# Electronic Supplementary Material (ESI) for Chemical Communications
# This journal is © The Royal Society of Chemistry 2011


data_publication_text
_journal_name_full               Chem.Commun.
_journal_coden_cambridge         0182
#TrackingRef '- Ag-L1a.cif'

_publ_contact_author_name        'Rasika Dias'
_publ_contact_author_address     
;Department of Chemistry and Biochemistry
The University of Texas at Arlington
700 Planetarium Place, Room 130 CPB
Arlington, Texas 76019-0065, USA
;
_publ_contact_author_email       dias@uta.edu
_publ_contact_author_phone       817-272-3813
_publ_contact_author_fax         817-272-3808
loop_
_publ_author_name
_publ_author_address
'Chi Yang'
;Department of Chemistry and Biochemistry
The University of Texas at Arlington
700 Planetarium Place, Room 130 CPB
Arlington, Texas 76019-0065, USA
;
M.Omary ''

data_unt002
_database_code_depnum_ccdc_archive 'CCDC 640177'
#TrackingRef '- Ag-L1a.cif'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            C83H66F42N31Ag7
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C83 H66 Ag7 F42 N31'
_chemical_formula_weight         3050.76

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'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   P2(1)/a

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

_cell_length_a                   13.2664(5)
_cell_length_b                   38.8979(15)
_cell_length_c                   20.6041(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 102.919(1)
_cell_angle_gamma                90.00
_cell_volume                     10363.3(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    8898
_cell_measurement_theta_min      2.50
_cell_measurement_theta_max      28.28

_exptl_crystal_description       yellow
_exptl_crystal_colour            rods
_exptl_crystal_size_max          0.33
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.12
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.955
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5952
_exptl_absorpt_coefficient_mu    1.431
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6495
_exptl_absorpt_correction_T_max  0.8470
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      100(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            77771
_diffrn_reflns_av_R_equivalents  0.0240
_diffrn_reflns_av_sigmaI/netI    0.0215
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -47
_diffrn_reflns_limit_k_max       47
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         1.97
_diffrn_reflns_theta_max         26.00
_reflns_number_total             20035
_reflns_number_gt                17782
_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^)+(0.0000P)^2^+96.4923P] 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    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         20035
_refine_ls_number_parameters     1510
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0546
_refine_ls_R_factor_gt           0.0424
_refine_ls_wR_factor_ref         0.1134
_refine_ls_wR_factor_gt          0.0916
_refine_ls_goodness_of_fit_ref   1.179
_refine_ls_restrained_S_all      1.179
_refine_ls_shift/su_max          0.003
_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
C1 C 0.7799(5) 0.13520(16) 0.3287(3) 0.0330(14) Uani 1 1 d . . .
H1A H 0.7715 0.1231 0.2861 0.050 Uiso 1 1 calc R . .
H1B H 0.7222 0.1294 0.3492 0.050 Uiso 1 1 calc R . .
H1C H 0.8451 0.1282 0.3584 0.050 Uiso 1 1 calc R . .
C2 C 0.7811(4) 0.17305(15) 0.3172(3) 0.0232(12) Uani 1 1 d . . .
C3 C 0.7984(4) 0.19969(15) 0.3654(3) 0.0240(12) Uani 1 1 d . . .
H3 H 0.8131(13) 0.1972(3) 0.407(3) 0.029 Uiso 1 1 calc R . .
C4 C 0.7870(4) 0.23003(15) 0.3316(3) 0.0195(11) Uani 1 1 d . A .
C5 C 0.7935(5) 0.26584(15) 0.3591(3) 0.0243(12) Uani 1 1 d . . .
H5A H 0.8151 0.2649 0.4078 0.036 Uiso 1 1 calc R . .
H5B H 0.7256 0.2769 0.3463 0.036 Uiso 1 1 calc R . .
H5C H 0.8441 0.2791 0.3414 0.036 Uiso 1 1 calc R . .
C6 C 0.7437(4) 0.24190(14) 0.2078(3) 0.0191(11) Uani 1 1 d . A .
C7 C 0.7160(4) 0.29397(14) 0.1594(3) 0.0185(11) Uani 1 1 d . A .
C8 C 0.7018(4) 0.24567(14) 0.0970(3) 0.0203(11) Uani 1 1 d . A .
C9 C 0.6613(5) 0.28096(14) -0.0444(3) 0.0248(12) Uani 1 1 d . . .
H9A H 0.7315 0.2897 -0.0270 0.037 Uiso 1 1 calc R . .
H9B H 0.6125 0.2937 -0.0241 0.037 Uiso 1 1 calc R . .
H9C H 0.6426 0.2840 -0.0928 0.037 Uiso 1 1 calc R . .
C10 C 0.6572(4) 0.24373(15) -0.0280(3) 0.0223(12) Uani 1 1 d . . .
C11 C 0.6307(4) 0.21698(15) -0.0707(3) 0.0238(12) Uani 1 1 d . . .
H11 H 0.6093(14) 0.21833(17) -0.121(3) 0.029 Uiso 1 1 calc R . .
C12 C 0.6387(4) 0.18647(14) -0.0310(3) 0.0210(11) Uani 1 1 d . . .
C13 C 0.6177(5) 0.15032(15) -0.0526(3) 0.0299(13) Uani 1 1 d . . .
H12A H 0.6161 0.1359 -0.0138 0.045 Uiso 1 1 calc R . .
H12B H 0.6724 0.1422 -0.0738 0.045 Uiso 1 1 calc R . .
H12C H 0.5508 0.1490 -0.0844 0.045 Uiso 1 1 calc R . .
C14 C 0.7102(4) 0.33098(14) 0.1641(3) 0.0217(11) Uani 1 1 d . . .
C15 C 0.7403(4) 0.34794(15) 0.2253(3) 0.0229(12) Uani 1 1 d . . .
H15 H 0.7641(18) 0.3351(9) 0.264(3) 0.027 Uiso 1 1 calc R . .
C16 C 0.7355(5) 0.38306(15) 0.2301(3) 0.0271(13) Uani 1 1 d . . .
H16 H 0.7563(16) 0.3934(8) 0.271(3) 0.033 Uiso 1 1 calc R . .
C17 C 0.6993(4) 0.40379(14) 0.1733(3) 0.0240(12) Uani 1 1 d . . .
C18 C 0.6691(5) 0.38648(16) 0.1117(3) 0.0278(13) Uani 1 1 d . . .
H18 H 0.6487(19) 0.3973(10) 0.079(3) 0.033 Uiso 1 1 calc R . .
C19 C 0.6743(4) 0.35136(14) 0.1073(3) 0.0223(11) Uani 1 1 d . . .
H19 H 0.6498(15) 0.3389(7) 0.059(3) 0.027 Uiso 1 1 calc R . .
C20 C 0.7197(5) 0.45662(16) 0.2413(3) 0.0351(15) Uani 1 1 d . . .
H20A H 0.6976 0.4421 0.2751 0.042 Uiso 1 1 calc R . .
H20B H 0.6791 0.4782 0.2372 0.042 Uiso 1 1 calc R . .
C21 C 0.8322(6) 0.4653(2) 0.2657(4) 0.0488(19) Uani 1 1 d . . .
H21A H 0.8736 0.4443 0.2677 0.073 Uiso 1 1 calc R . .
H21B H 0.8432 0.4755 0.3102 0.073 Uiso 1 1 calc R . .
H21C H 0.8532 0.4817 0.2351 0.073 Uiso 1 1 calc R . .
C22 C 0.6798(5) 0.46040(16) 0.1174(3) 0.0339(14) Uani 1 1 d . . .
H22A H 0.6651 0.4843 0.1293 0.041 Uiso 1 1 calc R . .
H22B H 0.6188 0.4520 0.0844 0.041 Uiso 1 1 calc R . .
C23 C 0.7735(6) 0.46051(18) 0.0859(4) 0.0411(16) Uani 1 1 d . . .
H23A H 0.8347 0.4680 0.1189 0.062 Uiso 1 1 calc R . .
H23B H 0.7609 0.4763 0.0479 0.062 Uiso 1 1 calc R . .
H23C H 0.7849 0.4373 0.0707 0.062 Uiso 1 1 calc R . .
C24 C 0.9416(5) 0.06276(16) 0.2042(3) 0.0349(15) Uani 1 1 d . . .
H1B1 H 0.8662 0.0608 0.1967 0.052 Uiso 1 1 calc R . .
H1B2 H 0.9740 0.0432 0.2308 0.052 Uiso 1 1 calc R . .
H1B3 H 0.9619 0.0629 0.1613 0.052 Uiso 1 1 calc R . .
C25 C 0.9762(4) 0.09539(15) 0.2407(3) 0.0253(12) Uani 1 1 d . A .
C26 C 1.0186(5) 0.09959(16) 0.3098(3) 0.0284(13) Uani 1 1 d . . .
H3B H 1.0325(12) 0.0823(13) 0.341(2) 0.034 Uiso 1 1 calc R . .
C27 C 1.0348(5) 0.13385(16) 0.3206(3) 0.0251(12) Uani 1 1 d . . .
C28 C 1.0774(6) 0.15211(17) 0.3844(3) 0.0373(15) Uani 1 1 d . . .
H5B1 H 1.1383 0.1654 0.3803 0.056 Uiso 1 1 calc R . .
H5B2 H 1.0970 0.1353 0.4204 0.056 Uiso 1 1 calc R . .
H5B3 H 1.0247 0.1676 0.3945 0.056 Uiso 1 1 calc R . .
C29 C 1.0013(4) 0.18404(14) 0.2403(3) 0.0201(11) Uani 1 1 d . A .
C30 C 1.0145(4) 0.24013(14) 0.2658(3) 0.0175(11) Uani 1 1 d . A .
