# Electronic Supplementary Material (ESI) for Dalton Transactions # This journal is © The Royal Society of Chemistry 2013 ####################################################################### # # 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_compound-1 _database_code_depnum_ccdc_archive 'CCDC 899315' #TrackingRef 'c-1.cif' _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'C8 H3 Ag3 N2 O5' _chemical_formula_weight 530.73 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' 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 C2/c loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y, -z+1/2' 'x+1/2, y+1/2, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y, z-1/2' '-x+1/2, -y+1/2, -z' 'x+1/2, -y+1/2, z-1/2' _cell_length_a 12.0085(15) _cell_length_b 15.0727(19) _cell_length_c 12.100(2) _cell_angle_alpha 90.00 _cell_angle_beta 111.686(2) _cell_angle_gamma 90.00 _cell_volume 2035.1(5) _cell_formula_units_Z 8 _cell_measurement_temperature 273(2) _cell_measurement_reflns_used 1665 _cell_measurement_theta_min 2.27 _cell_measurement_theta_max 22.67 _exptl_crystal_description plate _exptl_crystal_colour colorless _exptl_crystal_size_max 0.15 _exptl_crystal_size_mid 0.10 _exptl_crystal_size_min 0.05 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 3.464 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 1968 _exptl_absorpt_coefficient_mu 5.730 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.513 _exptl_absorpt_correction_T_max 0.762 _exptl_absorpt_process_details sadabs _exptl_special_details ; ? ; _diffrn_ambient_temperature 273(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 5710 _diffrn_reflns_av_R_equivalents 0.0337 _diffrn_reflns_av_sigmaI/netI 0.0298 _diffrn_reflns_limit_h_min -12 _diffrn_reflns_limit_h_max 13 _diffrn_reflns_limit_k_min -16 _diffrn_reflns_limit_k_max 16 _diffrn_reflns_limit_l_min -13 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_theta_min 2.70 _diffrn_reflns_theta_max 22.78 _reflns_number_total 1370 _reflns_number_gt 1166 _reflns_threshold_expression >2sigma(I) _computing_data_collection 'Bruker SMART' _computing_cell_refinement 'Bruker SMART' _computing_data_reduction 'Bruker SAIT' _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. One oxygen atom O4 is disordered over two positions with site occupancy ratios of 0.5:0.5. The length of carbon-carbon triple bond(C6-C7) was restrained in the reasonable range. ; _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^)+(0.0567P)^2^+25.1620P] 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 SHELXL _refine_ls_extinction_coef 0.00005(11) _refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^ _refine_ls_number_reflns 1370 _refine_ls_number_parameters 175 _refine_ls_number_restraints 37 _refine_ls_R_factor_all 0.0397 _refine_ls_R_factor_gt 0.0315 _refine_ls_wR_factor_ref 0.0987 _refine_ls_wR_factor_gt 0.0888 _refine_ls_goodness_of_fit_ref 1.036 _refine_ls_restrained_S_all 1.025 _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_symmetry_multiplicity _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_assembly _atom_site_disorder_group Ag3 Ag 0.33907(6) 0.60740(4) 0.66231(6) 0.0328(3) Uani 1 1 d . . . Ag2 Ag 0.2500 0.7500 0.5000 0.0430(4) Uani 1 2 d S . . C7 C 0.2213(8) 0.7150(6) 0.6589(8) 0.032(2) Uani 1 1 d D . . C6 C 0.1927(7) 0.7570(5) 0.7281(7) 0.0239(19) Uani 1 1 d D . . C4 C 0.1602(7) 0.8130(5) 0.8084(7) 0.0203(18) Uani 1 1 d U . . C3 C 0.1231(7) 0.7827(5) 0.8986(7) 0.0224(18) Uani 1 1 d U . . H3 H 0.1180 0.7221 0.9104 0.027 Uiso 1 1 calc R . . Ag4 Ag 0.5000 0.78966(7) 0.7500 0.0531(4) Uani 1 2 d S . . Ag1 Ag 0.07428(7) 0.61588(5) 0.57413(8) 0.0530(3) Uani 1 1 d . . . O1 O 0.0410(5) 0.7340(4) 1.0833(5) 0.0288(14) Uani 1 1 d . . . O2 O 0.0250(5) 0.8769(4) 1.1205(5) 0.0307(14) Uani 1 1 d . . . O3 O 0.1612(10) 0.5738(6) 0.3594(10) 0.092(3) Uani 1 1 d . . . N1 N 0.1448(6) 0.9630(5) 0.8659(6) 0.0307(17) Uani 1 1 d . . . C8 C 0.0492(7) 0.8154(5) 1.0657(7) 0.0210(18) Uani 1 1 d . . . N2 N 0.1188(7) 0.5027(6) 0.3713(8) 0.046(2) Uani 1 1 d U . . O5 O 0.1433(10) 0.4365(7) 0.3276(10) 0.104(4) Uani 1 1 d . . . C1 C 0.1084(7) 0.9318(5) 0.9515(8) 0.027(2) Uani 1 1 d . . . H1 H 0.0920 0.9728 1.0009 0.033 Uiso 1 1 calc R . . C2 C 0.0940(7) 0.8429(5) 0.9703(7) 0.0213(18) Uani 1 1 d . . . C5 C 0.1707(8) 0.9045(6) 0.7987(8) 0.028(2) Uani 1 1 d U . . H5 H 0.1978 0.9254 0.7409 0.034 Uiso 1 1 calc R . . O4A O 0.0402(15) 0.5129(12) 0.4182(15) 0.079(5) Uani 0.60 1 d PU . . O4B O 0.0826(17) 0.4792(13) 0.4503(17) 0.049(5) Uani 0.40 1 d PU . . 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 Ag3 0.0457(5) 0.0251(4) 0.0335(5) -0.0006(3) 0.0216(4) 0.0094(3) Ag2 0.0584(7) 0.0471(7) 0.0366(7) 0.0170(5) 0.0329(6) 0.0147(5) C7 0.032(5) 0.027(5) 0.036(6) 0.002(4) 0.013(4) 0.002(4) C6 0.034(5) 0.022(4) 0.020(5) 0.000(4) 0.014(4) -0.006(4) C4 0.024(4) 0.025(4) 0.017(4) 0.001(3) 0.014(3) 0.004(3) C3 0.026(4) 0.023(4) 0.022(4) 0.002(3) 0.014(3) 0.007(3) Ag4 0.1034(10) 0.0352(7) 0.0442(7) 0.000 0.0547(7) 0.000 Ag1 0.0450(5) 0.0352(5) 0.0708(7) -0.0077(4) 0.0122(4) -0.0116(3) O1 0.047(4) 0.025(4) 0.023(3) 0.000(3) 0.023(3) -0.003(3) O2 0.043(4) 0.032(3) 0.024(3) -0.003(3) 0.021(3) 0.002(3) O3 0.122(8) 0.050(5) 0.127(9) 0.002(5) 0.072(7) -0.027(5) N1 0.042(4) 0.021(4) 0.036(5) 0.005(3) 0.022(4) 0.005(3) C8 0.019(4) 0.026(5) 0.018(4) -0.005(4) 0.007(4) 0.000(3) N2 0.047(2) 0.047(2) 0.047(2) -0.0005(10) 0.0181(12) -0.0002(10) O5 0.118(8) 0.058(6) 0.116(9) -0.027(6) 0.018(7) 0.027(6) C1 0.033(5) 0.024(5) 0.027(5) -0.001(4) 0.013(4) -0.001(4) C2 0.025(4) 0.026(4) 0.016(4) 0.001(4) 0.011(3) 0.005(4) C5 0.036(5) 0.032(4) 0.028(5) 0.005(4) 0.026(4) 0.001(4) O4A 0.079(5) 0.079(5) 0.079(5) -0.0005(11) 0.029(2) -0.0003(11) O4B 0.049(5) 0.049(5) 0.049(5) 0.0005(11) 0.018(2) -0.0007(11) _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 Ag3 C7 2.141(8) . ? Ag3 N1 2.223(7) 4_546 ? Ag3 O2 2.476(6) 8_565 ? Ag3 O2 2.541(6) 7_567 ? Ag3 Ag2 2.8405(7) . ? Ag3 Ag1 2.9593(11) . ? Ag3 Ag4 3.3002(12) . ? Ag2 C7 2.140(9) 7_566 ? Ag2 C7 2.140(9) . ? Ag2 Ag3 2.8406(7) 7_566 ? Ag2 Ag1 3.2775(9) 7_566 ? Ag2 Ag1 3.2776(9) . ? C7 C6 1.198(8) . ? C7 Ag1 2.250(9) . ? C6 C4 1.445(11) . ? C4 C5 1.393(12) . ? C4 C3 1.399(11) . ? C3 C2 1.387(11) . ? C3 H3 0.9300 . ? Ag4 O1 2.274(5) 7_567 ? Ag4 O1 2.274(5) 8_565 ? Ag4 Ag3 3.3002(12) 2_656 ? Ag1 O4B 2.298(18) 5_566 ? Ag1 O4A 2.359(17) . ? Ag1 O4A 2.401(17) 5_566 ? Ag1 O4B 2.571(19) . ? O1 C8 1.255(10) . ? O1 Ag4 2.274(5) 7_567 ? O2 C8 1.235(9) . ? O2 Ag3 2.476(6) 8_466 ? O2 Ag3 2.541(6) 7_567 ? O3 N2 1.218(12) . ? N1 C5 1.312(11) . ? N1 C1 1.348(11) . ? N1 Ag3 2.223(7) 4_556 ? C8 C2 1.501(11) . ? N2 O5 1.215(12) . ? N2 O4B 1.24(2) . ? N2 O4A 1.277(18) . ? C1 C2 1.382(12) . ? C1 H1 0.9300 . ? C5 H5 0.9300 . ? O4A O4B 0.72(2) . ? O4A Ag1 2.401(17) 5_566 ? O4B Ag1 2.298(18) 5_566 ? 