F2' 1.383(12) . ?
C37 F1' 1.42(2) . ?
C37 C39 1.496(11) . ?
C38 F6 1.232(15) . ?
C38 F5' 1.27(2) . ?
C38 F4' 1.31(2) . ?
C38 F5 1.345(15) . ?
C38 F4 1.398(14) . ?
C38 C40 1.465(15) . ?
C38 F6' 1.58(2) . ?
C39 O5 1.217(8) . ?
C39 O6 1.237(8) . ?
C40 O8 1.214(9) . ?
C40 O7 1.220(9) . ?
N1 Ag2 2.154(6) 1_456 ?

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
N4 Ag1 N3 153.6(2) . . ?
N4 Ag1 O8 112.8(2) . . ?
N3 Ag1 O8 91.7(2) . . ?
N2 Ag2 N1 148.7(2) . 1_654 ?
N2 Ag2 O6 108.3(2) . . ?
N1 Ag2 O6 101.5(2) 1_654 . ?
C2 C1 C35 121.5(6) . . ?
C2 C1 H1 117.9 . . ?
C35 C1 H1 120.6 . . ?
C1 C2 C3 117.7(6) . . ?
C1 C2 C4 121.4(6) . . ?
C3 C2 C4 120.9(6) . . ?
C36 C3 C2 120.8(6) . . ?
C36 C3 H3 120.5 . . ?
C2 C3 H3 118.7 . . ?
N1 C4 O1 118.6(6) . . ?
N1 C4 C2 126.9(6) . . ?
O1 C4 C2 114.5(6) . . ?
O1 C5 C6 104.0(6) . . ?
O1 C5 H5A 110.9 . . ?
C6 C5 H5A 110.9 . . ?
O1 C5 H5B 110.9 . . ?
C6 C5 H5B 110.9 . . ?
H5A C5 H5B 109.0 . . ?
N1 C6 C5 103.9(6) . . ?
N1 C6 H6A 111.0 . . ?
C5 C6 H6A 111.0 . . ?
N1 C6 H6B 111.0 . . ?
C5 C6 H6B 111.0 . . ?
H6A C6 H6B 109.0 . . ?
N2 C7 C8 103.6(5) . . ?
N2 C7 H7A 111.0 . . ?
C8 C7 H7A 111.0 . . ?
N2 C7 H7B 111.0 . . ?
C8 C7 H7B 111.0 . . ?
H7A C7 H7B 109.0 . . ?
O2 C8 C7 104.4(6) . . ?
O2 C8 H8A 110.9 . . ?
C7 C8 H8A 110.9 . . ?
O2 C8 H8B 110.9 . . ?
C7 C8 H8B 110.9 . . ?
H8A C8 H8B 108.9 . . ?
N2 C9 O2 116.8(5) . . ?
N2 C9 C10 127.5(6) . . ?
O2 C9 C10 115.6(5) . . ?
C15 C10 C11 117.6(5) . . ?
C15 C10 C9 121.6(5) . . ?
C11 C10 C9 120.8(5) . . ?
C12 C11 C10 121.4(6) . . ?
C12 C11 H11 119.3 . . ?
C10 C11 H11 119.3 . . ?
C11 C12 C13 121.6(6) . . ?
C11 C12 H12 119.2 . . ?
C13 C12 H12 119.2 . . ?
C14 C13 C12 117.1(5) . . ?
C14 C13 C16 120.5(5) . . ?
C12 C13 C16 122.3(5) . . ?
C13 C14 C15 120.6(6) . . ?
C13 C14 H14 119.7 . . ?
C15 C14 H14 119.7 . . ?
C10 C15 C14 121.5(6) . . ?
C10 C15 H15 119.2 . . ?
C14 C15 H15 119.2 . . ?
C21 C16 C17 118.1(5) . . ?
C21 C16 C13 121.2(5) . . ?
C17 C16 C13 120.7(5) . . ?
C18 C17 C16 121.3(6) . . ?
C18 C17 H17 119.4 . . ?
C16 C17 H17 119.4 . . ?
C17 C18 C19 120.4(5) . . ?
C17 C18 H18 119.8 . . ?
C19 C18 H18 119.8 . . ?
C20 C19 C18 118.5(5) . . ?
C20 C19 C22 122.1(5) . . ?
C18 C19 C22 119.4(5) . . ?
C21 C20 C19 120.7(5) . . ?
C21 C20 H20 119.7 . . ?
C19 C20 H20 119.7 . . ?
C20 C21 C16 121.1(5) . . ?
C20 C21 H21 119.5 . . ?
C16 C21 H21 119.5 . . ?
N3 C22 O3 117.0(5) . . ?
N3 C22 C19 127.8(6) . . ?
O3 C22 C19 115.2(5) . . ?
O3 C23 C24 103.8(5) . . ?
O3 C23 H23A 111.0 . . ?
C24 C23 H23A 111.0 . . ?
O3 C23 H23B 111.0 . . ?
C24 C23 H23B 111.0 . . ?
H23A C23 H23B 109.0 . . ?
N3 C24 C23 104.5(5) . . ?
N3 C24 H24A 110.9 . . ?
C23 C24 H24A 110.9 . . ?
N3 C24 H24B 110.9 . . ?
C23 C24 H24B 110.9 . . ?
H24A C24 H24B 108.9 . . ?
N4 C25 C26 104.9(6) . . ?
N4 C25 H25A 110.8 . . ?
C26 C25 H25A 110.8 . . ?
N4 C25 H25B 110.8 . . ?
C26 C25 H25B 110.8 . . ?
H25A C25 H25B 108.8 . . ?
O4 C26 C25 104.2(6) . . ?
O4 C26 H26A 110.9 . . ?
C25 C26 H26A 110.9 . . ?
O4 C26 H26B 110.9 . . ?
C25 C26 H26B 110.9 . . ?
H26A C26 H26B 108.9 . . ?
N4 C27 O4 117.2(6) . . ?
N4 C27 C28 127.2(6) . . ?
O4 C27 C28 115.5(5) . . ?
C33 C28 C29 118.7(6) . . ?
C33 C28 C27 118.6(6) . . ?
C29 C28 C27 122.7(6) . . ?
C28 C29 C30 120.5(6) . . ?
C28 C29 H29 119.8 . . ?
C30 C29 H29 119.8 . . ?
C31 C30 C29 123.1(6) . . ?
C31 C30 H30 118.5 . . ?
C29 C30 H30 118.5 . . ?
C30 C31 C32 116.0(6) . . ?
C30 C31 C34 123.9(6) . . ?
C32 C31 C34 120.1(6) . . ?
C31 C32 C33 121.4(7) . . ?
C31 C32 H32 119.3 . . ?
C33 C32 H32 119.3 . . ?
C28 C33 C32 120.3(7) . . ?
C28 C33 H33 119.9 . . ?