C31 C 0.9722(4) 0.22293(14) 0.1584(3) 0.0196(11) Uani 1 1 d . A .
C32 C 0.9521(5) 0.29612(16) 0.0897(3) 0.0283(13) Uani 1 1 d . . .
H32A H 0.9449 0.3140 0.0554 0.042 Uiso 1 1 calc R . .
H32B H 1.0209 0.2976 0.1194 0.042 Uiso 1 1 calc R . .
H32C H 0.8991 0.2994 0.1156 0.042 Uiso 1 1 calc R . .
C33 C 0.9389(4) 0.26165(16) 0.0574(3) 0.0242(12) Uani 1 1 d . A .
C34 C 0.9166(4) 0.25337(17) -0.0089(3) 0.0270(13) Uani 1 1 d . . .
H34 H 0.9052(9) 0.2700(12) -0.047(3) 0.032 Uiso 1 1 calc R . .
C35 C 0.9126(4) 0.21762(17) -0.0142(3) 0.0262(13) Uani 1 1 d . . .
C36 C 0.8901(5) 0.1956(2) -0.0747(3) 0.0366(16) Uani 1 1 d . . .
H36A H 0.8197 0.2001 -0.1002 0.055 Uiso 1 1 calc R . .
H36B H 0.8964 0.1713 -0.0615 0.055 Uiso 1 1 calc R . .
H36C H 0.9396 0.2007 -0.1023 0.055 Uiso 1 1 calc R . .
C37 C 1.0312(4) 0.26756(14) 0.3144(3) 0.0199(11) Uani 1 1 d . . .
C38 C 1.0582(4) 0.26072(15) 0.3833(3) 0.0205(11) Uani 1 1 d . . .
H38 H 1.0686(8) 0.2378(16) 0.3980(11) 0.025 Uiso 1 1 calc R . .
C39 C 1.0697(4) 0.28668(15) 0.4295(3) 0.0227(12) Uani 1 1 d . . .
H39 H 1.0860(14) 0.2820(4) 0.469(3) 0.027 Uiso 1 1 calc R . .
C40 C 1.0538(4) 0.32143(15) 0.4100(3) 0.0222(11) Uani 1 1 d . . .
C41 C 1.0267(4) 0.32823(15) 0.3402(3) 0.0228(12) Uani 1 1 d . . .
H41 H 1.0154(9) 0.3503(17) 0.3258(11) 0.027 Uiso 1 1 calc R . .
C42 C 1.0171(4) 0.30211(14) 0.2944(3) 0.0213(11) Uani 1 1 d . . .
H42 H 1.0012(12) 0.3073(4) 0.250(3) 0.026 Uiso 1 1 calc R . .
C43 C 1.0774(5) 0.33975(16) 0.5270(3) 0.0310(14) Uani 1 1 d . . .
H43A H 1.0388 0.3185 0.5322 0.037 Uiso 1 1 calc R . .
H43B H 1.0468 0.3588 0.5481 0.037 Uiso 1 1 calc R . .
C44 C 1.1889(6) 0.3352(2) 0.5632(3) 0.0484(19) Uani 1 1 d . . .
H44A H 1.2275 0.3563 0.5593 0.073 Uiso 1 1 calc R . .
H44B H 1.2194 0.3160 0.5435 0.073 Uiso 1 1 calc R . .
H44C H 1.1922 0.3304 0.6103 0.073 Uiso 1 1 calc R . .
C45 C 1.0448(5) 0.38313(16) 0.4359(3) 0.0294(13) Uani 1 1 d . . .
H45A H 1.0731 0.3876 0.3962 0.035 Uiso 1 1 calc R . .
H45B H 1.0818 0.3982 0.4723 0.035 Uiso 1 1 calc R . .
C46 C 0.9306(5) 0.39215(17) 0.4202(3) 0.0372(15) Uani 1 1 d . . .
H46A H 0.8931 0.3767 0.3855 0.056 Uiso 1 1 calc R . .
H46B H 0.9214 0.4160 0.4044 0.056 Uiso 1 1 calc R . .
H46C H 0.9035 0.3897 0.4605 0.056 Uiso 1 1 calc R . .
C47 C 0.5776(6) 0.08772(18) 0.1191(3) 0.0409(17) Uani 1 1 d . . .
C48 C 0.6703(5) 0.08769(16) 0.0893(3) 0.0338(15) Uani 1 1 d . . .
C49 C 0.6984(5) 0.06413(16) 0.0463(3) 0.0350(15) Uani 1 1 d . . .
H49 H 0.669(3) 0.0453(17) 0.0318(14) 0.042 Uiso 1 1 calc R . .
C50 C 0.7867(5) 0.07863(16) 0.0326(3) 0.0314(14) Uani 1 1 d . A .
C51 C 0.8513(6) 0.0662(2) -0.0117(4) 0.0469(19) Uani 1 1 d . . .
Ag1 Ag 0.73869(4) 0.162591(11) 0.15325(2) 0.02769(10) Uani 1 1 d . . .
Ag2 Ag 0.9188(7) 0.15007(11) 0.0836(2) 0.0309(8) Uani 0.67(3) 1 d P A 1
Ag2' Ag 0.9555(15) 0.1433(3) 0.0938(4) 0.033(2) Uani 0.33(3) 1 d P A 2
F1 F 0.6006(4) 0.09489(13) 0.1841(2) 0.0561(12) Uani 1 1 d . . .
F2 F 0.5074(4) 0.11116(13) 0.0912(2) 0.0599(13) Uani 1 1 d . . .
F3 F 0.5298(4) 0.05767(12) 0.1116(3) 0.0683(15) Uani 1 1 d . . .
F4 F 0.8446(8) 0.03391(16) -0.0217(5) 0.145(4) Uani 1 1 d . . .
F5 F 0.8230(5) 0.0789(3) -0.0727(3) 0.125(3) Uani 1 1 d . . .
F6 F 0.9475(4) 0.07556(17) 0.0047(3) 0.090(2) Uani 1 1 d . . .
N1 N 0.7630(4) 0.18585(12) 0.2569(2) 0.0217(10) Uani 1 1 d . A .
N2 N 0.7656(3) 0.22136(11) 0.2648(2) 0.0194(9) Uani 1 1 d . . .
N3 N 0.7282(3) 0.22511(12) 0.1506(2) 0.0208(10) Uani 1 1 d . A .
N4 N 0.6802(3) 0.22964(11) 0.0353(2) 0.0185(9) Uani 1 1 d . . .
N5 N 0.6684(4) 0.19432(12) 0.0335(2) 0.0218(10) Uani 1 1 d . . .
N6 N 0.7393(3) 0.27576(12) 0.2169(2) 0.0207(10) Uani 1 1 d . . .
N7 N 0.6949(3) 0.27974(12) 0.0982(2) 0.0211(10) Uani 1 1 d . . .
N8 N 0.6952(4) 0.43871(13) 0.1775(3) 0.0295(11) Uani 1 1 d . . .
N9 N 0.9682(4) 0.12503(12) 0.2092(2) 0.0253(10) Uani 1 1 d . . .
N10 N 1.0052(3) 0.14916(12) 0.2593(2) 0.0218(10) Uani 1 1 d . A .
N11 N 0.9739(3) 0.18990(12) 0.1750(2) 0.0210(10) Uani 1 1 d . . .
N12 N 0.9483(3) 0.23021(12) 0.0906(2) 0.0214(10) Uani 1 1 d . . .
N13 N 0.9320(3) 0.20313(13) 0.0461(2) 0.0244(10) Uani 1 1 d . A .
N14 N 1.0232(3) 0.20728(12) 0.2875(2) 0.0201(9) Uani 1 1 d . . .
N15 N 0.9902(3) 0.24925(12) 0.2003(2) 0.0198(9) Uani 1 1 d . . .
N16 N 1.0639(4) 0.34719(12) 0.4558(2) 0.0247(10) Uani 1 1 d . . .
N17 N 0.7361(4) 0.11397(12) 0.1002(3) 0.0305(12) Uani 1 1 d . A .
N18 N 0.8089(4) 0.10880(13) 0.0648(3) 0.0304(12) Uani 1 1 d . . .
C52 C 0.1789(5) 0.03198(19) 0.4511(3) 0.0370(15) Uani 1 1 d . . .
C53 C 0.1024(5) 0.04989(15) 0.4817(3) 0.0274(13) Uani 1 1 d . . .
C54 C -0.0023(5) 0.04607(16) 0.4689(3) 0.0328(14) Uani 1 1 d . . .
H54 H -0.041(3) 0.0321(12) 0.441(2) 0.039 Uiso 1 1 calc R . .
C55 C -0.0324(5) 0.06958(16) 0.5111(3) 0.0296(13) Uani 1 1 d . . .
C56 C -0.1393(6) 0.0794(2) 0.5161(4) 0.0429(17) Uani 1 1 d . . .
C57 C -0.0548(5) 0.14927(17) 0.7627(3) 0.0304(14) Uani 1 1 d . . .
C58 C 0.0056(4) 0.11668(16) 0.7780(3) 0.0262(12) Uani 1 1 d . . .
C59 C 0.0131(5) 0.09530(17) 0.8321(3) 0.0325(14) Uani 1 1 d . . .
H59 H -0.018(3) 0.0976(3) 0.868(3) 0.039 Uiso 1 1 calc R . .
C60 C 0.0785(5) 0.06951(16) 0.8203(3) 0.0304(13) Uani 1 1 d . . .
C61 C 0.1114(6) 0.03852(18) 0.8618(3) 0.0357(15) Uani 1 1 d . . .
C62 C 0.2973(5) 0.13151(18) 0.9341(3) 0.0367(15) Uani 1 1 d . . .
C63 C 0.3496(4) 0.10552(15) 0.9006(3) 0.0239(12) Uani 1 1 d . . .