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 C7 Ag3 N1 146.4(3) . 4_546 ? C7 Ag3 O2 124.2(3) . 8_565 ? N1 Ag3 O2 85.7(2) 4_546 8_565 ? C7 Ag3 O2 96.7(3) . 7_567 ? N1 Ag3 O2 101.0(2) 4_546 7_567 ? O2 Ag3 O2 85.38(19) 8_565 7_567 ? C7 Ag3 Ag2 48.4(2) . . ? N1 Ag3 Ag2 131.81(19) 4_546 . ? O2 Ag3 Ag2 85.65(13) 8_565 . ? O2 Ag3 Ag2 125.36(13) 7_567 . ? C7 Ag3 Ag1 49.2(2) . . ? N1 Ag3 Ag1 97.46(19) 4_546 . ? O2 Ag3 Ag1 148.42(14) 8_565 . ? O2 Ag3 Ag1 124.26(13) 7_567 . ? Ag2 Ag3 Ag1 68.79(2) . . ? C7 Ag3 Ag4 71.3(2) . . ? N1 Ag3 Ag4 142.24(19) 4_546 . ? O2 Ag3 Ag4 61.40(13) 8_565 . ? O2 Ag3 Ag4 60.93(13) 7_567 . ? Ag2 Ag3 Ag4 67.579(19) . . ? Ag1 Ag3 Ag4 120.23(3) . . ? C7 Ag2 C7 179.999(2) 7_566 . ? C7 Ag2 Ag3 131.5(2) 7_566 . ? C7 Ag2 Ag3 48.5(2) . . ? C7 Ag2 Ag3 48.5(2) 7_566 7_566 ? C7 Ag2 Ag3 131.5(2) . 7_566 ? Ag3 Ag2 Ag3 180.0 . 7_566 ? C7 Ag2 Ag1 43.0(2) 7_566 7_566 ? C7 Ag2 Ag1 137.0(2) . 7_566 ? Ag3 Ag2 Ag1 122.68(2) . 7_566 ? Ag3 Ag2 Ag1 57.32(2) 7_566 7_566 ? C7 Ag2 Ag1 137.0(2) 7_566 . ? C7 Ag2 Ag1 43.0(2) . . ? Ag3 Ag2 Ag1 57.32(2) . . ? Ag3 Ag2 Ag1 122.68(2) 7_566 . ? Ag1 Ag2 Ag1 180.00(2) 7_566 . ? C6 C7 Ag2 132.9(7) . . ? C6 C7 Ag3 138.2(8) . . ? Ag2 C7 Ag3 83.1(3) . . ? C6 C7 Ag1 106.9(7) . . ? Ag2 C7 Ag1 96.6(3) . . ? Ag3 C7 Ag1 84.7(3) . . ? C7 C6 C4 176.2(9) . . ? C5 C4 C3 117.0(7) . . ? C5 C4 C6 117.8(7) . . ? C3 C4 C6 125.2(7) . . ? C2 C3 C4 120.1(8) . . ? C2 C3 H3 120.0 . . ? C4 C3 H3 120.0 . . ? O1 Ag4 O1 161.9(3) 7_567 8_565 ? O1 Ag4 Ag3 82.95(15) 7_567 2_656 ? O1 Ag4 Ag3 82.03(14) 8_565 2_656 ? O1 Ag4 Ag3 82.03(15) 7_567 . ? O1 Ag4 Ag3 82.95(15) 8_565 . ? Ag3 Ag4 Ag3 67.31(3) 2_656 . ? C7 Ag1 O4B 160.2(5) . 5_566 ? C7 Ag1 O4A 132.5(5) . . ? O4B Ag1 O4A 66.1(6) 5_566 . ? C7 Ag1 O4A 152.1(5) . 5_566 ? O4B Ag1 O4A 17.5(5) 5_566 5_566 ? O4A Ag1 O4A 64.3(7) . 5_566 ? C7 Ag1 O4B 127.2(5) . . ? O4B Ag1 O4B 68.4(7) 5_566 . ? O4A Ag1 O4B 16.1(5) . . ? O4A Ag1 O4B 61.4(5) 5_566 . ? C7 Ag1 Ag3 46.1(2) . . ? O4B Ag1 Ag3 137.7(5) 5_566 . ? O4A Ag1 Ag3 96.1(4) . . ? O4A Ag1 Ag3 120.4(4) 5_566 . ? O4B Ag1 Ag3 84.7(4) . . ? C7 Ag1 Ag2 40.5(2) . . ? O4B Ag1 Ag2 158.4(5) 5_566 . ? O4A Ag1 Ag2 97.2(4) . . ? O4A Ag1 Ag2 161.0(4) 5_566 . ? O4B Ag1 Ag2 99.6(4) . . ? Ag3 Ag1 Ag2 53.89(2) . . ? C8 O1 Ag4 111.1(5) . 7_567 ? C8 O2 Ag3 126.1(5) . 8_466 ? C8 O2 Ag3 115.8(5) . 7_567 ? Ag3 O2 Ag3 93.60(18) 8_466 7_567 ? C5 N1 C1 117.4(7) . . ? C5 N1 Ag3 120.6(6) . 4_556 ? C1 N1 Ag3 122.0(5) . 4_556 ? O2 C8 O1 126.5(7) . . ? O2 C8 C2 115.3(7) . . ? O1 C8 C2 118.2(7) . . ? O5 N2 O3 119.4(11) . . ? O5 N2 O4B 108.2(13) . . ? O3 N2 O4B 128.6(13) . . ? O5 N2 O4A 129.0(13) . . ? O3 N2 O4A 110.9(12) . . ? O4B N2 O4A 33.3(10) . . ? N1 C1 C2 124.1(8) . . ? N1 C1 H1 117.9 . . ? C2 C1 H1 117.9 . . ? C1 C2 C3 117.1(7) . . ? C1 C2 C8 119.8(7) . . ? C3 C2 C8 123.1(7) . . ? N1 C5 C4 124.3(8) . . ? N1 C5 H5 117.9 . . ? C4 C5 H5 117.9 . . ? O4B O4A N2 70(2) . . ? O4B O4A Ag1 99(2) . . ? N2 O4A Ag1 119.8(11) . . ? O4B O4A Ag1 73(2) . 5_566 ? N2 O4A Ag1 116.6(11) . 5_566 ? Ag1 O4A Ag1 115.7(7) . 5_566 ? O4A O4B N2 76(2) . . ? O4A O4B Ag1 89(2) . 5_566 ? N2 O4B Ag1 125.7(13) . 5_566 ? O4A O4B Ag1 65(2) . . ? N2 O4B Ag1 108.8(12) . . ? Ag1 O4B Ag1 111.6(7) 5_566 . ? _diffrn_measured_fraction_theta_max 0.989 _diffrn_reflns_theta_full 22.78 _diffrn_measured_fraction_theta_full 0.989 _refine_diff_density_max 1.281 _refine_diff_density_min -0.815 _refine_diff_density_rms 0.165 data_compound-2 _database_code_depnum_ccdc_archive 'CCDC 899316' #TrackingRef 'c-2.cif' _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'C48 H28 Ag24 N18 O53' _chemical_formula_weight 4293.76 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' 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' 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/n loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' _cell_length_a 13.099(3) _cell_length_b 16.177(3) _cell_length_c 38.977(8) _cell_angle_alpha 90.00 _cell_angle_beta 90.04(3) _cell_angle_gamma 90.00 _cell_volume 8260(3) _cell_formula_units_Z 4 _cell_measurement_temperature 293(2) _cell_measurement_reflns_used 9315 _cell_measurement_theta_min 2.18 _cell_measurement_theta_max 27.47 _exptl_crystal_description block _exptl_crystal_colour yellow _exptl_crystal_size_max 0.04 _exptl_crystal_size_mid 0.02 _exptl_crystal_size_min 0.02 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 3.453 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 7976 _exptl_absorpt_coefficient_mu 5.661 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.8052 _exptl_absorpt_correction_T_max 0.8952 _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 60305 _diffrn_reflns_av_R_equivalents 0.0527 _diffrn_reflns_av_sigmaI/netI 0.0516 _diffrn_reflns_limit_h_min -16 _diffrn_reflns_limit_h_max 16 _diffrn_reflns_limit_k_min -20 _diffrn_reflns_limit_k_max 20 _diffrn_reflns_limit_l_min -48 _diffrn_reflns_limit_l_max 47 _diffrn_reflns_theta_min 1.64 _diffrn_reflns_theta_max 26.15 _reflns_number_total 15756 _reflns_number_gt 10138 _reflns_threshold_expression >2sigma(I) _computing_data_collection 'Bruker SMART' _computing_cell_refinement 'Bruker SMART' _computing_data_reduction 'Bruker SAIT' _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.Anisotropic displacement parameters were applied to all nonhydrogen atoms. Four oxygen atoms O15, O29, O30 and O1W, and three silver atoms Ag3, Ag16 and Ag20, are disordered over two positions with site occupancy ratios of 