C32 C33 H33 119.9 . . ?
C35 C34 C36 115.5(6) . . ?
C35 C34 C31 122.3(6) . . ?
C36 C34 C31 122.2(6) . . ?
C1 C35 C34 121.9(6) . . ?
C1 C35 H35 119.1 . . ?
C34 C35 H35 119.1 . . ?
C3 C36 C34 122.5(7) . . ?
C3 C36 H36 118.7 . . ?
C34 C36 H36 118.7 . . ?
F1 C37 F3' 114.0(11) . . ?
F1 C37 F2 110.3(9) . . ?
F3' C37 F2 44.8(8) . . ?
F1 C37 F3 102.5(9) . . ?
F3' C37 F3 49.5(9) . . ?
F2 C37 F3 94.3(7) . . ?
F1 C37 F2' 38.5(6) . . ?
F3' C37 F2' 114.1(11) . . ?
F2 C37 F2' 84.4(8) . . ?
F3 C37 F2' 134.1(9) . . ?
F1 C37 F1' 51.7(15) . . ?
F3' C37 F1' 103.0(16) . . ?
F2 C37 F1' 138.4(12) . . ?
F3 C37 F1' 61.3(15) . . ?
F2' C37 F1' 90.0(16) . . ?
F1 C37 C39 122.4(7) . . ?
F3' C37 C39 123.5(10) . . ?
F2 C37 C39 112.1(7) . . ?
F3 C37 C39 111.2(7) . . ?
F2' C37 C39 111.6(8) . . ?
F1' C37 C39 108.4(11) . . ?
F6 C38 F5' 107.1(14) . . ?
F6 C38 F4' 56.7(10) . . ?
F5' C38 F4' 106.6(14) . . ?
F6 C38 F5 109.4(12) . . ?
F5' C38 F5 59.0(10) . . ?
F4' C38 F5 63.2(10) . . ?
F6 C38 F4 100.4(11) . . ?
F5' C38 F4 35.2(8) . . ?
F4' C38 F4 132.4(13) . . ?
F5 C38 F4 94.0(10) . . ?
F6 C38 C40 124.2(12) . . ?
F5' C38 C40 126.2(14) . . ?
F4' C38 C40 113.9(12) . . ?
F5 C38 C40 111.1(11) . . ?
F4 C38 C40 113.2(10) . . ?
F6 C38 F6' 34.4(7) . . ?
F5' C38 F6' 109.4(13) . . ?
F4' C38 F6' 89.7(13) . . ?
F5 C38 F6' 141.4(13) . . ?
F4 C38 F6' 84.5(10) . . ?
C40 C38 F6' 104.8(10) . . ?
O5 C39 O6 128.5(7) . . ?
O5 C39 C37 116.7(6) . . ?
O6 C39 C37 114.8(6) . . ?
O8 C40 O7 127.6(8) . . ?
O8 C40 C38 116.5(8) . . ?
O7 C40 C38 115.7(9) . . ?
C4 N1 C6 107.4(6) . . ?
C4 N1 Ag2 132.2(4) . 1_456 ?
C6 N1 Ag2 118.2(4) . 1_456 ?
C9 N2 C7 108.4(5) . . ?
C9 N2 Ag2 133.5(4) . . ?
C7 N2 Ag2 118.1(4) . . ?
C22 N3 C24 107.5(5) . . ?
C22 N3 Ag1 136.5(4) . . ?
C24 N3 Ag1 115.1(4) . . ?
C27 N4 C25 107.0(6) . . ?
C27 N4 Ag1 136.3(4) . . ?
C25 N4 Ag1 116.6(4) . . ?
C4 O1 C5 105.6(5) . . ?
C9 O2 C8 106.8(5) . . ?
C22 O3 C23 106.8(5) . . ?
C27 O4 C26 105.8(5) . . ?
C39 O6 Ag2 96.3(4) . . ?
C40 O8 Ag1 93.0(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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C35 C1 C2 C3 -1.0(12) . . . . ?
C35 C1 C2 C4 -179.1(7) . . . . ?
C1 C2 C3 C36 -1.0(13) . . . . ?
C4 C2 C3 C36 177.2(8) . . . . ?
C1 C2 C4 N1 18.9(11) . . . . ?
C3 C2 C4 N1 -159.2(8) . . . . ?
C1 C2 C4 O1 -161.0(7) . . . . ?
C3 C2 C4 O1 20.9(9) . . . . ?
O1 C5 C6 N1 -6.7(8) . . . . ?
N2 C7 C8 O2 -1.0(8) . . . . ?
N2 C9 C10 C15 -7.7(10) . . . . ?
O2 C9 C10 C15 172.0(6) . . . . ?
N2 C9 C10 C11 171.8(7) . . . . ?
O2 C9 C10 C11 -8.4(9) . . . . ?
C15 C10 C11 C12 -0.7(12) . . . . ?
C9 C10 C11 C12 179.7(7) . . . . ?
C10 C11 C12 C13 0.9(13) . . . . ?
C11 C12 C13 C14 0.9(11) . . . . ?
C11 C12 C13 C16 -177.7(7) . . . . ?
C12 C13 C14 C15 -2.8(10) . . . . ?
C16 C13 C14 C15 175.9(6) . . . . ?
C11 C10 C15 C14 -1.2(11) . . . . ?
C9 C10 C15 C14 178.4(6) . . . . ?
C13 C14 C15 C10 3.0(11) . . . . ?
C14 C13 C16 C21 29.2(8) . . . . ?
C12 C13 C16 C21 -152.2(6) . . . . ?
C14 C13 C16 C17 -148.9(6) . . . . ?
C12 C13 C16 C17 29.7(9) . . . . ?
C21 C16 C17 C18 -1.1(9) . . . . ?
C13 C16 C17 C18 177.1(5) . . . . ?
C16 C17 C18 C19 0.8(9) . . . . ?
C17 C18 C19 C20 0.1(9) . . . . ?
C17 C18 C19 C22 -179.7(6) . . . . ?
C18 C19 C20 C21 -0.7(9) . . . . ?
C22 C19 C20 C21 179.1(5) . . . . ?
C19 C20 C21 C16 0.3(9) . . . . ?
C17 C16 C21 C20 0.5(9) . . . . ?
C13 C16 C21 C20 -177.7(5) . . . . ?
C20 C19 C22 N3 -1.0(9) . . . . ?
C18 C19 C22 N3 178.8(6) . . . . ?
C20 C19 C22 O3 -178.4(5) . . . . ?
C18 C19 C22 O3 1.4(8) . . . . ?
O3 C23 C24 N3 5.3(7) . . . . ?