C64 C 0.4045(5) 0.07679(16) 0.9266(3) 0.0289(13) Uani 1 1 d . . .
H64 H 0.4128(9) 0.0695(7) 0.962(3) 0.035 Uiso 1 1 calc R . .
C65 C 0.4409(5) 0.06405(15) 0.8739(3) 0.0265(13) Uani 1 1 d . . .
C66 C 0.5091(5) 0.03402(16) 0.8737(3) 0.0331(14) Uani 1 1 d . . .
C67 C 0.2871(5) 0.18701(15) 0.5313(3) 0.0281(13) Uani 1 1 d . . .
C68 C 0.3574(4) 0.17606(14) 0.5933(3) 0.0223(12) Uani 1 1 d . . .
C69 C 0.4281(5) 0.19571(16) 0.6373(3) 0.0255(12) Uani 1 1 d . . .
H69 H 0.4379(10) 0.2161(18) 0.6361(3) 0.031 Uiso 1 1 calc R . .
C70 C 0.4784(5) 0.17202(16) 0.6840(3) 0.0271(13) Uani 1 1 d . . .
C71 C 0.5635(5) 0.17750(18) 0.7424(3) 0.0347(15) Uani 1 1 d . . .
C72 C -0.0071(5) 0.20742(15) 0.5672(3) 0.0287(13) Uani 1 1 d . . .
C73 C 0.0846(4) 0.20663(15) 0.6248(3) 0.0237(12) Uani 1 1 d . . .
C74 C 0.1408(5) 0.23415(15) 0.6561(3) 0.0262(12) Uani 1 1 d . . .
H74 H 0.1328(8) 0.2570(18) 0.6456(9) 0.031 Uiso 1 1 calc R . .
C75 C 0.2126(5) 0.21888(15) 0.7075(3) 0.0257(12) Uani 1 1 d . . .
C76 C 0.2888(5) 0.23585(16) 0.7617(3) 0.0298(13) Uani 1 1 d . . .
C77 C 0.5159(5) 0.04133(15) 0.5728(3) 0.0294(13) Uani 1 1 d . . .
C78 C 0.4422(5) 0.02802(15) 0.6117(3) 0.0256(12) Uani 1 1 d . . .
C79 C 0.4212(4) -0.00566(15) 0.6246(3) 0.0252(12) Uani 1 1 d . . .
H79 H 0.449(2) -0.0231(15) 0.6139(10) 0.030 Uiso 1 1 calc R . .
C80 C 0.3440(5) -0.00363(14) 0.6593(3) 0.0261(12) Uani 1 1 d . . .
C81 C 0.2930(5) -0.03120(17) 0.6890(3) 0.0356(15) Uani 1 1 d . . .
C82 C 0.7154(6) 0.06286(17) 0.7260(3) 0.0361(15) Uani 1 1 d . . .
C83 C 0.8147(5) 0.0522(2) 0.7150(4) 0.0427(17) Uani 1 1 d . . .
H83A H 0.8045 0.0344 0.6805 0.064 Uiso 1 1 calc R . .
H83B H 0.8570 0.0429 0.7565 0.064 Uiso 1 1 calc R . .
H83C H 0.8499 0.0720 0.7007 0.064 Uiso 1 1 calc R . .
Ag3 Ag 0.47032(4) 0.090539(12) 0.72640(2) 0.03094(11) Uani 1 1 d . . .
Ag4 Ag 0.27487(4) 0.098728(11) 0.57722(2) 0.02640(10) Uani 1 1 d . . .
Ag5 Ag 0.07501(4) 0.122243(12) 0.63064(2) 0.02852(11) Uani 1 1 d . . .
Ag6 Ag 0.27763(4) 0.145655(11) 0.76652(2) 0.02625(10) Uani 1 1 d . . .
Ag7 Ag 0.21797(4) 0.052634(12) 0.71753(2) 0.02839(11) Uani 1 1 d . . .
F7 F 0.2342(4) 0.05395(14) 0.4230(3) 0.0693(15) Uani 1 1 d . . .
F8 F 0.2473(4) 0.01346(14) 0.4940(2) 0.0754(17) Uani 1 1 d . . .
F9 F 0.1333(3) 0.01126(14) 0.4023(2) 0.0635(14) Uani 1 1 d . . .
F10 F -0.2099(4) 0.05816(19) 0.4833(4) 0.116(3) Uani 1 1 d . . .
F11 F -0.1503(4) 0.08116(18) 0.5775(2) 0.0797(18) Uani 1 1 d . . .
F12 F -0.1676(4) 0.11021(15) 0.4897(3) 0.0722(16) Uani 1 1 d . . .
F13 F -0.0983(3) 0.15247(12) 0.6981(2) 0.0508(11) Uani 1 1 d . . .
F14 F 0.0032(3) 0.17713(10) 0.7795(2) 0.0472(10) Uani 1 1 d . . .
F15 F -0.1304(3) 0.15054(11) 0.7959(2) 0.0460(10) Uani 1 1 d . . .
F16 F 0.1348(5) 0.04533(13) 0.9264(2) 0.0724(16) Uani 1 1 d . . .
F17 F 0.0363(4) 0.01497(11) 0.8527(3) 0.0661(14) Uani 1 1 d . . .
F18 F 0.1929(4) 0.02276(13) 0.8480(3) 0.0680(15) Uani 1 1 d . . .
F19 F 0.2031(3) 0.13974(13) 0.9016(3) 0.0615(14) Uani 1 1 d . . .
F20 F 0.2972(6) 0.12306(17) 0.9953(3) 0.104(3) Uani 1 1 d . . .
F21 F 0.3472(4) 0.16205(12) 0.9398(3) 0.0677(16) Uani 1 1 d . . .
F22 F 0.4806(4) 0.01489(10) 0.8186(2) 0.0483(11) Uani 1 1 d . . .
F23 F 0.5114(3) 0.01355(10) 0.92619(19) 0.0448(10) Uani 1 1 d . . .
F24 F 0.6078(3) 0.04270(11) 0.8763(2) 0.0477(10) Uani 1 1 d . . .
F25 F 0.1923(3) 0.17327(10) 0.52191(17) 0.0348(8) Uani 1 1 d . . .
F26 F 0.3225(3) 0.17789(10) 0.47655(16) 0.0324(8) Uani 1 1 d . . .
F27 F 0.2748(3) 0.22122(9) 0.52792(18) 0.0382(9) Uani 1 1 d . . .
F28 F 0.5826(3) 0.21083(10) 0.75502(19) 0.0461(10) Uani 1 1 d . . .
F29 F 0.6512(3) 0.16336(15) 0.7355(2) 0.0705(16) Uani 1 1 d . . .
F30 F 0.5435(4) 0.16401(11) 0.79764(18) 0.0519(12) Uani 1 1 d . . .
F31 F -0.0268(3) 0.17792(11) 0.5354(2) 0.0528(12) Uani 1 1 d . . .
F32 F -0.0931(3) 0.21552(12) 0.5879(2) 0.0513(11) Uani 1 1 d . . .
F33 F 0.0019(4) 0.23131(14) 0.5237(2) 0.0706(17) Uani 1 1 d . . .
F34 F 0.2516(3) 0.24126(12) 0.81538(18) 0.0464(10) Uani 1 1 d . . .
F35 F 0.3150(4) 0.26646(11) 0.7425(2) 0.0591(13) Uani 1 1 d . . .
F36 F 0.3747(3) 0.21790(11) 0.7815(2) 0.0513(11) Uani 1 1 d . . .
F37 F 0.5334(3) 0.07497(9) 0.58206(18) 0.0373(9) Uani 1 1 d . . .
F38 F 0.6064(3) 0.02524(10) 0.5882(2) 0.0414(9) Uani 1 1 d . . .
F39 F 0.4807(3) 0.03712(10) 0.50655(18) 0.0407(9) Uani 1 1 d . . .
F40 F 0.3325(5) -0.06165(11) 0.6798(3) 0.0710(16) Uani 1 1 d . . .
F41 F 0.1912(4) -0.03255(14) 0.6615(3) 0.0698(15) Uani 1 1 d . . .
F42 F 0.2991(3) -0.02777(10) 0.7536(2) 0.0458(10) Uani 1 1 d . . .
N19 N 0.1333(4) 0.07360(13) 0.5291(2) 0.0261(11) Uani 1 1 d . . .
N20 N 0.0488(4) 0.08578(13) 0.5471(3) 0.0293(11) Uani 1 1 d . . .
N21 N 0.0620(4) 0.10489(13) 0.7357(2) 0.0263(11) Uani 1 1 d . . .
N22 N 0.1076(4) 0.07531(13) 0.7632(2) 0.0278(11) Uani 1 1 d . . .
N23 N 0.3531(4) 0.10981(12) 0.8365(2) 0.0238(10) Uani 1 1 d . . .
N24 N 0.4106(4) 0.08339(12) 0.8201(2) 0.0266(11) Uani 1 1 d . . .
N25 N 0.3654(4) 0.14292(12) 0.6123(2) 0.0227(10) Uani 1 1 d . . .
N26 N 0.4408(4) 0.14005(13) 0.6685(2) 0.0248(10) Uani 1 1 d . . .
N27 N 0.1202(4) 0.17695(12) 0.6539(2) 0.0241(10) Uani 1 1 d . . .
N28 N 0.1992(4) 0.18438(13) 0.7058(2) 0.0240(10) Uani 1 1 d . . .
N29 N 0.3820(4) 0.04957(13) 0.6374(3) 0.0278(11) Uani 1 1 d . . .
N30 N 0.3210(4) 0.02965(12) 0.6675(2) 0.0269(11) Uani 1 1 d . . .