0.50:0.50,0.55:0.45, 0.55:0.45, 0.50:0.50, 0.70: 0.30, 0.70:0.30 and 0.70:0.30,respectively. One silver atom Ag11 is disordered over three positions with site occupancy ratio of 0.60:0.25:0.15. The restraints were used to restrict oxygen and nitrogen atoms of three nitrate anions (N7, O13, O14, O15; N7,O13, O14, O15A; N12, O28, O29, O30; N12, O28, O29A, O30A; N18, O46, O47, O48) on the planes, and N-O bond lengths in the reasonable range. The lengths of carbon-carbon triple bonds were also restrained. ; _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^)+(0.0640P)^2^+350.9554P] 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 15756 _refine_ls_number_parameters 1321 _refine_ls_number_restraints 276 _refine_ls_R_factor_all 0.1328 _refine_ls_R_factor_gt 0.0903 _refine_ls_wR_factor_ref 0.2223 _refine_ls_wR_factor_gt 0.1964 _refine_ls_goodness_of_fit_ref 1.025 _refine_ls_restrained_S_all 1.060 _refine_ls_shift/su_max 0.006 _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 0.82640(18) 0.33337(11) 0.03887(5) 0.0794(6) Uani 1 1 d U . . Ag2 Ag 0.85085(13) 0.50457(8) 0.05995(4) 0.0544(4) Uani 1 1 d . . . Ag3 Ag 0.8749(4) 0.4754(3) 0.13880(14) 0.0580(11) Uani 0.70 1 d P . . Ag4 Ag 0.71538(12) 0.41057(10) 0.10073(5) 0.0630(5) Uani 1 1 d . . . Ag5 Ag 0.51280(11) 0.43210(9) 0.04184(4) 0.0506(4) Uani 1 1 d . . . Ag6 Ag 0.45757(10) 0.56750(7) 0.09448(4) 0.0423(3) Uani 1 1 d . . . Ag7 Ag 0.35214(16) 0.57619(11) 0.02988(5) 0.0691(5) Uani 1 1 d . . . Ag8 Ag 0.21540(18) 0.56282(15) 0.08807(7) 0.0935(7) Uani 1 1 d . . . Ag9 Ag 0.38211(10) 0.06916(8) 0.07059(4) 0.0440(3) Uani 1 1 d . . . Ag10 Ag 0.44226(19) -0.09413(13) 0.03574(6) 0.0863(7) Uani 1 1 d . . . Ag11 Ag 0.5524(3) 0.0780(2) 0.11688(11) 0.0919(13) Uani 0.60 1 d P . . Ag12 Ag 0.65639(15) 0.14518(12) 0.20944(4) 0.0657(5) Uani 1 1 d . . . Ag13 Ag -0.06756(15) -0.00768(10) 0.03621(5) 0.0670(5) Uani 1 1 d . . . Ag14 Ag -0.01210(12) 0.00503(8) 0.10934(4) 0.0464(3) Uani 1 1 d . . . Ag15 Ag 0.11881(11) -0.08911(10) 0.06291(4) 0.0548(4) Uani 1 1 d . . . Ag16 Ag 0.3610(3) -0.0361(2) 0.13237(9) 0.0814(9) Uani 0.70 1 d PU . . Ag17 Ag 0.36159(12) 0.05498(10) 0.20742(5) 0.0568(4) Uani 1 1 d . . . Ag18 Ag 0.56448(14) 0.06345(12) 0.27569(6) 0.0824(7) Uani 1 1 d . . . Ag19 Ag 0.67744(13) -0.03372(10) 0.22485(4) 0.0563(4) Uani 1 1 d . . . Ag20 Ag 0.7753(3) -0.0388(3) 0.29088(11) 0.0971(13) Uani 0.70 1 d PU . . Ag21 Ag 0.29665(10) -0.08549(8) 0.25918(4) 0.0416(3) Uani 1 1 d . . . Ag22 Ag 0.20339(15) -0.08455(10) 0.19122(5) 0.0640(5) Uani 1 1 d . . . Ag23 Ag 0.06706(17) -0.08618(16) 0.25070(7) 0.0939(7) Uani 1 1 d DU . . Ag24 Ag 0.00225(16) -0.17197(10) 0.12838(5) 0.0666(5) Uani 1 1 d D . . Ag25 Ag 0.9104(11) 0.4932(8) 0.1308(3) 0.090(5) Uani 0.30 1 d P . . Ag26 Ag 0.6154(4) 0.0644(4) 0.08711(18) 0.0526(16) Uani 0.25 1 d P . . Ag27 Ag 0.4734(8) 0.0697(5) 0.1414(2) 0.042(2) Uani 0.15 1 d P . . Ag28 Ag 0.3171(5) -0.0701(3) 0.12490(17) 0.0534(15) Uani 0.30 1 d P . . Ag29 Ag 0.7315(6) -0.0055(4) 0.30059(17) 0.0650(19) Uani 0.30 1 d P . . C1 C 0.6801(11) 0.5889(10) 0.1284(4) 0.030(3) Uani 1 1 d . . . C2 C 0.6365(12) 0.6773(8) 0.1224(4) 0.028(3) Uani 1 1 d . . . C3 C 0.6937(12) 0.7487(9) 0.1308(4) 0.032(3) Uani 1 1 d . . . H3 H 0.7571 0.7433 0.1413 0.039 Uiso 1 1 calc R . . C4 C 0.6567(12) 0.8250(10) 0.1236(4) 0.034(4) Uani 1 1 d . . . H4 H 0.6943 0.8724 0.1284 0.041 Uiso 1 1 calc R . . C5 C 0.5603(12) 0.8296(9) 0.1086(4) 0.029(3) Uani 1 1 d . . . C6 C 0.5055(12) 0.7569(10) 0.1018(4) 0.031(3) Uani 1 1 d . . . H6 H 0.4403 0.7613 0.0925 0.037 Uiso 1 1 calc R . . C7 C 0.5128(12) 0.9076(9) 0.0975(4) 0.034(3) Uani 1 1 d D . . C8 C 0.4759(14) 0.9724(10) 0.0884(6) 0.052(5) Uani 1 1 d D . . C9 C 0.6388(12) 0.5826(10) 0.0261(4) 0.033(3) Uani 1 1 d . . . C10 C 0.7110(11) 0.6519(8) 0.0366(4) 0.026(3) Uani 1 1 d . . . C11 C 0.6786(13) 0.7325(10) 0.0318(4) 0.037(4) Uani 1 1 d . . . H11 H 0.6151 0.7438 0.0222 0.044 Uiso 1 1 calc R . . C12 C 0.7439(11) 0.7964(9) 0.0418(4) 0.031(3) Uani 1 1 d D . . H12 H 0.7254 0.8515 0.0390 0.037 Uiso 1 1 calc R . . C13 C 0.8363(11) 0.7753(8) 0.0559(4) 0.037(4) Uani 1 1 d D . . C14 C 0.8648(11) 0.6951(8) 0.0584(4) 0.029(3) Uani 1 1 d D . . H14 H 0.9296 0.6825 0.0666 0.035 Uiso 1 1 calc R . . C15 C 0.9028(11) 0.8408(8) 0.0689(4) 0.032(3) Uani 1 1 d DU . . C16 C 0.9540(11) 0.8971(9) 0.0798(4) 0.031(3) Uani 1 1 d DU . . C17 C 0.1579(12) 0.0900(10) 0.0394(4) 0.033(4) Uani 1 1 d . A . C18 C 0.2023(11) 0.1781(8) 0.0446(4) 0.025(3) Uani 1 1 d . A . C19 C 0.1434(11) 0.2478(10) 0.0374(4) 0.030(3) Uani 1 1 d . . . H19 H 0.0777 0.2415 0.0288 0.036 Uiso 1 1 calc R . . C20 C 0.1819(12) 0.3255(10) 0.0430(4) 0.034(4) Uani 1 1 d . . . H20 H 0.1444 0.3724 0.0373 0.041 Uiso 1 1 calc R . . C21 C 0.2787(11) 0.3322(9) 0.0575(4) 0.029(3) Uani 1 1 d . . . C22 C 0.3324(13) 0.2598(10) 0.0634(4) 0.037(4) Uani 1 1 d . . . H22 H 0.3986 0.2646 0.0718 0.044 Uiso 1 1 calc R . . C23 C 0.3248(12) 0.4129(9) 0.0641(5) 0.038(4) Uani 1 1 d D . . C24 C 0.3619(13) 0.4796(9) 0.0706(5) 0.045(4) Uani 1 1 d D . . C25 C 0.1965(12) 0.0777(11) 0.1403(4) 0.039(4) Uani 1 1 d . . . C26 C 0.1310(12) 0.1511(9) 0.1313(4) 0.028(3) Uani 1 1 d . . . C27 C 0.1645(12) 0.2323(10) 0.1350(4) 0.035(4) Uani 1 1 d . . . H27 H 0.2288 0.2431 0.1442 0.042 Uiso 1 1 calc R . . C28 C 0.1021(11) 0.2963(9) 0.1252(4) 0.029(3) Uani 1 1 d . . . H28 H 0.1245 0.3508 0.1263 0.034 Uiso 1 1 calc R . . C29 C 0.0044(13) 0.2771(11) 0.1137(4) 0.038(4) Uani 1 1 d . . . C30 C -0.0274(12) 0.1978(9) 0.1128(4) 0.030(3) Uani 1 1 d . . . H30 H -0.0947 0.1867 0.1067 0.036 Uiso 1 1 calc R . . C31 C -0.0615(11) 0.3424(9) 0.1010(4) 0.032(3) Uani 1 1 d D . . C32 C -0.1189(11) 0.3929(9) 0.0886(4) 0.037(4) Uani 1 1 d D . . C33 C 0.5102(12) -0.1130(11) 0.2953(4) 0.035(4) Uani 1 1 d . A . C34 C 0.4694(12) -0.1974(11) 0.2891(4) 0.035(4) Uani 1 1 d . A . C35 C 0.5203(11) -0.2691(9) 0.2972(4) 0.029(3) Uani 1 1 d . . . H35 H 0.5841 -0.2653 0.3076 0.035 Uiso 1 1 calc R . . C36 C 0.4801(12) -0.3471(10) 0.2905(4) 0.034(3) Uani 1 1 d U . . H36 H 0.5169 -0.3949 0.2953 0.040 Uiso 1 1 calc R . . C37 C 0.3820(11) -0.3505(9) 0.2764(4) 0.027(3) Uani 1 1 d . . . C38 C 0.3316(12) -0.2772(9) 0.2682(4) 