N4 C25 C26 O4 9.3(9) . . . . ?
N4 C27 C28 C33 160.7(8) . . . . ?
O4 C27 C28 C33 -17.1(9) . . . . ?
N4 C27 C28 C29 -20.0(11) . . . . ?
O4 C27 C28 C29 162.2(6) . . . . ?
C33 C28 C29 C30 -2.3(11) . . . . ?
C27 C28 C29 C30 178.5(7) . . . . ?
C28 C29 C30 C31 0.4(12) . . . . ?
C29 C30 C31 C32 1.4(11) . . . . ?
C29 C30 C31 C34 -179.8(7) . . . . ?
C30 C31 C32 C33 -1.3(13) . . . . ?
C34 C31 C32 C33 179.8(8) . . . . ?
C29 C28 C33 C32 2.3(13) . . . . ?
C27 C28 C33 C32 -178.4(8) . . . . ?
C31 C32 C33 C28 -0.5(15) . . . . ?
C30 C31 C34 C35 14.4(10) . . . . ?
C32 C31 C34 C35 -166.8(8) . . . . ?
C30 C31 C34 C36 -167.2(8) . . . . ?
C32 C31 C34 C36 11.6(11) . . . . ?
C2 C1 C35 C34 1.9(12) . . . . ?
C36 C34 C35 C1 -0.7(11) . . . . ?
C31 C34 C35 C1 177.8(7) . . . . ?
C2 C3 C36 C34 2.2(15) . . . . ?
C35 C34 C36 C3 -1.3(13) . . . . ?
C31 C34 C36 C3 -179.8(8) . . . . ?
F1 C37 C39 O5 2.2(14) . . . . ?
F3' C37 C39 O5 178.2(13) . . . . ?
F2 C37 C39 O5 -132.3(8) . . . . ?
F3 C37 C39 O5 123.5(8) . . . . ?
F2' C37 C39 O5 -39.7(12) . . . . ?
F1' C37 C39 O5 57.9(19) . . . . ?
F1 C37 C39 O6 -177.2(10) . . . . ?
F3' C37 C39 O6 -1.2(16) . . . . ?
F2 C37 C39 O6 48.3(11) . . . . ?
F3 C37 C39 O6 -55.9(10) . . . . ?
F2' C37 C39 O6 140.9(9) . . . . ?
F1' C37 C39 O6 -121.5(18) . . . . ?
F6 C38 C40 O8 -18.3(17) . . . . ?
F5' C38 C40 O8 -178.1(14) . . . . ?
F4' C38 C40 O8 46.6(16) . . . . ?
F5 C38 C40 O8 115.5(11) . . . . ?
F4 C38 C40 O8 -140.2(10) . . . . ?
F6' C38 C40 O8 -49.8(12) . . . . ?
F6 C38 C40 O7 167.5(12) . . . . ?
F5' C38 C40 O7 7.7(19) . . . . ?
F4' C38 C40 O7 -127.7(13) . . . . ?
F5 C38 C40 O7 -58.7(13) . . . . ?
F4 C38 C40 O7 45.6(14) . . . . ?
F6' C38 C40 O7 136.0(11) . . . . ?
O1 C4 N1 C6 -2.2(9) . . . . ?
C2 C4 N1 C6 177.9(7) . . . . ?
O1 C4 N1 Ag2 -164.3(5) . . . 1_456 ?
C2 C4 N1 Ag2 15.7(11) . . . 1_456 ?
C5 C6 N1 C4 5.5(9) . . . . ?
C5 C6 N1 Ag2 170.6(5) . . . 1_456 ?
O2 C9 N2 C7 -0.5(8) . . . . ?
C10 C9 N2 C7 179.2(6) . . . . ?
O2 C9 N2 Ag2 175.9(5) . . . . ?
C10 C9 N2 Ag2 -4.4(10) . . . . ?
C8 C7 N2 C9 1.0(8) . . . . ?
C8 C7 N2 Ag2 -176.1(5) . . . . ?
N1 Ag2 N2 C9 -80.6(7) 1_654 . . . ?
O6 Ag2 N2 C9 117.8(6) . . . . ?
N1 Ag2 N2 C7 95.5(5) 1_654 . . . ?
O6 Ag2 N2 C7 -66.1(5) . . . . ?
O3 C22 N3 C24 -1.6(7) . . . . ?
C19 C22 N3 C24 -178.9(6) . . . . ?
O3 C22 N3 Ag1 -170.3(4) . . . . ?
C19 C22 N3 Ag1 12.3(10) . . . . ?
C23 C24 N3 C22 -2.6(7) . . . . ?
C23 C24 N3 Ag1 168.8(4) . . . . ?
N4 Ag1 N3 C22 -97.1(7) . . . . ?
O8 Ag1 N3 C22 61.6(6) . . . . ?
N4 Ag1 N3 C24 94.7(6) . . . . ?
O8 Ag1 N3 C24 -106.5(5) . . . . ?
O4 C27 N4 C25 2.0(8) . . . . ?
C28 C27 N4 C25 -175.7(7) . . . . ?
O4 C27 N4 Ag1 -174.1(5) . . . . ?
C28 C27 N4 Ag1 8.1(11) . . . . ?
C26 C25 N4 C27 -7.3(9) . . . . ?
C26 C25 N4 Ag1 169.8(5) . . . . ?
N3 Ag1 N4 C27 -102.8(7) . . . . ?
O8 Ag1 N4 C27 100.4(7) . . . . ?
N3 Ag1 N4 C25 81.3(7) . . . . ?
O8 Ag1 N4 C25 -75.5(5) . . . . ?
N1 C4 O1 C5 -2.4(9) . . . . ?
C2 C4 O1 C5 177.5(6) . . . . ?
C6 C5 O1 C4 5.6(8) . . . . ?
N2 C9 O2 C8 -0.2(9) . . . . ?
C10 C9 O2 C8 -179.9(6) . . . . ?
C7 C8 O2 C9 0.8(9) . . . . ?
N3 C22 O3 C23 5.2(7) . . . . ?
C19 C22 O3 C23 -177.1(5) . . . . ?
C24 C23 O3 C22 -6.2(7) . . . . ?
N4 C27 O4 C26 4.2(8) . . . . ?
C28 C27 O4 C26 -177.8(6) . . . . ?
C25 C26 O4 C27 -8.3(9) . . . . ?
O5 C39 O6 Ag2 -1.5(10) . . . . ?
C37 C39 O6 Ag2 177.8(6) . . . . ?
N2 Ag2 O6 C39 -104.5(5) . . . . ?
N1 Ag2 O6 C39 85.2(5) 1_654 . . . ?
O7 C40 O8 Ag1 28.4(10) . . . . ?
C38 C40 O8 Ag1 -145.0(8) . . . . ?
N4 Ag1 O8 C40 -119.5(5) . . . . ?
N3 Ag1 O8 C40 70.6(5) . . . . ?