N31 N 0.6372(5) 0.07144(18) 0.7347(3) 0.0494(16) 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
C1 0.041(4) 0.025(3) 0.037(4) 0.001(3) 0.018(3) 0.001(3)
C2 0.018(3) 0.022(3) 0.031(3) 0.004(2) 0.010(2) 0.004(2)
C3 0.023(3) 0.029(3) 0.021(3) -0.001(2) 0.007(2) 0.001(2)
C4 0.013(2) 0.033(3) 0.012(2) -0.002(2) 0.0017(19) 0.001(2)
C5 0.029(3) 0.025(3) 0.021(3) -0.004(2) 0.008(2) 0.002(2)
C6 0.014(2) 0.026(3) 0.018(3) 0.005(2) 0.005(2) -0.001(2)
C7 0.014(2) 0.018(3) 0.025(3) 0.000(2) 0.008(2) 0.001(2)
C8 0.014(3) 0.026(3) 0.023(3) -0.002(2) 0.008(2) -0.003(2)
C9 0.029(3) 0.019(3) 0.027(3) -0.002(2) 0.009(2) -0.004(2)
C10 0.015(3) 0.033(3) 0.019(3) 0.001(2) 0.005(2) 0.000(2)
C11 0.018(3) 0.027(3) 0.025(3) -0.002(2) 0.002(2) 0.000(2)
C12 0.022(3) 0.024(3) 0.017(3) -0.004(2) 0.004(2) -0.003(2)
C13 0.040(4) 0.024(3) 0.024(3) 0.000(2) 0.003(3) -0.003(3)
C14 0.020(3) 0.019(3) 0.027(3) -0.003(2) 0.009(2) -0.007(2)
C15 0.024(3) 0.025(3) 0.021(3) -0.001(2) 0.007(2) 0.000(2)
C16 0.026(3) 0.025(3) 0.031(3) -0.004(3) 0.007(2) -0.004(2)
C17 0.027(3) 0.016(3) 0.032(3) -0.002(2) 0.013(2) -0.001(2)
C18 0.030(3) 0.026(3) 0.028(3) 0.002(2) 0.008(3) -0.001(2)
C19 0.024(3) 0.022(3) 0.024(3) -0.002(2) 0.009(2) -0.001(2)
C20 0.049(4) 0.021(3) 0.035(4) -0.009(3) 0.011(3) -0.006(3)
C21 0.050(5) 0.044(4) 0.048(4) -0.004(3) 0.001(4) -0.019(4)
C22 0.044(4) 0.021(3) 0.034(3) 0.001(3) 0.001(3) 0.003(3)
C23 0.050(4) 0.029(3) 0.045(4) 0.005(3) 0.012(3) -0.005(3)
C24 0.038(4) 0.023(3) 0.042(4) -0.006(3) 0.004(3) -0.003(3)
C25 0.024(3) 0.023(3) 0.031(3) -0.003(2) 0.011(2) -0.005(2)
C26 0.033(3) 0.024(3) 0.028(3) 0.000(3) 0.008(3) -0.003(3)
C27 0.030(3) 0.032(3) 0.014(3) 0.000(2) 0.004(2) 0.004(2)
C28 0.046(4) 0.029(3) 0.032(3) 0.000(3) -0.002(3) -0.007(3)
C29 0.020(3) 0.025(3) 0.017(3) -0.002(2) 0.007(2) 0.001(2)
C30 0.010(2) 0.023(3) 0.020(3) -0.001(2) 0.003(2) 0.002(2)
C31 0.013(2) 0.023(3) 0.025(3) -0.001(2) 0.008(2) 0.000(2)
C32 0.026(3) 0.033(3) 0.027(3) 0.005(3) 0.008(2) 0.000(3)
C33 0.015(3) 0.038(3) 0.019(3) 0.003(2) 0.003(2) 0.002(2)
C34 0.017(3) 0.039(4) 0.025(3) 0.004(3) 0.007(2) 0.006(2)
C35 0.016(3) 0.042(4) 0.020(3) -0.005(3) 0.003(2) 0.003(2)
C36 0.028(3) 0.061(5) 0.020(3) -0.009(3) 0.004(3) 0.000(3)
C37 0.018(3) 0.024(3) 0.019(3) 0.001(2) 0.007(2) 0.000(2)
C38 0.017(3) 0.022(3) 0.023(3) 0.000(2) 0.005(2) -0.003(2)
C39 0.021(3) 0.028(3) 0.019(3) -0.002(2) 0.006(2) -0.005(2)
C40 0.018(3) 0.027(3) 0.023(3) -0.004(2) 0.006(2) -0.003(2)
C41 0.021(3) 0.024(3) 0.024(3) 0.001(2) 0.006(2) -0.002(2)
C42 0.020(3) 0.023(3) 0.021(3) 0.000(2) 0.006(2) 0.001(2)
C43 0.040(4) 0.029(3) 0.025(3) -0.007(3) 0.011(3) -0.001(3)
C44 0.044(4) 0.067(5) 0.028(4) -0.002(3) -0.004(3) -0.016(4)
C45 0.039(4) 0.027(3) 0.023(3) -0.006(2) 0.010(3) -0.005(3)
C46 0.042(4) 0.029(3) 0.039(4) -0.002(3) 0.005(3) 0.010(3)
C47 0.052(4) 0.032(4) 0.033(4) -0.003(3) -0.002(3) 0.002(3)
C48 0.043(4) 0.027(3) 0.025(3) 0.002(3) -0.005(3) -0.001(3)
C49 0.041(4) 0.017(3) 0.041(4) -0.009(3) -0.002(3) -0.006(3)
C50 0.038(4) 0.023(3) 0.028(3) -0.003(2) -0.004(3) -0.003(3)
C51 0.049(4) 0.045(4) 0.044(4) -0.029(4) 0.004(3) -0.014(3)
Ag1 0.0323(2) 0.0200(2) 0.0291(2) -0.00569(18) 0.00344(19) -0.00278(18)
Ag2 0.0397(19) 0.0278(8) 0.0277(7) -0.0099(6) 0.0128(10) -0.0118(10)
Ag2' 0.043(4) 0.035(2) 0.0237(14) -0.0113(14) 0.013(2) -0.018(3)
F1 0.055(3) 0.074(3) 0.039(2) -0.001(2) 0.010(2) -0.014(2)
F2 0.053(3) 0.068(3) 0.060(3) 0.019(2) 0.015(2) 0.020(2)
F3 0.058(3) 0.039(3) 0.115(4) -0.013(3) 0.034(3) -0.026(2)
F4 0.227(9) 0.055(4) 0.209(9) -0.069(5) 0.164(8) -0.039(5)
F5 0.059(4) 0.266(11) 0.053(4) 0.004(5) 0.023(3) 0.032(5)
F6 0.035(3) 0.119(5) 0.110(5) -0.076(4) 0.005(3) 0.002(3)
N1 0.029(3) 0.023(2) 0.016(2) -0.0007(18) 0.0090(19) -0.0009(19)
N2 0.019(2) 0.019(2) 0.021(2) -0.0028(18) 0.0058(18) -0.0006(18)
N3 0.020(2) 0.027(2) 0.017(2) -0.0032(19) 0.0056(18) -0.0051(19)
N4 0.022(2) 0.018(2) 0.017(2) -0.0024(18) 0.0068(18) -0.0020(18)
N5 0.022(2) 0.022(2) 0.022(2) 0.0007(19) 0.0066(19) -0.0021(19)
N6 0.020(2) 0.020(2) 0.022(2) -0.0039(19) 0.0056(19) -0.0051(18)
N7 0.020(2) 0.025(2) 0.018(2) -0.0015(19) 0.0050(18) 0.0004(19)
N8 0.032(3) 0.021(3) 0.034(3) -0.004(2) 0.003(2) 0.003(2)
N9 0.021(2) 0.023(3) 0.031(3) -0.009(2) 0.006(2) -0.0025(19)
N10 0.015(2) 0.017(2) 0.033(3) -0.0033(19) 0.0043(19) -0.0002(18)
N11 0.018(2) 0.021(2) 0.025(2) -0.0068(19) 0.0060(19) -0.0011(18)
N12 0.018(2) 0.030(3) 0.017(2) -0.0022(19) 0.0038(18) 0.0007(19)
N13 0.016(2) 0.035(3) 0.023(2) -0.010(2) 0.0047(19) -0.002(2)
N14 0.019(2) 0.024(2) 0.018(2) -0.0018(19) 0.0051(18) 0.0001(18)
N15 0.016(2) 0.020(2) 0.024(2) -0.0031(19) 0.0065(18) 0.0015(18)
N16 0.028(3) 0.022(2) 0.025(3) -0.004(2) 0.006(2) -0.004(2)
N17 0.046(3) 0.016(2) 0.027(3) -0.001(2) 0.002(2) -0.009(2)
N18 0.043(3) 0.021(3) 0.025(3) -0.001(2) 0.004(2) -0.005(2)
C52 0.032(3) 0.044(4) 0.031(3) -0.013(3) 0.000(3) 0.003(3)
C53 0.040(3) 0.022(3) 0.019(3) 0.000(2) 0.004(2) 0.004(3)
C54 0.033(3) 0.027(3) 0.034(3) -0.005(3) 0.001(3) -0.006(3)
C55 0.029(3) 0.030(3) 0.030(3) -0.004(3) 0.008(3) -0.003(3)
C56 0.042(4) 0.050(4) 0.040(4) -0.007(3) 0.018(3) -0.008(3)
C57 0.030(3) 0.033(3) 0.027(3) -0.008(3) 0.005(3) 0.006(3)
C58 0.024(3) 0.031(3) 0.023(3) -0.004(2) 0.005(2) -0.001(2)
C59 0.033(3) 0.040(4) 0.027(3) -0.005(3) 0.014(3) -0.004(3)
C60 0.036(3) 0.032(3) 0.025(3) -0.004(3) 0.009(3) -0.001(3)
C61 0.046(4) 0.035(4) 0.028(3) 0.005(3) 0.013(3) 0.003(3)