0.033(4) Uani 1 1 d . . . H38 H 0.2670 -0.2801 0.2583 0.040 Uiso 1 1 calc R . . C39 C 0.3304(12) -0.4278(8) 0.2704(5) 0.037(4) Uani 1 1 d D . . C40 C 0.2893(13) -0.4939(9) 0.2659(5) 0.048(5) Uani 1 1 d D . . C41 C 0.4708(11) -0.1097(12) 0.1906(4) 0.038(4) Uani 1 1 d . . . C42 C 0.5369(12) -0.1818(11) 0.2020(4) 0.035(4) Uani 1 1 d . . . C43 C 0.5016(14) -0.2633(13) 0.1977(5) 0.049(5) Uani 1 1 d . . . H43 H 0.4374 -0.2741 0.1885 0.059 Uiso 1 1 calc R . . C44 C 0.5644(12) -0.3253(11) 0.2074(4) 0.038(4) Uani 1 1 d . . . H44 H 0.5420 -0.3796 0.2052 0.046 Uiso 1 1 calc R . . C45 C 0.6587(15) -0.3110(12) 0.2203(4) 0.047(5) Uani 1 1 d . . . C46 C 0.6892(13) -0.2274(12) 0.2240(4) 0.042(4) Uani 1 1 d . . . H46 H 0.7531 -0.2158 0.2333 0.051 Uiso 1 1 calc R . . C47 C 0.7270(14) -0.3726(11) 0.2337(5) 0.049(5) Uani 1 1 d D . . C48 C 0.7773(14) -0.4300(12) 0.2444(5) 0.051(5) Uani 1 1 d DU . . N1 N 0.5422(10) 0.6831(7) 0.1080(3) 0.028(3) Uani 1 1 d . . . N2 N 0.8022(9) 0.6337(7) 0.0494(3) 0.027(3) Uani 1 1 d . . . N3 N 0.0335(9) 0.1353(7) 0.1202(3) 0.025(3) Uani 1 1 d . . . N4 N 0.2968(9) 0.1842(7) 0.0580(3) 0.027(3) Uani 1 1 d . . . N5 N 0.3722(9) -0.2037(8) 0.2740(3) 0.032(3) Uani 1 1 d . . . N6 N 0.6277(11) -0.1634(11) 0.2144(4) 0.046(4) Uani 1 1 d . . . N7 N 0.9797(14) 0.6531(12) 0.1529(5) 0.060(5) Uani 1 1 d DU . . N8 N 0.9286(13) 0.4296(10) -0.0236(5) 0.051(4) Uani 1 1 d U . . N9 N 0.7023(14) 0.3070(12) 0.1739(5) 0.060(5) Uani 1 1 d U . . N10 N 0.5893(14) 0.2634(11) 0.0011(5) 0.059(4) Uani 1 1 d U . . N11 N 0.4539(15) 0.2212(12) 0.2557(5) 0.064(5) Uani 1 1 d U . . N12 N 0.4504(17) 0.2090(14) 0.1668(7) 0.128(10) Uani 1 1 d DU . . N13 N 0.7682(12) 0.0619(9) 0.1482(4) 0.043(3) Uani 1 1 d U . . N14 N 0.3426(13) -0.0036(10) -0.0218(4) 0.049(4) Uani 1 1 d U . . N15 N 0.225(3) -0.250(2) 0.0846(9) 0.132(7) Uani 1 1 d U . . N16 N 0.1381(13) -0.1618(11) -0.0152(5) 0.056(4) Uani 1 1 d U . . N17 N -0.0935(16) -0.0899(13) 0.1936(6) 0.071(5) Uani 1 1 d U . . N18 N 0.1000(19) -0.0142(16) 0.3193(6) 0.132(7) Uani 1 1 d DU . . O1 O 0.7561(12) 0.5849(7) 0.1455(4) 0.058(4) Uani 1 1 d . . . O2 O 0.6288(10) 0.5309(7) 0.1151(4) 0.052(3) Uani 1 1 d . . . O3 O 0.6664(10) 0.5087(7) 0.0316(3) 0.049(3) Uani 1 1 d . . . O4 O 0.5540(9) 0.6020(8) 0.0155(3) 0.051(3) Uani 1 1 d . . . O5 O 0.2049(9) 0.0341(7) 0.0551(3) 0.045(3) Uani 1 1 d . . . O6 O 0.0835(9) 0.0865(7) 0.0211(3) 0.045(3) Uani 1 1 d . . . O7 O 0.2882(11) 0.0949(11) 0.1482(5) 0.078(5) Uani 1 1 d . . . O8 O 0.1635(10) 0.0076(7) 0.1383(3) 0.049(3) Uani 1 1 d . . . O9 O 0.4623(10) -0.0533(7) 0.2839(3) 0.047(3) Uani 1 1 d . . . O10 O 0.5877(9) -0.1098(8) 0.3136(3) 0.048(3) Uani 1 1 d . . . O11 O 0.3905(10) -0.1311(9) 0.1746(4) 0.058(4) Uani 1 1 d . . . O12 O 0.5012(10) -0.0384(9) 0.1979(4) 0.059(4) Uani 1 1 d . . . O13 O 0.9843(12) 0.5839(8) 0.1660(4) 0.068(4) Uani 1 1 d . . . O14 O 0.9530(16) 0.7096(12) 0.1703(5) 0.098(6) Uani 1 1 d D . . O15 O 1.023(3) 0.669(3) 0.1255(8) 0.100(9) Uani 0.50 1 d PDU . 1 O15A O 0.957(3) 0.672(3) 0.1241(7) 0.100(9) Uani 0.50 1 d PD . 2 O16 O 0.8354(11) 0.4256(12) -0.0120(4) 0.075(5) Uani 1 1 d . . . O17 O 0.9931(12) 0.4026(13) -0.0049(5) 0.085(5) Uani 1 1 d . . . O18 O 0.9428(13) 0.4487(10) -0.0525(4) 0.070(4) Uani 1 1 d . . . O19 O 0.7088(15) 0.2916(13) 0.2044(5) 0.094(6) Uani 1 1 d U . . O20 O 0.6965(11) 0.3810(9) 0.1638(4) 0.061(4) Uani 1 1 d U . . O21 O 0.7133(19) 0.2502(15) 0.1539(6) 0.121(8) Uani 1 1 d U . . O22 O 0.6366(10) 0.3297(8) 0.0134(4) 0.056(4) Uani 1 1 d . . . O23 O 0.5300(13) 0.2252(10) 0.0202(5) 0.084(5) Uani 1 1 d . . . O24 O 0.5987(15) 0.2439(11) -0.0287(4) 0.083(5) Uani 1 1 d . . . O25 O 0.4229(16) 0.1474(14) 0.2592(5) 0.102(4) Uani 1 1 d . . . O26 O 0.535(2) 0.2443(17) 0.2489(7) 0.132(6) Uani 1 1 d U . . O27 O 0.388(2) 0.2748(17) 0.2637(7) 0.134(6) Uani 1 1 d . . . O28 O 0.4880(13) 0.1458(11) 0.1783(5) 0.080(5) Uani 1 1 d DU . . O29A O 0.401(5) 0.262(3) 0.1830(14) 0.157(14) Uani 0.45 1 d PDU A 1 O30A O 0.471(6) 0.213(4) 0.1357(9) 0.176(18) Uani 0.45 1 d PDU . 1 O29 O 0.384(4) 0.237(4) 0.1855(14) 0.157(14) Uani 0.55 1 d PDU A 2 O30 O 0.456(5) 0.256(3) 0.1421(12) 0.176(18) Uani 0.55 1 d PDU A 2 O31 O 0.6789(10) 0.0546(11) 0.1587(4) 0.065(4) Uani 1 1 d . . . O32 O 0.8363(11) 0.0756(13) 0.1675(5) 0.090(6) Uani 1 1 d . . . O33 O 0.7875(14) 0.0517(10) 0.1171(4) 0.075(5) Uani 1 1 d . . . O34 O 0.3570(16) -0.0777(14) -0.0157(6) 0.103(6) Uani 1 1 d U . . O35 O 0.3834(15) 0.0504(11) -0.0051(5) 0.090(5) Uani 1 1 d . . . O36 O 0.2901(15) 0.0099(11) -0.0461(5) 0.082(5) Uani 1 1 d . . . O37 O 0.2540(14) -0.1733(12) 0.0851(5) 0.085(5) Uani 1 1 d U . . O38 O 0.1453(18) -0.2711(16) 0.0724(9) 0.153(12) Uani 1 1 d . . . O39 O 0.283(2) -0.3011(18) 0.1014(7) 0.143(9) Uani 1 1 d U . . O40 O 0.1365(11) -0.0936(8) 0.0002(3) 0.053(3) Uani 1 1 d . . . O41 O 0.145(2) -0.2218(17) 0.0008(7) 0.127(8) Uani 1 1 d U . . O42 O 0.1299(16) -0.1652(13) -0.0468(4) 0.096(6) Uani 1 1 d . . . O43 O -0.0049(9) -0.0912(12) 0.1814(4) 0.074(5) Uani 1 1 d . . . O44 O -0.1642(12) -0.1097(11) 0.1754(5) 0.088(6) Uani 1 1 d . . . O45 O -0.1029(15) -0.0717(12) 0.2245(5) 0.090(6) Uani 1 1 d . . . O46 O 0.0140(16) -0.0229(13) 0.3044(4) 0.102(4) Uani 1 1 d DU . . O47 O 0.108(2) 0.0509(16) 0.3370(7) 0.132(6) Uani 1 1 d DU . . O48 O 0.1823(19) -0.0583(16) 0.3187(7) 0.134(6) Uani 1 1 d DU . . O1W O 0.1674(18) -0.198(3) 0.1579(9) 0.069(6) Uani 0.50 1 d PDU B 1 O2W O 0.5719(12) 0.3315(11) 0.0923(4) 0.077(5) Uani 1 1 d . . . O3W O 0.1702(19) 0.4904(15) 0.1391(6) 0.119(7) Uani 1 1 d U . . O4W O 0.2542(14) 0.5891(11) 0.2063(5) 0.084(5) Uani 1 1 d U . . O5W O 0.4061(17) 0.4000(10) 0.1268(5) 0.099(7) Uani 1 1 d . . . O1WA O 0.1796(17) -0.179(3) 0.1503(10) 0.069(6) Uani 0.50 1 d PDU B 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 0.1209(16) 0.0488(10) 0.0684(11) -0.0259(8) -0.0298(11) 0.0196(10) Ag2 0.0788(11) 0.0279(7) 0.0565(9) 0.0065(6) -0.0104(8) 0.0101(7) Ag3 0.071(2) 0.0426(17) 0.060(2) -0.0025(13) -0.0304(17) 0.0195(16) Ag4 0.0472(9) 0.0484(9) 0.0935(13) 0.0050(9) 0.0005(8) 0.0081(7) Ag5 0.0419(8) 0.0431(8) 0.0668(10) -0.0107(7) -0.0010(7) -0.0123(6) Ag6 0.0479(8) 0.0243(6) 