_diffrn_measured_fraction_theta_max 0.995
_diffrn_reflns_theta_full        25.50
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         1.117
_refine_diff_density_min         -1.745
_refine_diff_density_rms         0.124
_database_code_depnum_ccdc_archive 'CCDC 962763'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_962764

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C11 H8 Ag F3 N O3'
_chemical_formula_weight         367.05

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'

_symmetry_cell_setting           Triclinic
_symmetry_space_group_name_H-M   P-1
_symmetry_space_group_name_Hall  '-P 1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   5.5736(17)
_cell_length_b                   9.681(3)
_cell_length_c                   10.993(4)
_cell_angle_alpha                82.393(5)
_cell_angle_beta                 81.503(5)
_cell_angle_gamma                84.252(5)
_cell_volume                     579.5(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    2872
_cell_measurement_theta_min      2.7
_cell_measurement_theta_max      28.1

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.13
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.103
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             358
_exptl_absorpt_coefficient_mu    1.782
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7283
_exptl_absorpt_correction_T_max  0.8014
_exptl_absorpt_process_details   sadabs

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            2890
_diffrn_reflns_av_R_equivalents  0.0903
_diffrn_reflns_av_unetI/netI     0.0568
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_theta_min         2.67
_diffrn_reflns_theta_max         25.01
_reflns_number_total             2006
_reflns_number_gt                1969
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker SMART'
_computing_cell_refinement       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F^2^ against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F^2^, conventional R-factors R are based 
 on F, with F set to zero for negative F^2^. The threshold expression of 
 F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F^2^ are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.0459P)^2^+1.2073P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         2006
_refine_ls_number_parameters     184
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0430
_refine_ls_R_factor_gt           0.0424
_refine_ls_wR_factor_ref         0.1063
_refine_ls_wR_factor_gt          0.1058
_refine_ls_goodness_of_fit_ref   1.104
_refine_ls_restrained_S_all      1.104
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
Ag1 Ag 0.30008(6) 0.39422(4) 0.53559(3) 0.04813(18) Uani 1 1 d . . .
C1 C 0.5359(10) 0.1212(6) 0.6895(5) 0.0536(13) Uani 1 1 d . A .
H1A H 0.6915 0.1611 0.6665 0.064 Uiso 1 1 calc R . .
H1B H 0.5147 0.0620 0.6279 0.064 Uiso 1 1 calc R . .
C2 C 0.5214(12) 0.0387(7) 0.8177(5) 0.0644(16) Uani 1 1 d . A .
H2A H 0.5027 -0.0591 0.8140 0.077 Uiso 1 1 calc R . .
H2B H 0.6657 0.0459 0.8554 0.077 Uiso 1 1 calc R . .
C3 C 0.2241(10) 0.2138(5) 0.8087(5) 0.0473(11) Uani 1 1 d . A .
C4 C 0.0090(10) 0.2958(6) 0.8634(5) 0.0496(12) Uani 1 1 d . . .
C5 C -0.092(3) 0.2642(14) 0.9893(13) 0.061(3) Uani 0.60 1 d P A 1
H5A H -0.0271 0.1867 1.0367 0.073 Uiso 0.60 1 calc PR A 1
C6 C -0.284(2) 0.3456(12) 1.0419(8) 0.073(3) Uani 0.70 1 d P A 1
H6A H -0.3409 0.3264 1.1258 0.088 Uiso 0.70 1 calc PR A 1
C7 C -0.3956(11) 0.4566(6) 0.9715(5) 0.0529(13) Uani 1 1 d . . .
C8 C -0.3329(9) 0.4642(6) 0.8451(4) 0.0475(11) Uani 1 1 d . A .
H8 H -0.4279 0.5236 0.7942 0.057 Uiso 1 1 calc R . .
C9 C -0.1340(9) 0.3866(6) 0.7913(4) 0.0475(11) Uani 1 1 d . A .
H9 H -0.0959 0.3957 0.7055 0.057 Uiso 1 1 calc R . .
C10 C 0.8051(9) 0.3021(5) 0.4060(4) 0.0425(11) Uani 1 1 d . A .
C11 C 0.9894(10) 0.1867(6) 0.3582(5) 0.0502(12) Uani 1 1 d . . .
C5' C -0.005(3) 0.315(2) 0.9890(17) 0.050(4) Uani 0.40 1 d P A 2
H5'A H 0.1110 0.2695 1.0365 0.060 Uiso 0.40 1 calc PR A 2
C6' C -0.186(3) 0.3993(19) 1.0390(17) 0.040 Uani 0.30 1 d P A 2
H6'A H -0.1826 0.4230 1.1179 0.048 Uiso 0.30 1 calc PR A 2
F1 F 0.8929(9) 0.0859(5) 0.3195(6) 0.0998(16) Uani 1 1 d . . .
F2 F 1.1440(8) 0.2389(5) 0.2630(4) 0.0831(11) Uani 1 1 d . . .
F3 F 1.1283(8) 0.1291(4) 0.4424(4) 0.0780(11) Uani 1 1 d . . .
N1 N 0.3359(8) 0.2319(4) 0.7002(4) 0.0443(9) Uani 1 1 d . . .
O1 O 0.3071(9) 0.1047(5) 0.8858(4) 0.0721(13) Uani 1 1 d . . .
O2 O 0.5962(7) 0.3024(5) 0.3841(4) 0.0632(11) Uani 1 1 d . . .
O3 O 0.8911(6) 0.3835(4) 0.4630(3) 0.0496(8) Uani 1 1 d . . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.0396(2) 0.0483(3) 0.0523(3) -0.00191(17) -0.00508(17) 0.00959(17)
C1 0.049(3) 0.055(3) 0.052(3) -0.006(2) -0.001(2) 0.014(2)
C2 0.065(4) 0.060(4) 0.056(3) 0.003(3) 0.001(3) 0.025(3)
C3 0.052(3) 0.044(3) 0.042(3) -0.001(2) -0.009(2) 0.011(2)
C4 0.057(3) 0.051(3) 0.037(2) -0.005(2) -0.004(2) 0.014(2)
C5 0.073(10) 0.054(8) 0.041(5) 0.011(5) 0.000(6) 0.025(6)
C6 0.089(7) 0.078(7) 0.033(4) 0.006(4) 0.009(4) 0.040(5)
C7 0.065(3) 0.052(3) 0.035(2) -0.002(2) -0.002(2) 0.020(3)
C8 0.044(3) 0.057(3) 0.037(2) -0.001(2) -0.006(2) 0.011(2)
C9 0.046(3) 0.057(3) 0.035(2) 0.000(2) -0.001(2) 0.006(2)
C10 0.040(3) 0.054(3) 0.032(2) 0.0007(19) -0.0073(19) 0.001(2)
C11 0.044(3) 0.051(3) 0.056(3) -0.012(2) -0.006(2) 0.002(2)
C5' 0.044(10) 0.071(14) 0.032(7) -0.005(8) -0.010(7) 0.014(7)
C6' 0.037 0.045 0.037 -0.003 -0.007 0.002
F1 0.083(3) 0.074(3) 0.159(5) -0.061(3) -0.029(3) -0.003(2)
F2 0.077(2) 0.084(3) 0.075(2) -0.014(2) 0.026(2) 0.010(2)
F3 0.081(2) 0.060(2) 0.091(3) -0.0087(19) -0.029(2) 0.0301(19)
N1 0.044(2) 0.044(2) 0.040(2) -0.0020(16) -0.0049(17) 0.0110(17)
O1 0.083(3) 0.069(3) 0.047(2) 0.0091(18) 0.002(2) 0.038(2)
O2 0.038(2) 0.097(3) 0.057(2) -0.024(2) -0.0109(17) 0.007(2)
O3 0.0460(19) 0.0430(19) 0.061(2) -0.0115(16) -0.0161(17) 0.0103(15)

_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Ag1 N1 2.252(4) . ?
Ag1 O3 2.305(4) 2_666 ?
Ag1 O2 2.361(4) . ?
Ag1 O3 2.540(3) 1_455 ?
Ag1 Ag1 3.1222(10) 2_666 ?
C1 N1 1.469(7) . ?
C1 C2 1.521(8) . ?
C1 H1A 0.9700 . ?
C1 H1B 0.9700 . ?
C2 O1 1.451(7) . ?
C2 H2A 0.9700 . ?
C2 H2B 0.9700 . ?
C3 N1 1.261(7) . ?
C3 O1 1.353(6) . ?
C3 C4 1.467(7) . ?
C4 C9 1.378(7) . ?
C4 C5' 1.407(19) . ?
C4 C5 1.421(15) . ?
C5 C6 1.367(17) . ?
C5 H5A 0.9300 . ?
C6 C7 1.388(10) . ?
C6 H6A 0.9300 . ?
C7 C8 1.376(7) . ?
C7 C7 1.476(11) 2_467 ?
C7 C6' 1.495(18) . ?
C8 C9 1.378(7) . ?
C8 H8 0.9300 . ?
C9 H9 0.9300 . ?
C10 O2 1.223(6) . ?
C10 O3 1.241(6) . ?
C10 C11 1.531(8) . ?
C11 F1 1.306(7) . ?
C11 F3 1.325(7) . ?
C11 F2 1.332(7) . ?
C5' C6' 1.33(3) . ?
C5' H5'A 0.9300 . ?
C6' H6'A 0.9300 . ?
O3 Ag1 2.305(4) 2_666 ?
O3 Ag1 2.540(3) 1_655 ?