C62 0.034(4) 0.044(4) 0.032(3) -0.005(3) 0.006(3) 0.010(3)
C63 0.025(3) 0.025(3) 0.021(3) -0.005(2) 0.002(2) -0.001(2)
C64 0.036(3) 0.029(3) 0.021(3) 0.006(2) 0.004(3) 0.004(3)
C65 0.042(4) 0.022(3) 0.016(3) -0.001(2) 0.007(2) -0.003(3)
C66 0.048(4) 0.022(3) 0.028(3) -0.001(3) 0.007(3) 0.005(3)
C67 0.033(3) 0.025(3) 0.027(3) -0.002(2) 0.008(3) 0.001(2)
C68 0.028(3) 0.020(3) 0.019(3) -0.003(2) 0.007(2) -0.001(2)
C69 0.034(3) 0.025(3) 0.017(3) 0.001(2) 0.006(2) -0.006(2)
C70 0.030(3) 0.032(3) 0.021(3) -0.003(2) 0.009(2) -0.004(3)
C71 0.042(4) 0.041(4) 0.019(3) 0.002(3) 0.002(3) -0.003(3)
C72 0.033(3) 0.021(3) 0.030(3) 0.006(2) 0.003(3) 0.004(2)
C73 0.028(3) 0.023(3) 0.021(3) 0.001(2) 0.007(2) 0.003(2)
C74 0.029(3) 0.019(3) 0.029(3) 0.002(2) 0.004(2) 0.000(2)
C75 0.027(3) 0.024(3) 0.027(3) -0.003(2) 0.008(2) 0.000(2)
C76 0.034(3) 0.028(3) 0.025(3) -0.005(2) 0.000(3) 0.000(3)
C77 0.039(4) 0.022(3) 0.030(3) -0.002(2) 0.013(3) 0.006(3)
C78 0.034(3) 0.020(3) 0.022(3) 0.002(2) 0.006(2) 0.004(2)
C79 0.027(3) 0.019(3) 0.029(3) -0.003(2) 0.005(2) 0.006(2)
C80 0.032(3) 0.016(3) 0.030(3) -0.003(2) 0.007(3) 0.005(2)
C81 0.042(4) 0.030(3) 0.035(4) 0.000(3) 0.008(3) -0.001(3)
C82 0.046(4) 0.026(3) 0.035(4) 0.004(3) 0.006(3) 0.005(3)
C83 0.034(4) 0.048(4) 0.046(4) 0.001(3) 0.008(3) -0.003(3)
Ag3 0.0450(3) 0.0261(2) 0.0215(2) 0.00063(18) 0.0069(2) 0.0040(2)
Ag4 0.0302(2) 0.0248(2) 0.0232(2) -0.00366(17) 0.00384(18) -0.00247(18)
Ag5 0.0347(3) 0.0238(2) 0.0275(2) -0.00489(18) 0.00801(19) 0.00094(19)
Ag6 0.0310(2) 0.0234(2) 0.0231(2) 0.00075(17) 0.00342(18) 0.00618(18)
Ag7 0.0337(2) 0.0245(2) 0.0299(2) -0.00072(18) 0.01330(19) 0.00203(19)
F7 0.057(3) 0.072(3) 0.091(4) -0.016(3) 0.043(3) -0.005(3)
F8 0.082(4) 0.085(4) 0.048(3) -0.017(3) -0.008(3) 0.056(3)
F9 0.049(3) 0.086(4) 0.052(3) -0.049(3) 0.002(2) 0.006(2)
F10 0.041(3) 0.126(6) 0.187(7) -0.099(5) 0.038(4) -0.033(3)
F11 0.059(3) 0.145(6) 0.043(3) 0.024(3) 0.029(2) 0.031(3)
F12 0.054(3) 0.088(4) 0.082(4) 0.035(3) 0.031(3) 0.030(3)
F13 0.053(3) 0.060(3) 0.037(2) 0.000(2) 0.0043(19) 0.027(2)
F14 0.052(3) 0.031(2) 0.060(3) -0.0059(19) 0.016(2) 0.0036(19)
F15 0.039(2) 0.055(3) 0.049(2) -0.007(2) 0.0218(19) 0.0122(19)
F16 0.127(5) 0.053(3) 0.034(2) 0.008(2) 0.009(3) 0.005(3)
F17 0.067(3) 0.036(2) 0.094(4) 0.013(2) 0.014(3) -0.016(2)
F18 0.069(3) 0.068(3) 0.076(3) 0.039(3) 0.036(3) 0.031(3)
F19 0.031(2) 0.066(3) 0.084(4) -0.041(3) 0.004(2) 0.009(2)
F20 0.175(7) 0.106(5) 0.051(3) 0.029(3) 0.068(4) 0.090(5)
F21 0.049(3) 0.050(3) 0.105(4) -0.053(3) 0.019(3) -0.003(2)
F22 0.067(3) 0.034(2) 0.035(2) -0.0123(17) -0.006(2) 0.019(2)
F23 0.067(3) 0.032(2) 0.033(2) 0.0109(17) 0.0081(19) 0.0170(19)
F24 0.038(2) 0.042(2) 0.061(3) 0.003(2) 0.008(2) 0.0139(19)
F25 0.0272(19) 0.047(2) 0.0274(19) -0.0009(16) 0.0002(15) -0.0048(16)
F26 0.036(2) 0.042(2) 0.0191(17) -0.0002(15) 0.0061(15) 0.0042(16)
F27 0.053(2) 0.0266(19) 0.031(2) 0.0030(15) 0.0001(17) 0.0063(17)
F28 0.060(3) 0.039(2) 0.033(2) 0.0000(17) -0.0047(19) -0.022(2)
F29 0.037(2) 0.108(4) 0.054(3) -0.026(3) -0.016(2) 0.015(3)
F30 0.076(3) 0.052(3) 0.0181(18) 0.0084(17) -0.0091(19) -0.023(2)
F31 0.052(3) 0.044(2) 0.048(3) -0.017(2) -0.018(2) 0.009(2)
F32 0.034(2) 0.066(3) 0.050(3) -0.008(2) 0.0008(19) 0.011(2)
F33 0.061(3) 0.084(4) 0.051(3) 0.045(3) -0.021(2) -0.031(3)
F34 0.046(2) 0.066(3) 0.0243(19) -0.0164(19) 0.0028(17) 0.000(2)
F35 0.073(3) 0.041(2) 0.053(3) 0.002(2) -0.008(2) -0.028(2)
F36 0.037(2) 0.054(3) 0.054(3) -0.024(2) -0.0086(19) 0.014(2)
F37 0.052(2) 0.031(2) 0.034(2) -0.0018(16) 0.0194(18) -0.0031(17)
F38 0.036(2) 0.047(2) 0.046(2) 0.0059(19) 0.0188(18) 0.0076(18)
F39 0.059(3) 0.043(2) 0.0227(18) -0.0027(16) 0.0144(18) -0.0010(19)
F40 0.114(4) 0.021(2) 0.097(4) 0.002(2) 0.065(4) -0.002(2)
F41 0.053(3) 0.086(4) 0.063(3) 0.016(3) -0.004(2) -0.036(3)
F42 0.059(3) 0.041(2) 0.040(2) 0.0066(18) 0.018(2) -0.013(2)
N19 0.033(3) 0.024(3) 0.020(2) -0.003(2) 0.004(2) 0.001(2)
N20 0.037(3) 0.022(3) 0.032(3) -0.001(2) 0.014(2) -0.004(2)
N21 0.030(3) 0.026(3) 0.024(2) -0.003(2) 0.010(2) 0.001(2)
N22 0.036(3) 0.024(3) 0.027(3) -0.002(2) 0.014(2) 0.000(2)
N23 0.031(3) 0.018(2) 0.023(2) -0.0007(19) 0.007(2) 0.005(2)
N24 0.033(3) 0.022(3) 0.024(3) -0.003(2) 0.005(2) 0.005(2)
N25 0.028(3) 0.022(2) 0.017(2) -0.0015(19) 0.0020(19) -0.001(2)
N26 0.030(3) 0.027(3) 0.017(2) -0.0005(19) 0.004(2) -0.002(2)
N27 0.029(3) 0.026(3) 0.017(2) -0.0032(19) 0.004(2) 0.003(2)
N28 0.029(3) 0.028(3) 0.016(2) 0.0011(19) 0.006(2) 0.006(2)
N29 0.029(3) 0.023(3) 0.033(3) 0.001(2) 0.009(2) 0.002(2)
N30 0.033(3) 0.022(2) 0.027(3) 0.000(2) 0.010(2) -0.005(2)
N31 0.054(4) 0.054(4) 0.039(4) 0.006(3) 0.009(3) 0.017(3)

_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
C1 C2 1.492(8) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
C2 N1 1.309(7) . ?
C2 C3 1.418(8) . ?
C3 C4 1.361(8) . ?
C3 H3 0.8465 . ?
C4 N2 1.383(7) . ?
C4 C5 1.500(8) . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 H5C 0.9800 . ?
C6 N3 1.323(7) . ?
C6 N6 1.334(7) . ?
C6 N2 1.396(7) . ?
C7 N7 1.348(7) . ?
C7 N6 1.355(7) . ?
C7 C14 1.446(7) . ?
C8 N7 1.329(7) . ?
C8 N3 1.345(7) . ?
C8 N4 1.387(7) . ?
C9 C10 1.491(8) . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C11 1.357(8) . ?
C10 N4 1.384(7) . ?
C11 C12 1.432(8) . ?
C11 H11 1.0117 . ?
C12 N5 1.334(7) . ?
C12 C13 1.483(8) . ?
C13 H12A 0.9800 . ?
C13 H12B 0.9800 . ?
C13 H12C 0.9800 . ?
C14 C15 1.401(8) . ?