0.0547(8) -0.0068(6) -0.0172(6) -0.0053(5) Ag7 0.0898(13) 0.0491(9) 0.0684(11) 0.0179(8) -0.0227(9) -0.0086(9) Ag8 0.0880(15) 0.0801(14) 0.1123(18) 0.0104(13) 0.0050(13) 0.0116(12) Ag9 0.0440(7) 0.0230(6) 0.0650(9) 0.0077(6) -0.0213(6) 0.0066(5) Ag10 0.1067(16) 0.0656(12) 0.0866(14) -0.0181(10) -0.0376(12) 0.0070(11) Ag11 0.106(3) 0.065(2) 0.105(3) -0.0038(19) -0.067(3) -0.0206(19) Ag12 0.0786(12) 0.0673(11) 0.0513(10) 0.0048(8) -0.0108(8) 0.0029(9) Ag13 0.0855(12) 0.0473(9) 0.0682(11) 0.0212(8) -0.0384(9) -0.0182(8) Ag14 0.0629(9) 0.0253(6) 0.0510(8) -0.0095(6) -0.0033(7) -0.0051(6) Ag15 0.0443(8) 0.0465(8) 0.0736(11) 0.0079(7) 0.0044(7) -0.0114(6) Ag16 0.0834(16) 0.0865(17) 0.0744(15) 0.0200(13) 0.0124(13) 0.0492(14) Ag17 0.0477(9) 0.0442(8) 0.0784(11) 0.0047(8) -0.0021(8) 0.0043(7) Ag18 0.0611(11) 0.0616(11) 0.1247(17) -0.0201(11) 0.0439(11) -0.0244(9) Ag19 0.0606(10) 0.0541(9) 0.0540(9) -0.0117(7) -0.0037(7) -0.0007(7) Ag20 0.102(2) 0.096(2) 0.0934(19) 0.0257(15) -0.0156(15) -0.0045(15) Ag21 0.0430(7) 0.0273(6) 0.0543(8) 0.0057(6) -0.0164(6) 0.0030(5) Ag22 0.0820(12) 0.0493(9) 0.0606(10) -0.0073(8) -0.0176(9) 0.0022(8) Ag23 0.0749(13) 0.0990(16) 0.1077(16) -0.0335(13) 0.0118(12) -0.0215(12) Ag24 0.0949(13) 0.0456(9) 0.0593(10) 0.0162(8) -0.0242(9) -0.0030(8) Ag25 0.135(12) 0.067(7) 0.070(7) -0.048(6) -0.047(7) 0.026(6) Ag26 0.029(3) 0.049(3) 0.080(4) -0.040(3) -0.010(3) -0.005(2) Ag27 0.061(6) 0.018(4) 0.048(5) -0.004(4) -0.011(5) 0.011(4) Ag28 0.055(3) 0.022(2) 0.083(4) -0.008(2) -0.025(3) 0.016(2) Ag29 0.089(5) 0.055(4) 0.051(4) 0.015(3) -0.035(3) -0.030(4) C1 0.027(8) 0.036(8) 0.026(8) 0.012(6) -0.012(6) 0.005(6) C2 0.035(8) 0.019(7) 0.030(8) -0.006(6) -0.005(6) 0.005(6) C3 0.028(8) 0.030(8) 0.039(9) 0.002(7) -0.010(7) 0.002(6) C4 0.040(9) 0.030(8) 0.032(8) -0.008(7) -0.010(7) 0.008(7) C5 0.034(8) 0.017(7) 0.035(8) 0.002(6) -0.003(7) 0.007(6) C6 0.028(8) 0.036(8) 0.029(8) 0.004(6) -0.008(6) -0.004(6) C7 0.031(8) 0.028(8) 0.042(9) 0.006(7) -0.003(7) -0.003(6) C8 0.039(10) 0.037(10) 0.078(14) 0.021(9) -0.022(9) -0.003(8) C9 0.041(9) 0.031(8) 0.026(8) -0.008(6) -0.008(7) -0.011(7) C10 0.031(8) 0.013(6) 0.034(8) -0.005(6) 0.004(6) -0.006(5) C11 0.046(10) 0.026(8) 0.038(9) -0.001(7) -0.005(8) -0.008(7) C12 0.035(9) 0.020(7) 0.037(9) -0.003(6) -0.003(7) -0.007(6) C13 0.043(10) 0.038(9) 0.031(9) 0.000(7) 0.004(7) -0.001(7) C14 0.020(7) 0.035(8) 0.034(8) -0.010(7) -0.009(6) -0.005(6) C15 0.034(7) 0.027(6) 0.035(7) 0.002(6) -0.005(6) 0.004(6) C16 0.022(6) 0.036(7) 0.036(7) -0.002(6) -0.005(5) -0.008(5) C17 0.028(8) 0.034(8) 0.036(9) -0.013(7) -0.007(7) -0.004(7) C18 0.024(7) 0.015(6) 0.035(8) 0.008(6) -0.005(6) -0.009(5) C19 0.020(7) 0.040(9) 0.030(8) -0.012(7) -0.006(6) -0.006(6) C20 0.038(9) 0.028(8) 0.035(9) 0.003(7) 0.006(7) -0.001(7) C21 0.028(8) 0.019(7) 0.039(9) 0.010(6) -0.004(7) -0.007(6) C22 0.033(9) 0.037(9) 0.041(10) 0.002(7) -0.011(7) -0.009(7) C23 0.027(8) 0.025(8) 0.061(11) -0.002(7) 0.000(7) -0.004(6) C24 0.040(10) 0.028(9) 0.066(12) 0.011(8) -0.004(9) -0.005(7) C25 0.033(9) 0.041(10) 0.042(10) 0.024(8) -0.011(7) 0.009(7) C26 0.036(8) 0.027(7) 0.021(7) 0.006(6) 0.002(6) -0.005(6) C27 0.029(8) 0.032(8) 0.044(10) 0.014(7) -0.008(7) 0.000(7) C28 0.030(8) 0.023(7) 0.034(8) -0.007(6) -0.006(6) 0.003(6) C29 0.045(10) 0.040(9) 0.028(8) 0.005(7) 0.003(7) 0.012(8) C30 0.028(8) 0.028(8) 0.033(8) 0.001(6) 0.002(6) -0.003(6) C31 0.028(8) 0.038(9) 0.029(8) -0.002(7) -0.001(6) 0.003(7) C32 0.030(8) 0.031(8) 0.049(10) 0.001(7) -0.002(7) 0.006(7) C33 0.030(8) 0.048(10) 0.028(8) -0.013(7) -0.005(7) 0.004(7) C34 0.036(9) 0.045(9) 0.025(8) 0.005(7) -0.004(7) -0.006(7) C35 0.026(8) 0.031(8) 0.030(8) 0.003(6) -0.010(6) 0.001(6) C36 0.034(4) 0.033(4) 0.034(4) 0.001(2) -0.001(2) 0.001(2) C37 0.032(8) 0.024(7) 0.025(7) 0.003(6) -0.007(6) -0.013(6) C38 0.036(9) 0.016(7) 0.048(10) 0.004(6) -0.019(7) -0.003(6) C39 0.036(9) 0.012(7) 0.063(11) -0.002(7) -0.002(8) -0.006(6) C40 0.043(10) 0.027(9) 0.073(13) 0.003(9) -0.009(9) -0.003(8) C41 0.018(8) 0.064(12) 0.031(9) 0.006(8) -0.002(6) 0.002(7) C42 0.025(8) 0.053(10) 0.027(8) -0.005(7) -0.010(6) 0.011(7) C43 0.031(9) 0.067(13) 0.050(11) 0.018(10) 0.003(8) 0.005(9) C44 0.031(9) 0.044(10) 0.041(10) 0.016(8) -0.008(7) 0.001(7) C45 0.056(12) 0.054(11) 0.033(9) 0.009(8) 0.007(8) 0.024(9) C46 0.037(9) 0.053(11) 0.037(10) 0.000(8) -0.002(7) 0.010(8) C47 0.051(11) 0.054(12) 0.041(10) -0.003(9) -0.001(9) 0.004(9) C48 0.045(8) 0.061(9) 0.046(8) 0.001(7) -0.004(7) 0.012(7) N1 0.037(7) 0.023(6) 0.023(6) -0.003(5) -0.002(5) -0.002(5) N2 0.029(7) 0.019(6) 0.035(7) 0.001(5) -0.011(5) 0.010(5) N3 0.038(7) 0.010(5) 0.027(6) -0.004(5) -0.009(5) -0.006(5) N4 0.024(6) 0.018(6) 0.039(7) 0.004(5) -0.007(5) -0.003(5) N5 0.020(6) 0.029(7) 0.046(8) 0.002(6) -0.018(6) -0.001(5) N6 0.036(8) 0.071(11) 0.031(8) 0.004(7) 0.004(6) 0.004(7) N7 0.060(5) 0.060(5) 0.060(5) 0.001(2) -0.001(2) -0.001(2) N8 0.051(4) 0.051(4) 0.052(4) -0.001(2) 0.000(2) 0.001(2) N9 0.060(5) 0.060(5) 0.061(5) 0.001(2) -0.001(2) 0.000(2) N10 0.059(5) 0.058(5) 0.059(5) 0.000(2) 0.000(2) 0.001(2) N11 0.059(8) 0.063(8) 0.070(9) 0.005(7) 0.002(7) -0.008(7) N12 0.128(10) 0.128(10) 0.128(10) 0.000(2) 0.000(2) 0.000(2) N13 0.043(4) 0.043(4) 0.044(4) -0.001(2) 0.000(2) 0.000(2) N14 0.055(7) 0.041(7) 0.052(7) 0.001(6) -0.023(6) 0.003(6) N15 0.132(7) 0.132(7) 0.132(7) 0.0000(15) 0.0002(15) 0.0000(15) N16 0.058(8) 0.050(7) 0.060(8) -0.009(7) -0.002(7) 0.003(6) N17 0.070(5) 0.071(5) 0.071(5) 0.000(2) 0.000(2) 0.000(2) N18 0.132(7) 0.132(7) 0.132(7) 0.0000(15) 0.0002(15) 0.0000(15) O1 0.084(10) 0.025(6) 0.066(9) 0.001(6) -0.040(8) 0.011(6) O2 0.057(8) 0.027(6) 0.072(9) -0.006(6) -0.019(7) 0.011(6) O3 0.058(8) 0.026(6) 0.061(8) -0.012(6) -0.010(6) -0.001(5) O4 0.033(7) 0.056(8) 0.063(8) -0.017(7) -0.017(6) -0.003(6) O5 0.039(7) 0.035(6) 0.060(8) 0.010(6) -0.012(6) -0.001(5) O6 0.049(7) 0.022(6) 0.063(8) -0.005(5) -0.011(6) -0.009(5) O7 0.044(8) 0.084(12) 0.107(13) 0.042(10) -0.017(8) 0.004(8) O8 0.061(8) 0.031(7) 0.055(8) 0.004(6) -0.015(6) 0.006(6) O9 0.051(7) 0.026(6) 0.063(8) 0.004(6) -0.021(6) -0.011(5) O10 0.044(7) 0.051(8) 0.048(7) 0.001(6) -0.018(6) -0.021(6) O11 0.040(7) 