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
N1 Ag1 O3 127.06(14) . 2_666 ?
N1 Ag1 O2 101.27(16) . . ?
O3 Ag1 O2 129.43(16) 2_666 . ?
N1 Ag1 O3 109.08(14) . 1_455 ?
O3 Ag1 O3 74.08(13) 2_666 1_455 ?
O2 Ag1 O3 106.19(13) . 1_455 ?
N1 Ag1 Ag1 117.74(11) . 2_666 ?
O3 Ag1 Ag1 72.26(10) 2_666 2_666 ?
O2 Ag1 Ag1 72.61(12) . 2_666 ?
O3 Ag1 Ag1 132.57(9) 1_455 2_666 ?
N1 C1 C2 104.7(4) . . ?
N1 C1 H1A 110.8 . . ?
C2 C1 H1A 110.8 . . ?
N1 C1 H1B 110.8 . . ?
C2 C1 H1B 110.8 . . ?
H1A C1 H1B 108.9 . . ?
O1 C2 C1 103.5(4) . . ?
O1 C2 H2A 111.1 . . ?
C1 C2 H2A 111.1 . . ?
O1 C2 H2B 111.1 . . ?
C1 C2 H2B 111.1 . . ?
H2A C2 H2B 109.0 . . ?
N1 C3 O1 117.3(5) . . ?
N1 C3 C4 128.1(5) . . ?
O1 C3 C4 114.5(4) . . ?
C9 C4 C5' 117.8(9) . . ?
C9 C4 C5 115.6(7) . . ?
C5' C4 C5 29.8(7) . . ?
C9 C4 C3 121.8(4) . . ?
C5' C4 C3 117.4(9) . . ?
C5 C4 C3 121.3(7) . . ?
C6 C5 C4 121.2(10) . . ?
C6 C5 H5A 119.4 . . ?
C4 C5 H5A 119.4 . . ?
C5 C6 C7 120.8(8) . . ?
C5 C6 H6A 119.6 . . ?
C7 C6 H6A 119.6 . . ?
C8 C7 C6 116.5(6) . . ?
C8 C7 C7 121.8(6) . 2_467 ?
C6 C7 C7 120.5(6) . 2_467 ?
C8 C7 C6' 111.9(9) . . ?
C6 C7 C6' 31.3(7) . . ?
C7 C7 C6' 122.3(9) 2_467 . ?
C7 C8 C9 122.2(5) . . ?
C7 C8 H8 118.9 . . ?
C9 C8 H8 118.9 . . ?
C4 C9 C8 120.6(5) . . ?
C4 C9 H9 119.7 . . ?
C8 C9 H9 119.7 . . ?
O2 C10 O3 128.7(5) . . ?
O2 C10 C11 117.1(5) . . ?
O3 C10 C11 114.2(4) . . ?
F1 C11 F3 107.6(5) . . ?
F1 C11 F2 106.3(5) . . ?
F3 C11 F2 104.9(5) . . ?
F1 C11 C10 114.5(5) . . ?
F3 C11 C10 112.3(4) . . ?
F2 C11 C10 110.6(5) . . ?
C6' C5' C4 119.1(16) . . ?
C6' C5' H5'A 120.5 . . ?
C4 C5' H5'A 120.5 . . ?
C5' C6' C7 121.7(15) . . ?
C5' C6' H6'A 119.1 . . ?
C7 C6' H6'A 119.1 . . ?
C3 N1 C1 107.6(4) . . ?
C3 N1 Ag1 134.3(3) . . ?
C1 N1 Ag1 118.1(3) . . ?
C3 O1 C2 106.8(4) . . ?
C10 O2 Ag1 113.8(3) . . ?
C10 O3 Ag1 116.9(3) . 2_666 ?
C10 O3 Ag1 134.8(3) . 1_655 ?
Ag1 O3 Ag1 105.92(13) 2_666 1_655 ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C1 C2 O1 3.4(7) . . . . ?
N1 C3 C4 C9 15.6(9) . . . . ?
O1 C3 C4 C9 -163.4(6) . . . . ?
N1 C3 C4 C5' -144.2(11) . . . . ?
O1 C3 C4 C5' 36.8(12) . . . . ?
N1 C3 C4 C5 -178.2(9) . . . . ?
O1 C3 C4 C5 2.8(11) . . . . ?
C9 C4 C5 C6 -16.7(18) . . . . ?
C5' C4 C5 C6 85(3) . . . . ?
C3 C4 C5 C6 176.2(11) . . . . ?
C4 C5 C6 C7 4(2) . . . . ?
C5 C6 C7 C8 11.2(17) . . . . ?
C5 C6 C7 C7 179.4(12) . . . 2_467 ?
C5 C6 C7 C6' -78(2) . . . . ?
C6 C7 C8 C9 -14.0(11) . . . . ?
C7 C7 C8 C9 178.0(7) 2_467 . . . ?
C6' C7 C8 C9 20.1(11) . . . . ?
C5' C4 C9 C8 -19.2(12) . . . . ?
C5 C4 C9 C8 14.1(11) . . . . ?
C3 C4 C9 C8 -178.9(5) . . . . ?
C7 C8 C9 C4 1.0(9) . . . . ?
O2 C10 C11 F1 -12.3(8) . . . . ?
O3 C10 C11 F1 167.5(5) . . . . ?
O2 C10 C11 F3 -135.3(5) . . . . ?
O3 C10 C11 F3 44.4(6) . . . . ?
O2 C10 C11 F2 107.8(6) . . . . ?
O3 C10 C11 F2 -72.5(6) . . . . ?
C9 C4 C5' C6' 13(2) . . . . ?
C5 C4 C5' C6' -80(3) . . . . ?
C3 C4 C5' C6' 174.0(14) . . . . ?
C4 C5' C6' C7 9(3) . . . . ?
C8 C7 C6' C5' -26(2) . . . . ?
C6 C7 C6' C5' 80(2) . . . . ?
C7 C7 C6' C5' 176.4(15) 2_467 . . . ?
O1 C3 N1 C1 0.1(7) . . . . ?
C4 C3 N1 C1 -178.9(5) . . . . ?
O1 C3 N1 Ag1 -176.9(4) . . . . ?
C4 C3 N1 Ag1 4.1(9) . . . . ?
C2 C1 N1 C3 -2.3(6) . . . . ?
C2 C1 N1 Ag1 175.2(4) . . . . ?
O3 Ag1 N1 C3 19.8(6) 2_666 . . . ?
O2 Ag1 N1 C3 -176.0(5) . . . . ?
O3 Ag1 N1 C3 -64.3(5) 1_455 . . . ?
Ag1 Ag1 N1 C3 107.8(5) 2_666 . . . ?
O3 Ag1 N1 C1 -157.0(3) 2_666 . . . ?
O2 Ag1 N1 C1 7.2(4) . . . . ?
O3 Ag1 N1 C1 118.9(4) 1_455 . . . ?
Ag1 Ag1 N1 C1 -68.9(4) 2_666 . . . ?
N1 C3 O1 C2 2.3(7) . . . . ?
C4 C3 O1 C2 -178.6(5) . . . . ?
C1 C2 O1 C3 -3.4(7) . . . . ?
O3 C10 O2 Ag1 -29.8(7) . . . . ?
C11 C10 O2 Ag1 150.0(4) . . . . ?
N1 Ag1 O2 C10 -66.8(4) . . . . ?
O3 Ag1 O2 C10 96.9(4) 2_666 . . . ?
O3 Ag1 O2 C10 179.3(4) 1_455 . . . ?
Ag1 Ag1 O2 C10 49.0(4) 2_666 . . . ?
O2 C10 O3 Ag1 -26.3(7) . . . 2_666 ?
C11 C10 O3 Ag1 153.9(3) . . . 2_666 ?
O2 C10 O3 Ag1 173.9(4) . . . 1_655 ?
C11 C10 O3 Ag1 -5.8(7) . . . 1_655 ?

_diffrn_measured_fraction_theta_max 0.980
_diffrn_reflns_theta_full        25.01
_diffrn_measured_fraction_theta_full 0.980
_refine_diff_density_max         0.670
_refine_diff_density_min         -1.158
_refine_diff_density_rms         0.121
_database_code_depnum_ccdc_archive 'CCDC 962764'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_962765
_audit_creation_date             2013-10-16
_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
;
[Ag(OX12)2](OCOCF3)2-2(H2O)
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C38 H36 Ag F3 N4 O8'
_chemical_formula_sum            'C38 H36 Ag F3 N4 O8'
_chemical_formula_weight         841.58

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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

loop_
_space_group_symop_operation_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'

_cell_length_a                   18.055(9)
_cell_length_b                   13.972(8)
_cell_length_c                   14.544(9)
_cell_angle_alpha                90
_cell_angle_beta                 106.986(18)
_cell_angle_gamma                90
_cell_volume                     3509(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    200
_cell_measurement_reflns_used    1297
_cell_measurement_theta_min      3.1
_cell_measurement_theta_max      27.5