C14 C19 1.405(8) . ?
C15 C16 1.372(8) . ?
C15 H15 0.9257 . ?
C16 C17 1.414(8) . ?
C16 H16 0.9243 . ?
C17 N8 1.363(7) . ?
C17 C18 1.413(8) . ?
C18 C19 1.372(8) . ?
C18 H18 0.7867 . ?
C19 H19 1.0961 . ?
C20 N8 1.458(8) . ?
C20 C21 1.503(10) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 N8 1.474(8) . ?
C22 C23 1.526(10) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C25 1.494(8) . ?
C24 H1B1 0.9800 . ?
C24 H1B2 0.9800 . ?
C24 H1B3 0.9800 . ?
C25 N9 1.316(8) . ?
C25 C26 1.418(8) . ?
C26 C27 1.360(8) . ?
C26 H3B 0.9248 . ?
C27 N10 1.372(7) . ?
C27 C28 1.490(8) . ?
C28 H5B1 0.9800 . ?
C28 H5B2 0.9800 . ?
C28 H5B3 0.9800 . ?
C29 N14 1.312(7) . ?
C29 N11 1.332(7) . ?
C29 N10 1.410(7) . ?
C30 N14 1.351(7) . ?
C30 N15 1.363(7) . ?
C30 C37 1.446(7) . ?
C31 N15 1.325(7) . ?
C31 N11 1.328(7) . ?
C31 N12 1.392(7) . ?
C32 C33 1.490(8) . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 C34 1.369(8) . ?
C33 N12 1.394(8) . ?
C34 C35 1.395(9) . ?
C34 H34 0.9965 . ?
C35 N13 1.335(8) . ?
C35 C36 1.487(8) . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 C42 1.406(8) . ?
C37 C38 1.410(8) . ?
C38 C39 1.372(8) . ?
C38 H38 0.9429 . ?
C39 C40 1.413(8) . ?
C39 H39 0.8123 . ?
C40 N16 1.363(7) . ?
C40 C41 1.426(8) . ?
C41 C42 1.373(8) . ?
C41 H41 0.9082 . ?
C42 H42 0.9138 . ?
C43 N16 1.466(8) . ?
C43 C44 1.511(9) . ?
C43 H43A 0.9900 . ?
C43 H43B 0.9900 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 N16 1.463(8) . ?
C45 C46 1.518(9) . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C46 H46C 0.9800 . ?
C47 F3 1.323(8) . ?
C47 F1 1.335(8) . ?
C47 F2 1.338(8) . ?
C47 C48 1.492(10) . ?
C48 N17 1.331(8) . ?
C48 C49 1.383(9) . ?
C49 C50 1.385(9) . ?
C49 H49 0.8523 . ?
C50 N18 1.348(8) . ?
C50 C51 1.467(10) . ?
C51 F4 1.272(9) . ?
C51 F6 1.298(9) . ?
C51 F5 1.326(10) . ?
Ag1 N17 2.181(5) . ?
Ag1 N1 2.276(4) . ?
Ag1 N3 2.436(5) . ?
Ag1 Ag2 3.089(6) . ?
Ag2 N18 2.145(6) . ?
Ag2 N13 2.225(7) . ?
Ag2 N11 2.422(5) . ?
Ag2' N18 2.330(11) . ?
Ag2' N11 2.440(8) . ?
Ag2' N9 2.451(10) . ?
Ag2' N13 2.517(16) . ?
N1 N2 1.390(6) . ?
N4 N5 1.382(6) . ?
N9 N10 1.401(6) . ?
N12 N13 1.381(6) . ?
N17 N18 1.349(8) . ?
C52 F9 1.324(7) . ?
C52 F8 1.328(8) . ?
C52 F7 1.339(9) . ?
C52 C53 1.483(9) . ?
C53 N19 1.339(7) . ?
C53 C54 1.364(9) . ?
C54 C55 1.380(9) . ?
C54 H54 0.8750 . ?
C55 N20 1.323(8) . ?
C55 C56 1.495(9) . ?
C56 F11 1.308(8) . ?
C56 F10 1.316(9) . ?
C56 F12 1.335(9) . ?
C57 F14 1.329(8) . ?
C57 F13 1.333(7) . ?
C57 F15 1.337(7) . ?
C57 C58 1.495(8) . ?
C58 N21 1.349(7) . ?
C58 C59 1.376(9) . ?
C59 C60 1.383(9) . ?
C59 H59 0.9252 . ?
C60 N22 1.337(8) . ?
C60 C61 1.486(9) . ?
C61 F16 1.326(8) . ?
C61 F18 1.328(8) . ?
C61 F17 1.336(8) . ?
C62 F20 1.303(8) . ?
C62 F19 1.319(8) . ?
C62 F21 1.352(9) . ?
C62 C63 1.481(8) . ?
C63 N23 1.343(7) . ?
C63 C64 1.375(8) . ?
C64 C65 1.376(8) . ?
C64 H64 0.7750 . ?
C65 N24 1.325(7) . ?
C65 C66 1.478(9) . ?
C66 F23 1.337(7) . ?
C66 F22 1.339(7) . ?
C66 F24 1.342(8) . ?
C67 F25 1.340(7) . ?
C67 F27 1.341(7) . ?
C67 F26 1.362(7) . ?
C67 C68 1.467(8) . ?
C68 N25 1.344(7) . ?
C68 C69 1.379(8) . ?
C69 C70 1.392(8) . ?
C69 H69 0.8056 . ?
C70 N26 1.351(8) . ?
C70 C71 1.469(8) . ?
C71 F29 1.323(8) . ?
C71 F30 1.333(7) . ?
C71 F28 1.335(8) . ?
C72 F33 1.316(7) . ?
C72 F31 1.318(7) . ?
C72 F32 1.342(7) . ?
C72 C73 1.498(8) . ?
C73 N27 1.337(7) . ?
C73 C74 1.380(8) . ?
C74 C75 1.389(8) . ?
C74 H74 0.9144 . ?
C75 N28 1.353(8) . ?
C75 C76 1.484(8) . ?
C76 F36 1.321(7) . ?
C76 F34 1.325(7) . ?
C76 F35 1.325(7) . ?
C77 F38 1.328(7) . ?
C77 F37 1.335(7) . ?
C77 F39 1.350(7) . ?
C77 C78 1.489(8) . ?
C78 N29 1.346(7) . ?
C78 C79 1.378(8) . ?
C79 C80 1.376(8) . ?
C79 H79 0.8210 . ?
C80 N30 1.349(7) . ?
C80 C81 1.472(9) . ?
C81 F42 1.322(8) . ?
C81 F40 1.326(8) . ?
C81 F41 1.345(8) . ?
C82 N31 1.140(9) . ?
C82 C83 1.447(10) . ?
C83 H83A 0.9800 . ?
C83 H83B 0.9800 . ?
C83 H83C 0.9800 . ?
Ag3 N26 2.253(5) . ?
Ag3 N24 2.262(5) . ?
Ag3 N31 2.306(7) . ?
Ag3 N29 2.512(5) . ?
Ag4 N25 2.129(5) . ?
Ag4 N19 2.152(5) . ?
Ag4 N29 2.535(5) . ?
Ag4 Ag5 3.2223(7) . ?
Ag5 N20 2.198(5) . ?
Ag5 N27 2.233(5) . ?
Ag5 N21 2.311(5) . ?
Ag6 N28 2.082(5) . ?
Ag6 N23 2.092(5) . ?
Ag7 N30 2.089(5) . ?
Ag7 N22 2.103(5) . ?
N19 N20 1.343(7) . ?
N21 N22 1.363(7) . ?
N23 N24 1.366(6) . ?
N25 N26 1.354(6) . ?
N27 N28 1.351(7) . ?
N29 N30 1.365(7) . ?

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
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
H1A C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
N1 C2 C3 110.6(5) . . ?
N1 C2 C1 121.3(5) . . ?
C3 C2 C1 128.0(5) . . ?
C4 C3 C2 107.1(5) . . ?
C4 C3 H3 126.5 . . ?
C2 C3 H3 126.5 . . ?
C3 C4 N2 105.8(5) . . ?
C3 C4 C5 128.4(5) . . ?
N2 C4 C5 125.8(5) . . ?
C4 C5 H5A 109.5 . . ?
C4 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
C4 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
N3 C6 N6 127.6(5) . . ?
N3 C6 N2 115.4(5) . . ?
N6 C6 N2 117.0(5) . . ?
N7 C7 N6 124.2(5) . . ?
N7 C7 C14 117.9(5) . . ?
N6 C7 C14 117.9(5) . . ?
N7 C8 N3 125.6(5) . . ?
N7 C8 N4 117.8(5) . . ?
N3 C8 N4 116.6(5) . . ?
C10 C9 H9A 109.5 . . ?
C10 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C10 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C11 C10 N4 106.1(5) . . ?
C11 C10 C9 128.0(5) . . ?
N4 C10 C9 125.9(5) . . ?
C10 C11 C12 106.8(5) . . ?
C10 C11 H11 126.6 . . ?
C12 C11 H11 126.6 . . ?
N5 C12 C11 110.3(5) . . ?
N5 C12 C13 120.7(5) . . ?
C11 C12 C13 129.0(5) . . ?
C12 C13 H12A 109.5 . . ?
C12 C13 H12B 109.5 . . ?
H12A C13 H12B 109.5 . . ?
C12 C13 H12C 109.5 . . ?
H12A C13 H12C 109.5 . . ?
H12B C13 H12C 109.5 . . ?
C15 C14 C19 117.3(5) . . ?
C15 C14 C7 121.3(5) . . ?
C19 C14 C7 121.3(5) . . ?
C16 C15 C14 121.7(6) . . ?
C16 C15 H15 119.2 . . ?
C14 C15 H15 119.2 . . ?