0.061(9) 0.072(10) 0.015(7) -0.018(7) 0.008(6) O12 0.039(7) 0.057(9) 0.082(10) -0.006(8) -0.019(7) 0.007(6) O13 0.081(10) 0.042(8) 0.080(10) 0.031(7) -0.034(8) -0.017(7) O14 0.102(14) 0.093(14) 0.099(14) 0.025(12) -0.022(11) 0.020(12) O15 0.100(10) 0.100(9) 0.099(9) 0.000(2) 0.000(2) 0.000(2) O15A 0.100(10) 0.100(9) 0.099(9) 0.000(2) 0.000(2) 0.000(2) O16 0.043(8) 0.110(14) 0.073(10) 0.011(10) -0.001(7) 0.013(8) O17 0.044(8) 0.123(16) 0.086(12) -0.022(11) -0.013(8) 0.013(9) O18 0.078(11) 0.077(11) 0.054(9) 0.007(8) -0.002(8) -0.008(9) O19 0.102(9) 0.100(9) 0.078(9) 0.034(8) -0.005(7) -0.009(8) O20 0.061(4) 0.061(4) 0.061(4) 0.002(2) -0.002(2) 0.000(2) O21 0.133(11) 0.109(11) 0.122(11) 0.014(9) -0.012(9) -0.001(9) O22 0.054(8) 0.039(7) 0.075(10) -0.023(7) -0.021(7) 0.012(6) O23 0.074(11) 0.064(10) 0.115(15) 0.015(10) 0.000(10) -0.027(9) O24 0.115(14) 0.084(12) 0.051(9) -0.024(8) -0.023(9) 0.018(10) O25 0.102(5) 0.101(5) 0.102(5) 0.000(2) 0.000(2) -0.001(2) O26 0.132(6) 0.131(6) 0.132(6) -0.0003(15) 0.0002(15) 0.0000(15) O27 0.134(6) 0.134(6) 0.134(6) 0.000(2) 0.000(2) 0.001(2) O28 0.080(5) 0.081(5) 0.081(5) 0.002(2) 0.000(2) 0.001(2) O29A 0.156(15) 0.157(16) 0.156(15) 0.001(7) -0.005(7) 0.001(7) O30A 0.176(18) 0.175(19) 0.176(18) 0.004(7) 0.002(7) 0.000(8) O29 0.156(15) 0.157(16) 0.156(15) 0.001(7) -0.005(7) 0.001(7) O30 0.176(18) 0.175(19) 0.176(18) 0.004(7) 0.002(7) 0.000(8) O31 0.036(7) 0.099(12) 0.059(9) -0.021(8) 0.001(6) -0.012(7) O32 0.041(8) 0.123(16) 0.105(14) -0.001(12) -0.031(9) -0.029(9) O33 0.094(12) 0.071(11) 0.059(10) -0.010(8) 0.015(9) 0.000(9) O34 0.103(6) 0.103(6) 0.104(6) 0.000(2) -0.001(2) 0.001(2) O35 0.105(14) 0.065(11) 0.099(14) 0.009(10) -0.006(11) -0.012(10) O36 0.099(13) 0.066(11) 0.083(12) -0.008(9) 0.005(10) 0.007(9) O37 0.085(5) 0.084(5) 0.086(5) -0.001(2) 0.000(2) 0.000(2) O38 0.077(15) 0.115(19) 0.27(4) 0.02(2) -0.043(19) -0.009(14) O39 0.143(9) 0.143(9) 0.144(9) 0.000(2) 0.000(2) 0.000(2) O40 0.067(9) 0.037(7) 0.054(8) -0.010(6) -0.016(7) -0.002(6) O41 0.127(8) 0.127(8) 0.127(8) -0.0001(11) -0.0001(11) 0.0001(11) O42 0.124(16) 0.116(16) 0.047(10) -0.031(10) -0.006(10) 0.013(13) O43 0.018(6) 0.116(14) 0.089(11) -0.021(10) 0.007(7) 0.011(7) O44 0.044(9) 0.086(12) 0.133(16) 0.017(11) -0.025(10) -0.013(8) O45 0.093(13) 0.097(14) 0.080(12) -0.011(11) 0.019(10) 0.030(11) O46 0.102(5) 0.101(5) 0.102(5) 0.000(2) 0.000(2) -0.001(2) O47 0.132(6) 0.131(6) 0.132(6) -0.0003(15) 0.0002(15) 0.0000(15) O48 0.134(6) 0.134(6) 0.134(6) 0.000(2) 0.000(2) 0.001(2) O1W 0.069(6) 0.069(6) 0.069(6) -0.0002(15) -0.0004(15) -0.0002(15) O2W 0.057(9) 0.085(12) 0.090(12) 0.017(9) -0.030(8) -0.023(8) O3W 0.120(8) 0.118(8) 0.120(8) 0.000(2) 0.001(2) 0.000(2) O4W 0.085(5) 0.082(5) 0.083(5) 0.001(2) -0.002(2) 0.001(2) O5W 0.139(17) 0.036(8) 0.123(16) 0.012(9) -0.048(13) -0.021(10) O1WA 0.069(6) 0.069(6) 0.069(6) -0.0002(15) -0.0004(15) -0.0002(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 C32 2.281(17) 1_655 ? Ag1 O41 2.41(3) 3_655 ? Ag1 O16 2.484(17) . ? Ag1 Ag2 2.907(2) . ? Ag1 Ag4 3.081(3) . ? Ag2 C32 2.161(14) 1_655 ? Ag2 N2 2.223(11) . ? Ag2 Ag4 2.827(2) . ? Ag2 Ag25 2.874(13) . ? Ag2 Ag3 3.125(5) . ? Ag3 Ag25 0.630(16) . ? Ag3 O10 2.362(13) 2_655 ? Ag3 C32 2.369(18) 1_655 ? Ag3 O1 2.372(14) . ? Ag3 O13 2.502(15) . ? Ag3 Ag29 2.761(10) 2_655 ? Ag3 Ag4 2.768(5) . ? Ag4 C32 2.240(15) 1_655 ? Ag4 O2W 2.297(15) . ? Ag4 O2 2.322(12) . ? Ag4 O20 2.517(15) . ? Ag4 Ag25 3.111(13) . ? Ag5 O3 2.397(13) . ? Ag5 C24 2.399(19) . ? Ag5 O4 2.463(13) 3_665 ? Ag5 O22 2.570(13) . ? Ag5 C23 2.631(16) . ? Ag5 Ag6 3.087(2) . ? Ag5 Ag7 3.175(3) . ? Ag5 Ag7 3.312(3) 3_665 ? Ag6 C24 2.112(16) . ? Ag6 N1 2.237(12) . ? Ag6 O2 2.454(12) . ? Ag6 Ag7 2.874(2) . ? Ag6 Ag8 3.183(3) . ? Ag7 C24 2.230(17) . ? Ag7 O22 2.279(15) 3_665 ? Ag7 O16 2.553(15) 3_665 ? Ag7 Ag8 2.899(3) . ? Ag7 Ag5 3.312(3) 3_665 ? Ag8 O3W 2.38(2) . ? Ag8 O39 2.43(3) 1_565 ? Ag8 C24 2.442(18) . ? Ag8 O18 2.499(16) 3_665 ? Ag9 C8 2.107(15) 1_545 ? Ag9 N4 2.225(12) . ? Ag9 O5 2.464(12) . ? Ag9 Ag11 2.872(3) . ? Ag9 Ag16 2.963(3) . ? Ag9 Ag27 3.007(9) . ? Ag9 Ag10 3.073(3) . ? Ag9 Ag26 3.124(5) . ? Ag9 Ag28 3.207(7) . ? Ag10 O34 2.31(2) . ? Ag10 C8 2.36(2) 1_545 ? Ag10 O24 2.496(18) 3_655 ? Ag10 C7 2.578(16) 1_545 ? Ag11 Ag27 1.416(11) . ? Ag11 Ag26 1.441(8) . ? Ag11 C8 2.27(2) 1_545 ? Ag11 O31 2.353(15) . ? Ag11 O30A 2.54(6) . ? Ag11 Ag16 3.172(6) . ? Ag12 C48 2.34(2) 2_655 ? Ag12 O19 2.47(2) . ? Ag12 O31 2.481(14) . ? Ag12 O28 2.516(18) . ? Ag12 C47 2.705(19) 2_655 ? Ag12 Ag19 2.969(3) . ? Ag12 Ag18 3.142(3) . ? Ag13 C16 2.310(16) 1_445 ? Ag13 O40 2.346(13) 3 ? Ag13 O6 2.566(12) . ? Ag13 O6 2.580(12) 3 ? Ag13 Ag14 2.948(2) . ? Ag13 Ag15 2.962(2) . ? Ag13 Ag13 3.342(4) 3 ? Ag14 C16 2.138(13) 1_445 ? Ag14 N3 2.231(10) . ? Ag14 O8 2.563(13) . ? Ag14 Ag15 2.922(2) . ? Ag14 Ag24 2.964(2) . ? Ag15 C16 2.269(14) 1_445 ? Ag15 O5 2.310(12) . ? Ag15 O37 2.395(19) . ? Ag15 O40 2.458(13) . ? Ag15 Ag24 3.263(3) . ? Ag16 Ag28 0.847(5) . ? Ag16 O11 2.283(14) . ? Ag16 Ag27 2.285(10) . ? Ag16 C8 2.29(2) 1_545 ? Ag16 O7 2.405(18) . ? Ag16 C7 2.575(16) 1_545 ? Ag16 Ag22 3.185(4) . ? Ag16 Ag17 3.276(4) . ? Ag17 C40 2.370(19) 2 ? Ag17 O12 2.401(13) . ? Ag17 O28 2.487(18) . ? Ag17 O7 2.582(16) . ? Ag17 C39 2.674(16) 2 ? Ag17 Ag27 2.971(11) . ? Ag17 Ag22 3.128(2) . ? Ag17 Ag21 3.156(2) . ? Ag18 C48 2.219(19) 2_655 ? Ag18 O9 2.337(11) . ? Ag18 O13 2.385(16) 2_645 ? Ag18 O25 2.39(2) . ? Ag18 Ag29 2.640(8) . ? Ag18 Ag19 2.931(3) . ? Ag18 Ag20 3.273(5) . ? Ag19 C48 2.145(18) 2_655 ? Ag19 N6 2.234(17) . ? Ag19 O12 2.537(13) . ? Ag19 Ag20 2.876(5) . ? Ag19 Ag29 3.070(6) . ? Ag20 Ag29 0.874(8) . ? Ag20 O20 2.222(15) 2_645 ? Ag20 C48 2.34(2) 2_655 ? Ag21 C40 2.102(15) 2 ? Ag21 N5 2.229(12) . ? Ag21 O9 2.430(12) . ? Ag21 Ag22 2.916(2) . ? Ag21 Ag23 3.025(3) . ? Ag22 C40 2.225(19) 2 ? Ag22 O1WA 2.24(4) . ? Ag22 O1W 2.29(4) . ? Ag22 O8 2.596(12) . ? Ag22 Ag23 2.927(3) . ? Ag22 Ag28 2.993(7) . ? Ag23 O27 2.39(3) 2_545 ? Ag23 O46 2.432(15) . ? Ag23 O45 2.46(2) . ? Ag23 C40 2.488(19) 2 ? Ag24 C16 2.288(16) 1_445 ? Ag24 O43 2.448(16) . ? Ag24 O1WA 2.477(18) . ? Ag24 O1W 2.484(18) . ? Ag24 O15 2.59(4) 1_445 ? Ag24 