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.593
_exptl_crystal_F_000             1720
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.250
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.150
_exptl_absorpt_coefficient_mu    0.651
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8541
_exptl_absorpt_correction_T_max  0.9086
_exptl_absorpt_process_details   
;
    Higashi, T. (1995). Program for Absorption Correction.
    Rigaku Corporation, Tokyo, Japan.
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      200
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_source                   
;
 MicroMax-007HF microfocus rotating anode X-ray generator
;
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID II'
_diffrn_measurement_method       \w
_diffrn_detector_area_resol_mean 10.00
_diffrn_reflns_number            16410
_diffrn_reflns_av_unetI/netI     0.0350
_diffrn_reflns_av_R_equivalents  0.0443
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_theta_min         3.175
_diffrn_reflns_theta_max         27.485
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             4013
_reflns_number_gt                3456
_reflns_threshold_expression     'I > 2\s(I)'
_reflns_Friedel_coverage         0.000
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 The following restraints were gererated by SHELX SADI, ISOR, and ISOR;
 equal distances, C1 F1, C1 F2, C1 F3, C1 F1B, C1 F2B, C1 F3B;
 U_iso F1 F2 F3 F1B F2B F3B;
 U_similar F3 F3B.
;

_computing_data_collection       PROCESS-AUTO
_computing_cell_refinement       PROCESS-AUTO
_computing_data_reduction        'CrystalStructure 3.8'
_computing_structure_solution    'SIR92 (Altomare et al., 1994)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'ORTEP-3 for Windows version 2.02'
_computing_publication_material  'WinGX-Version 2013.3'

_refine_special_details          
;
 ?
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[\s^2^(Fo^2^)+(0.0814P)^2^+2.8709P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4013
_refine_ls_number_parameters     313
_refine_ls_number_restraints     57
_refine_ls_R_factor_all          0.0563
_refine_ls_R_factor_gt           0.0497
_refine_ls_wR_factor_ref         0.1381
_refine_ls_wR_factor_gt          0.1327
_refine_ls_goodness_of_fit_ref   1.081
_refine_ls_restrained_S_all      1.083
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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 0.0000 0.49401(2) 0.7500 0.04150(14) Uani 1 2 d S T P . .
F1 F 0.4621(6) 0.5396(12) 0.3309(7) 0.123(5) Uani 0.344(9) 1 d D U P A 1
F2 F 0.5618(15) 0.4348(11) 0.3726(15) 0.137(6) Uani 0.344(9) 1 d D U P A 1
F3 F 0.5730(7) 0.5871(9) 0.4027(10) 0.110(4) Uani 0.344(9) 1 d D U P A 1
F1B F 0.498(2) 0.438(2) 0.3359(17) 0.115(10) Uani 0.156(9) 1 d D U P A 2
F2B F 0.5971(13) 0.460(2) 0.414(2) 0.113(10) Uani 0.156(9) 1 d D U P A 2
F3B F 0.538(3) 0.586(2) 0.347(3) 0.138(12) Uani 0.156(9) 1 d D U P A 2
O1 O 0.14460(14) 0.65034(16) 0.59279(18) 0.0541(6) Uani 1 1 d . . . . .
O2 O 0.27604(12) -0.15806(15) 0.60617(16) 0.0471(5) Uani 1 1 d . . . . .
O3 O 0.4908(6) 0.5811(7) 0.5249(6) 0.080(2) Uani 0.5 1 d . . P . .
O4 O 0.5111(7) 0.4220(8) 0.5270(6) 0.088(3) Uani 0.5 1 d . . P . .
O5 O 0.4357(4) 0.3844(6) 0.6650(10) 0.095(3) Uani 0.5 1 d . . P . .
O6 O 0.4280(6) 0.5828(6) 0.6786(7) 0.105(3) Uani 0.5 1 d . . P . .
N2 N 0.39828(13) -0.10444(17) 0.66252(17) 0.0398(5) Uani 1 1 d . . . . .
N1 N 0.04926(14) 0.59810(17) 0.65152(17) 0.0407(5) Uani 1 1 d . . . . .
C1 C 0.5279(6) 0.5102(6) 0.4012(10) 0.083(3) Uani 0.5 1 d D . P . .
C2 C 0.510(2) 0.506(5) 0.499(5) 0.067(6) Uani 0.5 1 d . . P A .
C11 C 0.19634(17) 0.2949(2) 0.6167(2) 0.0410(6) Uani 1 1 d . . . . .
C12 C 0.11668(17) 0.3104(2) 0.5965(2) 0.0409(6) Uani 1 1 d . . . . .
H1 H 0.0823 0.2573 0.5826 0.049 Uiso 1 1 calc R U . . .
C13 C 0.08723(17) 0.4017(2) 0.5965(2) 0.0416(6) Uani 1 1 d . . . . .
H2 H 0.0331 0.4105 0.5847 0.050 Uiso 1 1 calc R U . . .
C14 C 0.1363(2) 0.4811(2) 0.6135(2) 0.0408(6) Uani 1 1 d . . . . .
C15 C 0.21508(19) 0.4670(2) 0.6310(3) 0.0493(7) Uani 1 1 d . . . . .
H3 H 0.2489 0.5206 0.6409 0.059 Uiso 1 1 calc R U . . .
C16 C 0.24508(18) 0.3752(2) 0.6341(3) 0.0507(8) Uani 1 1 d . . . . .
H4 H 0.2994 0.3666 0.6482 0.061 Uiso 1 1 calc R U . . .
C17 C 0.10550(17) 0.5777(2) 0.6202(2) 0.0395(6) Uani 1 1 d . . . . .
C18 C 0.04173(18) 0.7037(2) 0.6480(2) 0.0459(7) Uani 1 1 d . . . . .
H5 H 0.0446 0.7298 0.7123 0.055 Uiso 1 1 calc R U . . .
H6 H -0.0081 0.7234 0.6020 0.055 Uiso 1 1 calc R U . . .
C19 C 0.1099(2) 0.7384(2) 0.6149(3) 0.0525(8) Uani 1 1 d . . . . .
H7 H 0.0921 0.7796 0.5573 0.063 Uiso 1 1 calc R U . . .
H8 H 0.1473 0.7747 0.6665 0.063 Uiso 1 1 calc R U . . .
C21 C 0.22906(17) 0.1965(2) 0.6188(2) 0.0409(6) Uani 1 1 d . . . . .
C22 C 0.30447(17) 0.1827(2) 0.6146(2) 0.0420(6) Uani 1 1 d . . . . .
H9 H 0.3352 0.2365 0.6095 0.050 Uiso 1 1 calc R U . . .
C23 C 0.33518(17) 0.0919(2) 0.6177(2) 0.0409(6) Uani 1 1 d . . . . .
H10 H 0.3869 0.0842 0.6153 0.049 Uiso 1 1 calc R U . . .
C24 C 0.29174(19) 0.0114(2) 0.6242(2) 0.0385(6) Uani 1 1 d . . . . .
C25 C 0.2163(2) 0.0240(3) 0.6265(4) 0.0612(10) Uani 1 1 d . . . . .
H11 H 0.1851 -0.0302 0.6289 0.073 Uiso 1 1 calc R U . . .
C26 C 0.1859(2) 0.1153(2) 0.6253(3) 0.0663(11) Uani 1 1 d . . . . .
H12 H 0.1345 0.1227 0.6289 0.080 Uiso 1 1 calc R U . . .
C27 C 0.32674(16) -0.0846(2) 0.6321(2) 0.0390(6) Uani 1 1 d . . . . .
C28 C 0.40539(17) -0.2095(2) 0.6599(2) 0.0457(7) Uani 1 1 d . . . . .
H13 H 0.4319 -0.2350 0.7247 0.055 Uiso 1 1 calc R U . . .
H14 H 0.4349 -0.2288 0.6153 0.055 Uiso 1 1 calc R U . . .
C29 C 0.32210(17) -0.2458(2) 0.6245(2) 0.0467(7) Uani 1 1 d . . . . .
H15 H 0.3136 -0.2841 0.5651 0.056 Uiso 1 1 calc R U . . .
H16 H 0.3092 -0.2854 0.6742 0.056 Uiso 1 1 calc R U . . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.0360(2) 0.0352(2) 0.0538(2) 0.000 0.01398(15) 0.000
F1 0.095(8) 0.180(14) 0.096(7) 0.004(8) 0.030(6) -0.011(8)
F2 0.191(15) 0.095(9) 0.139(13) -0.007(9) 0.072(12) 0.030(10)
F3 0.111(8) 0.112(8) 0.124(9) 0.037(7) 0.060(7) -0.020(6)
F1B 0.128(17) 0.124(17) 0.100(13) -0.023(11) 0.046(12) -0.053(14)
F2B 0.128(17) 0.115(17) 0.120(17) -0.022(13) 0.073(13) -0.007(13)
F3B 0.16(2) 0.118(18) 0.133(18) 0.007(15) 0.046(15) 0.001(15)
O1 0.0630(15) 0.0357(11) 0.0780(15) 0.0004(10) 0.0432(12) -0.0027(10)
O2 0.0354(11) 0.0363(11) 0.0675(14) -0.0074(10) 0.0116(9) -0.0025(8)
O3 0.079(4) 0.062(4) 0.100(6) 0.018(5) 0.028(5) 0.013(3)
O4 0.099(6) 0.066(5) 0.106(7) 0.034(6) 0.040(6) 0.014(4)
O5 0.058(4) 0.055(4) 0.170(9) 0.002(5) 0.029(5) -0.001(3)
O6 0.150(8) 0.066(5) 0.125(7) 0.015(5) 0.082(6) 0.032(5)
N2 0.0332(12) 0.0350(12) 0.0499(13) -0.0033(10) 0.0100(10) 0.0000(9)
N1 0.0413(13) 0.0340(12) 0.0495(13) 0.0035(10) 0.0176(10) 0.0018(9)
C1 0.081(8) 0.064(6) 0.111(9) 0.017(5) 0.038(7) 0.003(4)
C2 0.040(19) 0.057(13) 0.092(6) 0.012(8) 0.001(16) -0.004(12)
C11 0.0440(16) 0.0392(15) 0.0436(15) -0.0035(12) 0.0189(12) 0.0014(12)
C12 0.0390(15) 0.0377(15) 0.0484(15) -0.0053(12) 0.0166(12) -0.0027(12)
C13 0.0415(16) 0.0384(15) 0.0500(16) -0.0001(12) 0.0213(13) 0.0005(12)
C14 0.0449(17) 0.0373(14) 0.0448(15) -0.0009(12) 0.0201(13) 0.0018(12)
C15 0.0466(18) 0.0385(15) 0.069(2) -0.0100(15) 0.0266(15) -0.0071(13)
C16 0.0376(16) 0.0413(17) 0.077(2) -0.0086(15) 0.0217(15) -0.0006(12)
C17 0.0418(15) 0.0354(14) 0.0437(15) -0.0012(11) 0.0166(12) -0.0019(11)
C18 0.0466(16) 0.0375(16) 0.0572(18) 0.0015(13) 0.0205(14) 0.0030(12)
C19 0.064(2) 0.0352(16) 0.068(2) 0.0022(14) 0.0344(17) 0.0023(14)
C21 0.0408(15) 0.0378(15) 0.0465(15) -0.0042(12) 0.0164(12) -0.0005(12)
C22 0.0411(16) 0.0369(15) 0.0504(16) 0.0084(12) 0.0170(13) 0.0020(12)
C23 0.0334(14) 0.0419(15) 0.0479(15) 0.0066(12) 0.0125(12) 0.0017(11)
C24 0.0348(16) 0.0397(16) 0.0415(15) -0.0039(11) 0.0120(12) -0.0022(10)
C25 0.0411(19) 0.0387(16) 0.109(3) -0.0109(19) 0.030(2) -0.0059(14)
C26 0.0418(18) 0.0407(18) 0.125(3) -0.0124(19) 0.038(2) -0.0022(14)
C27 0.0389(15) 0.0358(15) 0.0428(14) -0.0036(11) 0.0128(12) -0.0025(11)
C28 0.0373(15) 0.0376(15) 0.0602(18) -0.0058(13) 0.0111(13) 0.0000(11)
C29 0.0392(16) 0.0357(15) 0.0610(18) -0.0041(13) 0.0079(13) 0.0001(12)