C15 C16 C17 121.4(6) . . ?
C15 C16 H16 119.3 . . ?
C17 C16 H16 119.3 . . ?
N8 C17 C18 121.7(6) . . ?
N8 C17 C16 121.8(5) . . ?
C18 C17 C16 116.6(5) . . ?
C19 C18 C17 121.7(6) . . ?
C19 C18 H18 119.2 . . ?
C17 C18 H18 119.2 . . ?
C18 C19 C14 121.3(5) . . ?
C18 C19 H19 119.3 . . ?
C14 C19 H19 119.3 . . ?
N8 C20 C21 114.4(6) . . ?
N8 C20 H20A 108.7 . . ?
C21 C20 H20A 108.7 . . ?
N8 C20 H20B 108.7 . . ?
C21 C20 H20B 108.7 . . ?
H20A C20 H20B 107.6 . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
N8 C22 C23 112.7(5) . . ?
N8 C22 H22A 109.1 . . ?
C23 C22 H22A 109.1 . . ?
N8 C22 H22B 109.1 . . ?
C23 C22 H22B 109.1 . . ?
H22A C22 H22B 107.8 . . ?
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 . . ?
C25 C24 H1B1 109.5 . . ?
C25 C24 H1B2 109.5 . . ?
H1B1 C24 H1B2 109.5 . . ?
C25 C24 H1B3 109.5 . . ?
H1B1 C24 H1B3 109.5 . . ?
H1B2 C24 H1B3 109.5 . . ?
N9 C25 C26 111.4(5) . . ?
N9 C25 C24 121.0(5) . . ?
C26 C25 C24 127.7(6) . . ?
C27 C26 C25 106.9(5) . . ?
C27 C26 H3B 126.6 . . ?
C25 C26 H3B 126.6 . . ?
C26 C27 N10 105.8(5) . . ?
C26 C27 C28 128.8(6) . . ?
N10 C27 C28 125.4(5) . . ?
C27 C28 H5B1 109.5 . . ?
C27 C28 H5B2 109.5 . . ?
H5B1 C28 H5B2 109.5 . . ?
C27 C28 H5B3 109.5 . . ?
H5B1 C28 H5B3 109.5 . . ?
H5B2 C28 H5B3 109.5 . . ?
N14 C29 N11 126.6(5) . . ?
N14 C29 N10 117.9(5) . . ?
N11 C29 N10 115.5(5) . . ?
N14 C30 N15 124.0(5) . . ?
N14 C30 C37 118.7(5) . . ?
N15 C30 C37 117.4(5) . . ?
N15 C31 N11 126.1(5) . . ?
N15 C31 N12 117.6(5) . . ?
N11 C31 N12 116.3(5) . . ?
C33 C32 H32A 109.5 . . ?
C33 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C33 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C34 C33 N12 105.0(5) . . ?
C34 C33 C32 129.4(6) . . ?
N12 C33 C32 125.5(5) . . ?
C33 C34 C35 107.9(5) . . ?
C33 C34 H34 126.0 . . ?
C35 C34 H34 126.0 . . ?
N13 C35 C34 110.6(5) . . ?
N13 C35 C36 119.8(6) . . ?
C34 C35 C36 129.6(6) . . ?
C35 C36 H36A 109.5 . . ?
C35 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C35 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C42 C37 C38 117.5(5) . . ?
C42 C37 C30 120.9(5) . . ?
C38 C37 C30 121.6(5) . . ?
C39 C38 C37 121.6(5) . . ?
C39 C38 H38 119.2 . . ?
C37 C38 H38 119.2 . . ?
C38 C39 C40 121.3(5) . . ?
C38 C39 H39 119.3 . . ?
C40 C39 H39 119.3 . . ?
N16 C40 C39 121.4(5) . . ?
N16 C40 C41 121.7(5) . . ?
C39 C40 C41 116.9(5) . . ?
C42 C41 C40 121.3(5) . . ?
C42 C41 H41 119.4 . . ?
C40 C41 H41 119.4 . . ?
C41 C42 C37 121.4(5) . . ?
C41 C42 H42 119.3 . . ?
C37 C42 H42 119.3 . . ?
N16 C43 C44 113.8(5) . . ?
N16 C43 H43A 108.8 . . ?
C44 C43 H43A 108.8 . . ?
N16 C43 H43B 108.8 . . ?
C44 C43 H43B 108.8 . . ?
H43A C43 H43B 107.7 . . ?
C43 C44 H44A 109.5 . . ?
C43 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
C43 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
N16 C45 C46 112.5(5) . . ?
N16 C45 H45A 109.1 . . ?
C46 C45 H45A 109.1 . . ?
N16 C45 H45B 109.1 . . ?
C46 C45 H45B 109.1 . . ?
H45A C45 H45B 107.8 . . ?
C45 C46 H46A 109.5 . . ?
C45 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
C45 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
F3 C47 F1 107.4(6) . . ?
F3 C47 F2 106.4(6) . . ?
F1 C47 F2 105.7(6) . . ?
F3 C47 C48 111.6(6) . . ?
F1 C47 C48 112.9(6) . . ?
F2 C47 C48 112.4(6) . . ?
N17 C48 C49 110.9(6) . . ?
N17 C48 C47 120.0(6) . . ?
C49 C48 C47 129.0(6) . . ?
C48 C49 C50 102.9(6) . . ?
C48 C49 H49 128.6 . . ?
C50 C49 H49 128.6 . . ?
N18 C50 C49 110.8(6) . . ?
N18 C50 C51 120.0(6) . . ?
C49 C50 C51 129.1(6) . . ?
F4 C51 F6 110.4(8) . . ?
F4 C51 F5 102.8(8) . . ?
F6 C51 F5 101.3(7) . . ?
F4 C51 C50 113.4(7) . . ?
F6 C51 C50 115.0(6) . . ?
F5 C51 C50 112.7(7) . . ?
N17 Ag1 N1 142.96(18) . . ?
N17 Ag1 N3 149.34(17) . . ?
N1 Ag1 N3 67.65(16) . . ?
N17 Ag1 Ag2 63.75(15) . . ?
N1 Ag1 Ag2 122.45(17) . . ?
N3 Ag1 Ag2 101.15(13) . . ?
N18 Ag2 N13 137.3(5) . . ?
N18 Ag2 N11 133.9(2) . . ?
N13 Ag2 N11 69.10(17) . . ?
N18 Ag2 Ag1 68.7(2) . . ?
N13 Ag2 Ag1 98.3(3) . . ?
N11 Ag2 Ag1 70.61(14) . . ?
N18 Ag2' N11 123.6(7) . . ?
N18 Ag2' N9 87.3(2) . . ?
N11 Ag2' N9 64.93(19) . . ?
N18 Ag2' N13 114.1(9) . . ?
N11 Ag2' N13 64.3(3) . . ?
N9 Ag2' N13 128.6(4) . . ?
C2 N1 N2 105.9(4) . . ?
C2 N1 Ag1 134.1(4) . . ?
N2 N1 Ag1 119.9(3) . . ?
C4 N2 N1 110.6(4) . . ?
C4 N2 C6 130.9(5) . . ?
N1 N2 C6 118.4(4) . . ?
C6 N3 C8 113.5(5) . . ?
C6 N3 Ag1 118.4(4) . . ?
C8 N3 Ag1 128.0(4) . . ?
N5 N4 C10 111.6(4) . . ?
N5 N4 C8 118.1(4) . . ?
C10 N4 C8 129.9(5) . . ?
C12 N5 N4 105.1(4) . . ?
C6 N6 C7 113.7(5) . . ?
C8 N7 C7 115.3(5) . . ?
C17 N8 C20 122.0(5) . . ?
C17 N8 C22 121.1(5) . . ?
C20 N8 C22 116.4(5) . . ?
C25 N9 N10 104.3(5) . . ?
C25 N9 Ag2' 135.5(5) . . ?
N10 N9 Ag2' 117.2(4) . . ?
C27 N10 N9 111.7(5) . . ?
C27 N10 C29 131.2(5) . . ?
N9 N10 C29 117.1(5) . . ?
C31 N11 C29 114.2(5) . . ?
C31 N11 Ag2 115.7(4) . . ?
C29 N11 Ag2 130.0(4) . . ?
C31 N11 Ag2' 123.2(5) . . ?
C29 N11 Ag2' 121.9(5) . . ?
Ag2 N11 Ag2' 13.0(3) . . ?
N13 N12 C31 118.6(5) . . ?
N13 N12 C33 111.1(4) . . ?
C31 N12 C33 130.3(5) . . ?
C35 N13 N12 105.3(5) . . ?
C35 N13 Ag2 134.5(4) . . ?
N12 N13 Ag2 119.3(4) . . ?
C35 N13 Ag2' 137.3(4) . . ?
N12 N13 Ag2' 117.2(4) . . ?
Ag2 N13 Ag2' 11.33(18) . . ?
C29 N14 C30 114.7(5) . . ?
C31 N15 C30 114.3(5) . . ?
C40 N16 C45 121.6(5) . . ?
C40 N16 C43 121.3(5) . . ?
C45 N16 C43 116.3(5) . . ?
C48 N17 N18 108.4(5) . . ?
C48 N17 Ag1 133.4(5) . . ?
N18 N17 Ag1 117.8(4) . . ?
C50 N18 N17 107.0(5) . . ?
C50 N18 Ag2 143.6(5) . . ?
N17 N18 Ag2 109.3(4) . . ?
C50 N18 Ag2' 134.9(6) . . ?
N17 N18 Ag2' 115.7(4) . . ?
Ag2 N18 Ag2' 13.3(3) . . ?
F9 C52 F8 107.6(6) . . ?
F9 C52 F7 105.2(6) . . ?
F8 C52 F7 106.0(6) . . ?
F9 C52 C53 111.6(6) . . ?