O14 2.60(2) 1_445 ? Ag24 C15 2.667(15) 1_445 ? Ag25 O13 2.231(19) . ? Ag25 C32 2.34(2) 1_655 ? Ag25 O1 2.57(2) . ? Ag25 Ag29 3.259(17) 2_655 ? Ag26 O36 2.353(18) 3_655 ? Ag26 C8 2.357(19) 1_545 ? Ag26 O33 2.546(19) . ? Ag26 Ag27 2.820(13) . ? Ag27 O28 1.90(2) . ? Ag27 O30A 2.33(7) . ? Ag27 O7 2.474(18) . ? Ag27 C8 2.60(2) 1_545 ? Ag27 Ag28 3.118(11) . ? Ag28 O11 2.375(14) . ? Ag28 O37 2.42(2) . ? Ag28 O8 2.429(14) . ? Ag28 C8 2.61(2) 1_545 ? Ag29 C48 2.14(2) 2_655 ? Ag29 O20 2.487(16) 2_645 ? Ag29 O1 2.567(15) 2_645 ? Ag29 O10 2.579(13) . ? Ag29 C47 2.590(19) 2_655 ? Ag29 Ag3 2.761(10) 2_645 ? Ag29 Ag25 3.259(17) 2_645 ? C1 O1 1.199(18) . ? C1 O2 1.265(19) . ? C1 C2 1.56(2) . ? C2 N1 1.361(19) . ? C2 C3 1.41(2) . ? C3 C4 1.36(2) . ? C4 C5 1.39(2) . ? C5 C6 1.40(2) . ? C5 C7 1.471(19) . ? C6 N1 1.31(2) . ? C7 C8 1.207(16) . ? C7 Ag16 2.575(16) 1_565 ? C7 Ag10 2.578(16) 1_565 ? C8 Ag9 2.107(15) 1_565 ? C8 Ag11 2.27(2) 1_565 ? C8 Ag16 2.29(2) 1_565 ? C8 Ag26 2.357(19) 1_565 ? C8 Ag10 2.36(2) 1_565 ? C8 Ag27 2.60(2) 1_565 ? C8 Ag28 2.61(2) 1_565 ? C9 O4 1.23(2) . ? C9 O3 1.27(2) . ? C9 C10 1.523(19) . ? C10 N2 1.327(19) . ? C10 C11 1.38(2) . ? C11 C12 1.40(2) . ? C12 C13 1.371(15) . ? C13 C14 1.353(15) . ? C13 C15 1.462(15) . ? C14 N2 1.334(18) . ? C15 C16 1.208(12) . ? C15 Ag24 2.666(15) 1_665 ? C16 Ag14 2.138(13) 1_665 ? C16 Ag15 2.269(14) 1_665 ? C16 Ag24 2.288(16) 1_665 ? C16 Ag13 2.310(16) 1_665 ? C17 O6 1.209(19) . ? C17 O5 1.25(2) . ? C17 C18 1.552(19) . ? C18 N4 1.347(18) . ? C18 C19 1.39(2) . ? C19 C20 1.37(2) . ? C20 C21 1.39(2) . ? C21 C22 1.39(2) . ? C21 C23 1.461(19) . ? C22 N4 1.326(19) . ? C23 C24 1.209(16) . ? C25 O8 1.22(2) . ? C25 O7 1.27(2) . ? C25 C26 1.51(2) . ? C26 N3 1.372(19) . ? C26 C27 1.39(2) . ? C27 C28 1.37(2) . ? C28 C29 1.39(2) . ? C29 C30 1.35(2) . ? C29 C31 1.45(2) . ? C30 N3 1.319(19) . ? C31 C32 1.210(10) . ? C32 Ag2 2.161(14) 1_455 ? C32 Ag4 2.240(15) 1_455 ? C32 Ag1 2.281(17) 1_455 ? C32 Ag25 2.34(2) 1_455 ? C32 Ag3 2.369(18) 1_455 ? C33 O9 1.23(2) . ? C33 O10 1.241(19) . ? C33 C34 1.49(2) . ? C34 C35 1.38(2) . ? C34 N5 1.407(19) . ? C35 C36 1.39(2) . ? C36 C37 1.40(2) . ? C37 C38 1.39(2) . ? C37 C39 1.440(18) . ? C38 N5 1.322(19) . ? C39 C40 1.210(16) . ? C39 Ag17 2.674(16) 2_545 ? C40 Ag21 2.102(15) 2_545 ? C40 Ag22 2.225(19) 2_545 ? C40 Ag17 2.370(19) 2_545 ? C40 Ag23 2.488(19) 2_545 ? C41 O12 1.25(2) . ? C41 O11 1.27(2) . ? C41 C42 1.52(2) . ? C42 N6 1.32(2) . ? C42 C43 1.41(3) . ? C43 C44 1.35(2) . ? C44 C45 1.35(3) . ? C45 C46 1.42(3) . ? C45 C47 1.44(2) . ? C46 N6 1.36(2) . ? C47 C48 1.212(17) . ? C47 Ag29 2.590(19) 2_645 ? C47 Ag12 2.705(19) 2_645 ? C48 Ag29 2.14(2) 2_645 ? C48 Ag19 2.145(18) 2_645 ? C48 Ag18 2.219(19) 2_645 ? C48 Ag20 2.34(2) 2_645 ? C48 Ag12 2.34(2) 2_645 ? N7 O14 1.191(13) . ? N7 O15A 1.199(19) . ? N7 O13 1.23(2) . ? N7 O15 1.233(19) . ? N8 O18 1.18(2) . ? N8 O17 1.20(2) . ? N8 O16 1.30(2) . ? N9 O21 1.21(3) . ? N9 O19 1.22(2) . ? N9 O20 1.26(2) . ? N10 O24 1.21(2) . ? N10 O23 1.24(2) . ? N10 O22 1.33(2) . ? N11 O26 1.16(3) . ? N11 O27 1.26(3) . ? N11 O25 1.27(3) . ? N12 O29 1.22(2) . ? N12 O28 1.222(17) . ? N12 O30 1.23(2) . ? N12 O29A 1.244(19) . ? N12 O30A 1.25(2) . ? N13 O32 1.19(2) . ? N13 O31 1.245(19) . ? N13 O33 1.25(2) . ? N14 O36 1.19(2) . ? N14 O35 1.21(2) . ? N14 O34 1.24(2) . ? N15 O38 1.20(4) . ? N15 O39 1.29(4) . ? N15 O37 1.30(4) . ? N16 O41 1.16(3) . ? N16 O42 1.24(2) . ? N16 O40 1.26(2) . ? N17 O44 1.21(2) . ? N17 O45 1.25(3) . ? N17 O43 1.25(2) . ? N18 O47 1.262(18) . ? N18 O46 1.275(18) . ? N18 O48 1.293(18) . ? O1 Ag29 2.566(15) 2_655 ? O4 Ag5 2.463(13) 3_665 ? O6 Ag13 2.580(12) 3 ? O10 Ag3 2.362(13) 2_645 ? O13 Ag18 2.385(16) 2_655 ? O14 Ag24 2.60(2) 1_665 ? O15 Ag24 2.59(4) 1_665 ? O16 Ag7 2.553(15) 3_665 ? O18 Ag8 2.499(16) 3_665 ? O20 Ag20 2.222(15) 2_655 ? O20 Ag29 2.487(16) 2_655 ? O22 Ag7 2.279(15) 3_665 ? O24 Ag10 2.496(18) 3_655 ? O27 Ag23 2.39(3) 2 ? O36 Ag26 2.352(18) 3_655 ? O39 Ag8 2.43(3) 1_545 ? O40 Ag13 2.346(13) 3 ? O41 Ag1 2.41(3) 3_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 C32 Ag1 O41 144.6(7) 1_655 3_655 ? C32 Ag1 O16 114.2(6) 1_655 . ? O41 Ag1 O16 86.0(8) 3_655 . ? C32 Ag1 Ag2 47.4(3) 1_655 . ? O41 Ag1 Ag2 151.6(6) 3_655 . ? O16 Ag1 Ag2 69.4(4) . . ? C32 Ag1 Ag4 46.5(4) 1_655 . ? O41 Ag1 Ag4 151.7(6) 3_655 . ? O16 Ag1 Ag4 113.8(4) . . ? Ag2 Ag1 Ag4 56.25(6) . . ? C32 Ag2 N2 159.1(6) 1_655 . ? C32 Ag2 Ag4 51.3(4) 1_655 . ? N2 Ag2 Ag4 115.5(3) . . ? C32 Ag2 Ag25 53.1(5) 1_655 . ? N2 Ag2 Ag25 108.4(4) . . ? Ag4 Ag2 Ag25 66.1(3) . . ? C32 Ag2 Ag1 50.9(5) 1_655 . ? N2 Ag2 Ag1 144.3(3) . . ? Ag4 Ag2 Ag1 65.00(7) . . ? Ag25 Ag2 Ag1 103.9(3) . . ? C32 Ag2 Ag3 49.2(5) 1_655 . ? N2 Ag2 Ag3 110.6(3) . . ? Ag4 Ag2 Ag3 55.16(10) . . ? Ag25 Ag2 Ag3 11.1(3) . . ? Ag1 Ag2 Ag3 98.35(11) . . ? Ag25 Ag3 O10 120.3(18) . 2_655 ? Ag25 Ag3 C32 79.7(15) . 1_655 ? O10 Ag3 C32 108.2(5) 2_655 1_655 ? Ag25 Ag3 O1 101.4(17) . . ? O10 Ag3 O1 119.0(5) 2_655 . ? C32 Ag3 O1 122.3(5) 1_655 . ? Ag25 Ag3 O13 57.8(15) . . ? O10 Ag3 O13 87.6(5) 2_655 . ? C32 Ag3 O13 136.5(6) 1_655 . ? O1 Ag3 O13 78.8(5) . . ? Ag25 Ag3 Ag29 138.3(16) . 2_655 ? O10 Ag3 Ag29 59.9(3) 2_655 2_655 ? C32 Ag3 Ag29 141.9(5) 1_655 2_655 ? O1 Ag3 Ag29 59.4(4) . 2_655 ? O13 Ag3 Ag29 81.3(5) . 2_655 ? Ag25 Ag3 Ag4 117.6(16) . . ? O10 Ag3 Ag4 110.9(4) 2_655 . ? C32 Ag3 Ag4 51.0(4) 1_655 . ? O1 Ag3 Ag4 81.2(3) . . ? O13 Ag3 Ag4 157.7(4) . . ? Ag29 Ag3 Ag4 96.9(2) 2_655 . ? Ag25 Ag3 Ag2 61.1(15) . . ? O10 Ag3 Ag2 151.8(4) 2_655 . ? C32 Ag3 Ag2 43.7(3) 1_655 . ? O1 Ag3 Ag2 85.9(4) . . ? O13 Ag3 Ag2 111.6(4) . . ? Ag29 Ag3 Ag2 140.7(2) 2_655 . ? Ag4 Ag3 Ag2 56.94(11) . . ? C32 Ag4 O2W 133.8(6) 1_655 . ? C32 Ag4 O2 129.2(5) 1_655 . ? O2W Ag4 O2 95.8(6) . . ? C32 Ag4 O20 106.1(5) 1_655 . ? O2W Ag4 O20 87.3(6) . . ? O2 Ag4 O20 82.8(5) . . ? C32 Ag4 Ag3 55.2(5) 1_655 . ? O2W Ag4 Ag3 154.9(4) . . ? O2 Ag4 Ag3 85.5(3) . . ? O20 Ag4 Ag3 67.9(4) . . ? C32 Ag4 Ag2 48.8(4) 1_655 . ? O2W Ag4 Ag2 137.1(4) . . ? O2 Ag4 Ag2 89.5(4) . . ? O20 Ag4 Ag2 135.5(3) . . ? Ag3 Ag4 Ag2 67.89(11) . . ? C32 Ag4 Ag1 47.6(4) 1_655 . ? O2W Ag4 Ag1 92.8(5) . . ? O2 Ag4 Ag1 139.4(4) . . ? O20 Ag4 Ag1 137.2(3) . . ? Ag3 Ag4 Ag1 102.50(13) . . ? Ag2 Ag4 Ag1 58.75(6) . . ? C32 Ag4 Ag25 48.6(5) 1_655 . ? O2W Ag4 Ag25 164.8(5) . . ? O2 Ag4 Ag25 87.1(4) . . ? O20 Ag4 Ag25 78.2(4) . . ? Ag3 Ag4 Ag25 10.3(3) . . ? Ag2 Ag4 Ag25 57.6(3) . . ? Ag1 Ag4 Ag25 94.6(3) . . ? O3 Ag5 C24 127.2(4) . . ? O3 Ag5 O4 105.2(4) . 