_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
Ag1 N2 2.349(2) 3_455 ?
Ag1 N2 2.349(2) 4_556 ?
Ag1 N1 2.388(2) 2_556 ?
Ag1 N1 2.388(2) . ?
F1 C1 1.384(12) . ?
F2 C1 1.343(13) . ?
F3 C1 1.344(11) . ?
F1B C1 1.380(15) . ?
F2B C1 1.395(16) . ?
F3B C1 1.360(17) . ?
O1 C17 1.360(4) . ?
O1 C19 1.459(4) . ?
O2 C27 1.354(4) . ?
O2 C29 1.462(4) . ?
O3 C2 1.20(7) . ?
O4 C2 1.23(6) . ?
N2 C27 1.268(4) . ?
N2 C28 1.475(4) . ?
N2 Ag1 2.349(2) 3_545 ?
N1 C17 1.261(4) . ?
N1 C18 1.481(4) . ?
C1 C2 1.56(7) . ?
C11 C12 1.398(4) . ?
C11 C16 1.403(4) . ?
C11 C21 1.492(4) . ?
C12 C13 1.383(4) . ?
C12 H1 0.9500 . ?
C13 C14 1.397(4) . ?
C13 H2 0.9500 . ?
C14 C15 1.384(5) . ?
C14 C17 1.474(4) . ?
C15 C16 1.388(4) . ?
C15 H3 0.9500 . ?
C16 H4 0.9500 . ?
C18 C19 1.526(4) . ?
C18 H5 0.9900 . ?
C18 H6 0.9900 . ?
C19 H7 0.9900 . ?
C19 H8 0.9900 . ?
C21 C22 1.394(4) . ?
C21 C26 1.396(4) . ?
C22 C23 1.380(4) . ?
C22 H9 0.9500 . ?
C23 C24 1.389(4) . ?
C23 H10 0.9500 . ?
C24 C25 1.384(5) . ?
C24 C27 1.473(4) . ?
C25 C26 1.386(5) . ?
C25 H11 0.9500 . ?
C26 H12 0.9500 . ?
C28 C29 1.527(4) . ?
C28 H13 0.9900 . ?
C28 H14 0.9900 . ?
C29 H15 0.9900 . ?
C29 H16 0.9900 . ?