F8 C52 C53 113.8(6) . . ?
F7 C52 C53 112.2(6) . . ?
N19 C53 C54 110.4(6) . . ?
N19 C53 C52 120.4(6) . . ?
C54 C53 C52 129.2(6) . . ?
C53 C54 C55 103.4(6) . . ?
C53 C54 H54 128.3 . . ?
C55 C54 H54 128.3 . . ?
N20 C55 C54 110.8(6) . . ?
N20 C55 C56 120.4(6) . . ?
C54 C55 C56 128.7(6) . . ?
F11 C56 F10 108.0(7) . . ?
F11 C56 F12 105.4(6) . . ?
F10 C56 F12 104.5(7) . . ?
F11 C56 C55 113.2(6) . . ?
F10 C56 C55 112.4(6) . . ?
F12 C56 C55 112.7(6) . . ?
F14 C57 F13 106.3(6) . . ?
F14 C57 F15 107.0(5) . . ?
F13 C57 F15 107.5(5) . . ?
F14 C57 C58 112.6(5) . . ?
F13 C57 C58 112.5(5) . . ?
F15 C57 C58 110.5(5) . . ?
N21 C58 C59 111.6(6) . . ?
N21 C58 C57 120.0(5) . . ?
C59 C58 C57 128.5(6) . . ?
C58 C59 C60 103.3(5) . . ?
C58 C59 H59 128.3 . . ?
C60 C59 H59 128.3 . . ?
N22 C60 C59 110.4(6) . . ?
N22 C60 C61 122.5(6) . . ?
C59 C60 C61 127.1(6) . . ?
F16 C61 F18 106.8(6) . . ?
F16 C61 F17 106.1(6) . . ?
F18 C61 F17 105.8(6) . . ?
F16 C61 C60 112.9(6) . . ?
F18 C61 C60 113.6(5) . . ?
F17 C61 C60 111.2(6) . . ?
F20 C62 F19 110.3(6) . . ?
F20 C62 F21 104.1(6) . . ?
F19 C62 F21 102.8(6) . . ?
F20 C62 C63 112.4(6) . . ?
F19 C62 C63 114.7(6) . . ?
F21 C62 C63 111.6(6) . . ?
N23 C63 C64 110.6(5) . . ?
N23 C63 C62 119.8(5) . . ?
C64 C63 C62 129.5(6) . . ?
C63 C64 C65 103.6(5) . . ?
C63 C64 H64 128.2 . . ?
C65 C64 H64 128.2 . . ?
N24 C65 C64 111.1(5) . . ?
N24 C65 C66 121.2(5) . . ?
C64 C65 C66 127.6(5) . . ?
F23 C66 F22 107.8(5) . . ?
F23 C66 F24 105.8(5) . . ?
F22 C66 F24 105.1(5) . . ?
F23 C66 C65 111.9(5) . . ?
F22 C66 C65 112.6(5) . . ?
F24 C66 C65 113.2(5) . . ?
F25 C67 F27 106.8(5) . . ?
F25 C67 F26 105.2(5) . . ?
F27 C67 F26 106.0(5) . . ?
F25 C67 C68 113.8(5) . . ?
F27 C67 C68 112.3(5) . . ?
F26 C67 C68 112.1(5) . . ?
N25 C68 C69 110.0(5) . . ?
N25 C68 C67 121.7(5) . . ?
C69 C68 C67 128.1(5) . . ?
C68 C69 C70 103.7(5) . . ?
C68 C69 H69 128.1 . . ?
C70 C69 H69 128.1 . . ?
N26 C70 C69 110.6(5) . . ?
N26 C70 C71 120.2(6) . . ?
C69 C70 C71 129.2(6) . . ?
F29 C71 F30 106.0(6) . . ?
F29 C71 F28 106.9(6) . . ?
F30 C71 F28 106.3(5) . . ?
F29 C71 C70 112.7(5) . . ?
F30 C71 C70 112.2(6) . . ?
F28 C71 C70 112.2(5) . . ?
F33 C72 F31 108.3(6) . . ?
F33 C72 F32 105.4(5) . . ?
F31 C72 F32 105.9(5) . . ?
F33 C72 C73 111.9(5) . . ?
F31 C72 C73 114.2(5) . . ?
F32 C72 C73 110.5(5) . . ?
N27 C73 C74 111.1(5) . . ?
N27 C73 C72 121.0(5) . . ?
C74 C73 C72 127.8(5) . . ?
C73 C74 C75 103.4(5) . . ?
C73 C74 H74 128.3 . . ?
C75 C74 H74 128.3 . . ?
N28 C75 C74 109.9(5) . . ?
N28 C75 C76 121.6(5) . . ?
C74 C75 C76 128.3(5) . . ?
F36 C76 F34 106.4(5) . . ?
F36 C76 F35 107.5(6) . . ?
F34 C76 F35 106.1(5) . . ?
F36 C76 C75 113.2(5) . . ?
F34 C76 C75 112.4(5) . . ?
F35 C76 C75 110.8(5) . . ?
F38 C77 F37 108.0(5) . . ?
F38 C77 F39 105.9(5) . . ?
F37 C77 F39 105.9(5) . . ?
F38 C77 C78 112.0(5) . . ?
F37 C77 C78 112.2(5) . . ?
F39 C77 C78 112.5(5) . . ?
N29 C78 C79 110.7(5) . . ?
N29 C78 C77 120.9(5) . . ?
C79 C78 C77 128.3(5) . . ?
C80 C79 C78 104.6(5) . . ?
C80 C79 H79 127.7 . . ?
C78 C79 H79 127.7 . . ?
N30 C80 C79 109.6(5) . . ?
N30 C80 C81 120.7(5) . . ?
C79 C80 C81 129.7(5) . . ?
F42 C81 F40 107.3(6) . . ?
F42 C81 F41 104.9(6) . . ?
F40 C81 F41 107.3(6) . . ?
F42 C81 C80 114.5(5) . . ?
F40 C81 C80 111.0(6) . . ?
F41 C81 C80 111.4(6) . . ?
N31 C82 C83 179.7(8) . . ?
C82 C83 H83A 109.5 . . ?
C82 C83 H83B 109.5 . . ?
H83A C83 H83B 109.5 . . ?
C82 C83 H83C 109.5 . . ?
H83A C83 H83C 109.5 . . ?
H83B C83 H83C 109.5 . . ?
N26 Ag3 N24 120.26(17) . . ?
N26 Ag3 N31 111.4(2) . . ?
N24 Ag3 N31 114.3(2) . . ?
N26 Ag3 N29 99.12(17) . . ?
N24 Ag3 N29 110.47(17) . . ?
N31 Ag3 N29 97.6(2) . . ?
N25 Ag4 N19 153.02(18) . . ?
N25 Ag4 N29 103.34(17) . . ?
N19 Ag4 N29 102.63(18) . . ?
N25 Ag4 Ag5 95.72(13) . . ?
N19 Ag4 Ag5 65.56(13) . . ?
N29 Ag4 Ag5 117.46(11) . . ?
N20 Ag5 N27 140.41(18) . . ?
N20 Ag5 N21 120.91(18) . . ?
N27 Ag5 N21 98.64(17) . . ?
N20 Ag5 Ag4 63.07(14) . . ?
N27 Ag5 Ag4 98.16(12) . . ?
N21 Ag5 Ag4 118.48(12) . . ?
N28 Ag6 N23 173.67(18) . . ?
N30 Ag7 N22 176.8(2) . . ?
C53 N19 N20 107.8(5) . . ?
C53 N19 Ag4 137.9(4) . . ?
N20 N19 Ag4 114.2(4) . . ?
C55 N20 N19 107.6(5) . . ?
C55 N20 Ag5 135.5(4) . . ?
N19 N20 Ag5 116.6(4) . . ?
C58 N21 N22 106.1(5) . . ?
C58 N21 Ag5 132.4(4) . . ?
N22 N21 Ag5 121.0(3) . . ?
C60 N22 N21 108.6(5) . . ?
C60 N22 Ag7 133.6(4) . . ?
N21 N22 Ag7 117.2(4) . . ?
C63 N23 N24 107.0(5) . . ?
C63 N23 Ag6 130.1(4) . . ?
N24 N23 Ag6 122.6(4) . . ?
C65 N24 N23 107.6(5) . . ?
C65 N24 Ag3 133.2(4) . . ?
N23 N24 Ag3 116.1(3) . . ?
C68 N25 N26 108.8(5) . . ?
C68 N25 Ag4 132.3(4) . . ?
N26 N25 Ag4 118.5(4) . . ?
C70 N26 N25 106.8(5) . . ?
C70 N26 Ag3 130.5(4) . . ?
N25 N26 Ag3 122.1(4) . . ?
C73 N27 N28 107.7(5) . . ?
C73 N27 Ag5 132.5(4) . . ?
N28 N27 Ag5 119.8(4) . . ?
N27 N28 C75 107.9(5) . . ?
N27 N28 Ag6 121.1(4) . . ?
C75 N28 Ag6 131.1(4) . . ?
C78 N29 N30 106.8(5) . . ?
C78 N29 Ag3 117.5(4) . . ?
N30 N29 Ag3 104.8(3) . . ?
C78 N29 Ag4 126.5(4) . . ?
N30 N29 Ag4 109.0(3) . . ?
Ag3 N29 Ag4 89.86(16) . . ?
C80 N30 N29 108.4(5) . . ?
C80 N30 Ag7 131.5(4) . . ?
N29 N30 Ag7 120.1(4) . . ?
C82 N31 Ag3 167.0(6) . . ?

_diffrn_measured_fraction_theta_max 0.983
_diffrn_reflns_theta_full        26.00
_diffrn_measured_fraction_theta_full 0.983
_refine_diff_density_max         1.270
_refine_diff_density_min         -0.966
_refine_diff_density_rms         0.166