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
N2 Ag1 N2 108.32(12) 3_455 4_556 ?
N2 Ag1 N1 108.20(9) 3_455 2_556 ?
N2 Ag1 N1 113.64(9) 4_556 2_556 ?
N2 Ag1 N1 113.64(9) 3_455 . ?
N2 Ag1 N1 108.20(9) 4_556 . ?
N1 Ag1 N1 104.96(12) 2_556 . ?
C17 O1 C19 105.8(2) . . ?
C27 O2 C29 106.4(2) . . ?
C27 N2 C28 107.2(2) . . ?
C27 N2 Ag1 128.1(2) . 3_545 ?
C28 N2 Ag1 122.46(17) . 3_545 ?
C17 N1 C18 106.7(2) . . ?
C17 N1 Ag1 124.0(2) . . ?
C18 N1 Ag1 125.49(17) . . ?
F2 C1 F3 107.6(15) . . ?
F3B C1 F1B 105(2) . . ?
F2 C1 F1 112.0(14) . . ?
F3 C1 F1 99.2(10) . . ?
F3B C1 F2B 101(2) . . ?
F1B C1 F2B 83.4(19) . . ?
F2 C1 C2 119(3) . . ?
F3 C1 C2 108(2) . . ?
F3B C1 C2 131(3) . . ?
F1B C1 C2 117(2) . . ?
F1 C1 C2 109(2) . . ?
F2B C1 C2 106(3) . . ?
O3 C2 O4 135(6) . . ?
O3 C2 C1 114(4) . . ?
O4 C2 C1 110(5) . . ?
C12 C11 C16 117.8(3) . . ?
C12 C11 C21 121.6(3) . . ?
C16 C11 C21 120.6(3) . . ?
C13 C12 C11 121.0(3) . . ?
C13 C12 H1 119.5 . . ?
C11 C12 H1 119.5 . . ?
C12 C13 C14 120.6(3) . . ?
C12 C13 H2 119.7 . . ?
C14 C13 H2 119.7 . . ?
C15 C14 C13 119.0(3) . . ?
C15 C14 C17 120.4(3) . . ?
C13 C14 C17 120.5(3) . . ?
C14 C15 C16 120.5(3) . . ?
C14 C15 H3 119.7 . . ?
C16 C15 H3 119.7 . . ?
C15 C16 C11 121.0(3) . . ?
C15 C16 H4 119.5 . . ?
C11 C16 H4 119.5 . . ?
N1 C17 O1 118.6(3) . . ?
N1 C17 C14 126.2(3) . . ?
O1 C17 C14 115.2(3) . . ?
N1 C18 C19 104.6(2) . . ?
N1 C18 H5 110.8 . . ?
C19 C18 H5 110.8 . . ?
N1 C18 H6 110.8 . . ?
C19 C18 H6 110.8 . . ?
H5 C18 H6 108.9 . . ?
O1 C19 C18 103.8(2) . . ?
O1 C19 H7 111.0 . . ?
C18 C19 H7 111.0 . . ?
O1 C19 H8 111.0 . . ?
C18 C19 H8 111.0 . . ?
H7 C19 H8 109.0 . . ?
C22 C21 C26 117.5(3) . . ?
C22 C21 C11 120.9(3) . . ?
C26 C21 C11 121.6(3) . . ?
C23 C22 C21 121.0(3) . . ?
C23 C22 H9 119.5 . . ?
C21 C22 H9 119.5 . . ?
C22 C23 C24 121.1(3) . . ?
C22 C23 H10 119.5 . . ?
C24 C23 H10 119.5 . . ?
C25 C24 C23 118.6(3) . . ?
C25 C24 C27 121.1(3) . . ?
C23 C24 C27 120.3(3) . . ?
C24 C25 C26 120.3(3) . . ?
C24 C25 H11 119.8 . . ?
C26 C25 H11 119.8 . . ?
C25 C26 C21 121.5(3) . . ?
C25 C26 H12 119.2 . . ?
C21 C26 H12 119.2 . . ?
N2 C27 O2 117.9(3) . . ?
N2 C27 C24 126.6(3) . . ?
O2 C27 C24 115.4(3) . . ?
N2 C28 C29 104.8(2) . . ?
N2 C28 H13 110.8 . . ?
C29 C28 H13 110.8 . . ?
N2 C28 H14 110.8 . . ?
C29 C28 H14 110.8 . . ?
H13 C28 H14 108.9 . . ?
O2 C29 C28 103.6(2) . . ?
O2 C29 H15 111.0 . . ?
C28 C29 H15 111.0 . . ?
O2 C29 H16 111.0 . . ?
C28 C29 H16 111.0 . . ?
H15 C29 H16 109.0 . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
F2 C1 C2 O3 169(3) . . . . ?
F3 C1 C2 O3 46(3) . . . . ?
F3B C1 C2 O3 12(5) . . . . ?
F1B C1 C2 O3 -135(3) . . . . ?
F1 C1 C2 O3 -61(3) . . . . ?
F2B C1 C2 O3 134(3) . . . . ?
F2 C1 C2 O4 -18(4) . . . . ?
F3 C1 C2 O4 -141(2) . . . . ?
F3B C1 C2 O4 -174(3) . . . . ?
F1B C1 C2 O4 38(4) . . . . ?
F1 C1 C2 O4 113(3) . . . . ?
F2B C1 C2 O4 -53(3) . . . . ?
C16 C11 C12 C13 -1.8(4) . . . . ?
C21 C11 C12 C13 178.9(3) . . . . ?
C11 C12 C13 C14 2.1(4) . . . . ?
C12 C13 C14 C15 -0.3(5) . . . . ?
C12 C13 C14 C17 -175.7(3) . . . . ?
C13 C14 C15 C16 -1.7(5) . . . . ?
C17 C14 C15 C16 173.6(3) . . . . ?
C14 C15 C16 C11 2.0(5) . . . . ?
C12 C11 C16 C15 -0.2(5) . . . . ?
C21 C11 C16 C15 179.1(3) . . . . ?
C18 N1 C17 O1 0.5(4) . . . . ?
Ag1 N1 C17 O1 -158.7(2) . . . . ?
C18 N1 C17 C14 177.7(3) . . . . ?
Ag1 N1 C17 C14 18.6(4) . . . . ?
C19 O1 C17 N1 3.6(4) . . . . ?
C19 O1 C17 C14 -174.0(3) . . . . ?
C15 C14 C17 N1 -143.6(3) . . . . ?
C13 C14 C17 N1 31.7(5) . . . . ?
C15 C14 C17 O1 33.8(4) . . . . ?
C13 C14 C17 O1 -150.9(3) . . . . ?
C17 N1 C18 C19 -4.1(3) . . . . ?
Ag1 N1 C18 C19 154.7(2) . . . . ?
C17 O1 C19 C18 -5.7(3) . . . . ?
N1 C18 C19 O1 5.9(3) . . . . ?
C12 C11 C21 C22 163.6(3) . . . . ?
C16 C11 C21 C22 -15.7(4) . . . . ?
C12 C11 C21 C26 -16.6(5) . . . . ?
C16 C11 C21 C26 164.1(4) . . . . ?
C26 C21 C22 C23 -0.6(5) . . . . ?
C11 C21 C22 C23 179.2(3) . . . . ?
C21 C22 C23 C24 0.6(5) . . . . ?
C22 C23 C24 C25 0.7(5) . . . . ?
C22 C23 C24 C27 -177.1(3) . . . . ?
C23 C24 C25 C26 -2.0(6) . . . . ?
C27 C24 C25 C26 175.8(4) . . . . ?
C24 C25 C26 C21 2.0(7) . . . . ?
C22 C21 C26 C25 -0.6(6) . . . . ?
C11 C21 C26 C25 179.5(4) . . . . ?
C28 N2 C27 O2 0.3(3) . . . . ?
Ag1 N2 C27 O2 -162.71(19) 3_545 . . . ?
C28 N2 C27 C24 178.4(3) . . . . ?
Ag1 N2 C27 C24 15.4(4) 3_545 . . . ?
C29 O2 C27 N2 1.5(3) . . . . ?
C29 O2 C27 C24 -176.8(3) . . . . ?
C25 C24 C27 N2 -154.7(4) . . . . ?
C23 C24 C27 N2 23.1(5) . . . . ?
C25 C24 C27 O2 23.5(5) . . . . ?
C23 C24 C27 O2 -158.8(3) . . . . ?
C27 N2 C28 C29 -1.9(3) . . . . ?
Ag1 N2 C28 C29 162.31(19) 3_545 . . . ?
C27 O2 C29 C28 -2.5(3) . . . . ?
N2 C28 C29 O2 2.6(3) . . . . ?

_refine_diff_density_max         0.734
_refine_diff_density_min         -1.234
_refine_diff_density_rms         0.086

#====END
_database_code_depnum_ccdc_archive 'CCDC 962765'