3_665 ? C24 Ag5 O4 101.7(5) . 3_665 ? O3 Ag5 O22 74.4(4) . . ? C24 Ag5 O22 158.1(5) . . ? O4 Ag5 O22 71.9(4) 3_665 . ? O3 Ag5 C23 154.5(4) . . ? C24 Ag5 C23 27.3(4) . . ? O4 Ag5 C23 86.6(5) 3_665 . ? O22 Ag5 C23 131.1(4) . . ? O3 Ag5 Ag6 86.6(3) . . ? C24 Ag5 Ag6 43.1(4) . . ? O4 Ag5 Ag6 132.7(3) 3_665 . ? O22 Ag5 Ag6 153.1(3) . . ? C23 Ag5 Ag6 69.2(3) . . ? O3 Ag5 Ag7 98.8(3) . . ? C24 Ag5 Ag7 44.5(4) . . ? O4 Ag5 Ag7 78.2(3) 3_665 . ? O22 Ag5 Ag7 146.0(3) . . ? C23 Ag5 Ag7 60.9(3) . . ? Ag6 Ag5 Ag7 54.63(5) . . ? O3 Ag5 Ag7 55.3(3) . 3_665 ? C24 Ag5 Ag7 148.0(4) . 3_665 ? O4 Ag5 Ag7 54.2(3) 3_665 3_665 ? O22 Ag5 Ag7 43.3(3) . 3_665 ? C23 Ag5 Ag7 140.8(4) . 3_665 ? Ag6 Ag5 Ag7 135.66(6) . 3_665 ? Ag7 Ag5 Ag7 105.08(7) . 3_665 ? C24 Ag6 N1 163.9(6) . . ? C24 Ag6 O2 121.6(5) . . ? N1 Ag6 O2 70.8(4) . . ? C24 Ag6 Ag7 50.3(5) . . ? N1 Ag6 Ag7 113.7(3) . . ? O2 Ag6 Ag7 137.5(3) . . ? C24 Ag6 Ag5 50.8(5) . . ? N1 Ag6 Ag5 129.3(3) . . ? O2 Ag6 Ag5 80.3(3) . . ? Ag7 Ag6 Ag5 64.23(6) . . ? C24 Ag6 Ag8 50.1(5) . . ? N1 Ag6 Ag8 122.2(3) . . ? O2 Ag6 Ag8 158.5(3) . . ? Ag7 Ag6 Ag8 56.92(7) . . ? Ag5 Ag6 Ag8 99.49(7) . . ? C24 Ag7 O22 172.6(6) . 3_665 ? C24 Ag7 O16 103.9(6) . 3_665 ? O22 Ag7 O16 82.4(5) 3_665 3_665 ? C24 Ag7 Ag6 46.8(4) . . ? O22 Ag7 Ag6 130.6(3) 3_665 . ? O16 Ag7 Ag6 134.5(4) 3_665 . ? C24 Ag7 Ag8 55.0(5) . . ? O22 Ag7 Ag8 132.0(3) 3_665 . ? O16 Ag7 Ag8 67.5(4) 3_665 . ? Ag6 Ag7 Ag8 66.91(7) . . ? C24 Ag7 Ag5 49.0(5) . . ? O22 Ag7 Ag5 123.8(3) 3_665 . ? O16 Ag7 Ag5 132.0(4) 3_665 . ? Ag6 Ag7 Ag5 61.14(5) . . ? Ag8 Ag7 Ag5 103.90(7) . . ? C24 Ag7 Ag5 122.8(5) . 3_665 ? O22 Ag7 Ag5 50.7(3) 3_665 3_665 ? O16 Ag7 Ag5 106.5(4) 3_665 3_665 ? Ag6 Ag7 Ag5 118.73(8) . 3_665 ? Ag8 Ag7 Ag5 171.10(9) . 3_665 ? Ag5 Ag7 Ag5 74.92(7) . 3_665 ? O3W Ag8 O39 111.0(9) . 1_565 ? O3W Ag8 C24 99.1(7) . . ? O39 Ag8 C24 105.9(8) 1_565 . ? O3W Ag8 O18 102.7(7) . 3_665 ? O39 Ag8 O18 119.2(8) 1_565 3_665 ? C24 Ag8 O18 117.1(6) . 3_665 ? O3W Ag8 Ag7 147.5(6) . . ? O39 Ag8 Ag7 82.8(7) 1_565 . ? C24 Ag8 Ag7 48.4(4) . . ? O18 Ag8 Ag7 94.9(4) 3_665 . ? O3W Ag8 Ag6 101.2(6) . . ? O39 Ag8 Ag6 66.4(7) 1_565 . ? C24 Ag8 Ag6 41.6(4) . . ? O18 Ag8 Ag6 150.6(4) 3_665 . ? Ag7 Ag8 Ag6 56.18(6) . . ? C8 Ag9 N4 170.6(6) 1_545 . ? C8 Ag9 O5 117.3(6) 1_545 . ? N4 Ag9 O5 70.4(4) . . ? C8 Ag9 Ag11 51.5(5) 1_545 . ? N4 Ag9 Ag11 119.1(3) . . ? O5 Ag9 Ag11 153.7(3) . . ? C8 Ag9 Ag16 50.2(6) 1_545 . ? N4 Ag9 Ag16 127.8(3) . . ? O5 Ag9 Ag16 88.8(3) . . ? Ag11 Ag9 Ag16 65.86(13) . . ? C8 Ag9 Ag27 57.9(6) 1_545 . ? N4 Ag9 Ag27 113.6(4) . . ? O5 Ag9 Ag27 126.8(4) . . ? Ag11 Ag9 Ag27 27.8(2) . . ? Ag16 Ag9 Ag27 45.0(2) . . ? C8 Ag9 Ag10 50.0(6) 1_545 . ? N4 Ag9 Ag10 138.6(3) . . ? O5 Ag9 Ag10 86.3(3) . . ? Ag11 Ag9 Ag10 96.97(10) . . ? Ag16 Ag9 Ag10 83.63(9) . . ? Ag27 Ag9 Ag10 107.84(16) . . ? C8 Ag9 Ag26 49.0(5) 1_545 . ? N4 Ag9 Ag26 123.9(3) . . ? O5 Ag9 Ag26 165.0(3) . . ? Ag11 Ag9 Ag26 27.41(15) . . ? Ag16 Ag9 Ag26 84.84(16) . . ? Ag27 Ag9 Ag26 54.7(2) . . ? Ag10 Ag9 Ag26 79.56(11) . . ? C8 Ag9 Ag28 54.3(6) 1_545 . ? N4 Ag9 Ag28 126.8(3) . . ? O5 Ag9 Ag28 75.5(3) . . ? Ag11 Ag9 Ag28 80.05(14) . . ? Ag16 Ag9 Ag28 15.12(10) . . ? Ag27 Ag9 Ag28 60.1(2) . . ? Ag10 Ag9 Ag28 75.89(12) . . ? Ag26 Ag9 Ag28 96.15(18) . . ? O34 Ag10 C8 142.5(7) . 1_545 ? O34 Ag10 O24 84.9(7) . 3_655 ? C8 Ag10 O24 125.4(5) 1_545 3_655 ? O34 Ag10 C7 169.1(6) . 1_545 ? C8 Ag10 C7 27.9(4) 1_545 1_545 ? O24 Ag10 C7 101.0(5) 3_655 1_545 ? O34 Ag10 Ag9 99.3(6) . . ? C8 Ag10 Ag9 43.2(4) 1_545 . ? O24 Ag10 Ag9 145.9(4) 3_655 . ? C7 Ag10 Ag9 70.7(3) 1_545 . ? Ag27 Ag11 Ag26 161.5(5) . . ? Ag27 Ag11 C8 86.3(7) . 1_545 ? Ag26 Ag11 C8 75.2(6) . 1_545 ? Ag27 Ag11 O31 91.9(5) . . ? Ag26 Ag11 O31 97.4(5) . . ? C8 Ag11 O31 121.8(6) 1_545 . ? Ag27 Ag11 O30A 65.2(14) . . ? Ag26 Ag11 O30A 127.2(12) . . ? C8 Ag11 O30A 127.1(18) 1_545 . ? O31 Ag11 O30A 103.6(15) . . ? Ag27 Ag11 Ag9 81.4(4) . . ? Ag26 Ag11 Ag9 86.1(3) . . ? C8 Ag11 Ag9 46.6(4) 1_545 . ? O31 Ag11 Ag9 166.7(4) . . ? O30A Ag11 Ag9 84.1(16) . . ? Ag27 Ag11 Ag16 40.3(4) . . ? Ag26 Ag11 Ag16 121.1(3) . . ? C8 Ag11 Ag16 46.1(6) 1_545 . ? O31 Ag11 Ag16 109.3(4) . . ? O30A Ag11 Ag16 96.5(17) . . ? Ag9 Ag11 Ag16 58.45(9) . . ? C48 Ag12 O19 117.1(6) 2_655 . ? C48 Ag12 O31 105.2(6) 2_655 . ? O19 Ag12 O31 118.0(6) . . ? C48 Ag12 O28 134.2(6) 2_655 . ? O19 Ag12 O28 101.6(6) . . ? O31 Ag12 O28 73.9(5) . . ? C48 Ag12 C47 26.6(4) 2_655 2_655 ? O19 Ag12 C47 90.6(6) . 2_655 ? O31 Ag12 C47 121.5(5) . 2_655 ? O28 Ag12 C47 152.8(6) . 2_655 ? C48 Ag12 Ag19 45.8(4) 2_655 . ? O19 Ag12 Ag19 157.5(5) . . ? O31 Ag12 Ag19 64.8(4) . . ? O28 Ag12 Ag19 100.5(4) . . ? C47 Ag12 Ag19 71.2(4) 2_655 . ? C48 Ag12 Ag18 44.9(5) 2_655 . ? O19 Ag12 Ag18 125.1(5) . . ? O31 Ag12 Ag18 116.9(4) . . ? O28 Ag12 Ag18 93.5(4) . . ? C47 Ag12 Ag18 59.9(4) 2_655 . ? Ag19 Ag12 Ag18 57.24(6) . . ? C16 Ag13 O40 163.0(5) 1_445 3 ? C16 Ag13 O6 118.1(4) 1_445 . ? O40 Ag13 O6 75.1(4) 3 . ? C16 Ag13 O6 108.5(4) 1_445 3 ? O40 Ag13 O6 78.0(4) 3 3 ? O6 Ag13 O6 99.0(3) . 3 ? C16 Ag13 Ag14 46.0(3) 1_445 . ? O40 Ag13 Ag14 129.0(3) 3 . ? O6 Ag13 Ag14 89.5(3) . . ? O6 Ag13 Ag14 153.0(3) 3 . ? C16 Ag13 Ag15 49.1(4) 1_445 . ? O40 Ag13 Ag15 147.1(4) 3 . ? O6 Ag13 Ag15 73.1(3) . . ? O6 Ag13 Ag15 98.6(3) 3 . ? Ag14 Ag13 Ag15 59.26(6) . . ? C16 Ag13 Ag13 127.3(4) 1_445 3 ? O40 Ag13 Ag13 69.0(4) 3 3 ? O6 Ag13 Ag13 49.7(3) . 3 ? O6 Ag13 Ag13 49.3(3) 3 3 ? Ag14 Ag13 Ag13 132.93(9) . 3 ? Ag15 Ag13 Ag13 83.86(8) . 3 ? C16 Ag14 N3 158.3(5) 1_445 . ? C16 Ag14 O8 115.9(5) 1_445 . ? N3 Ag14 O8 70.2(4) . . ? C16 Ag14 Ag15 50.4(4) 1_445 . ? N3 Ag14 Ag15 116.9(3) . . ? O8 Ag14 Ag15 75.8(3) . . ? C16 Ag14 Ag13 51.0(4) 1_445 . ? N3 Ag14 Ag13 108.4(3) . . ? O8 Ag14 Ag13 130.4(3) . . ? Ag15 Ag14 Ag13 60.61(6) . . ? C16 Ag14 Ag24 50.1(4) 1_445 . ? N3 Ag14 Ag24 148.0(3) . . ? O8 Ag14 Ag24 81.3(3) . . ? Ag15 Ag14 Ag24 67.32(6) . . ? Ag13 Ag14 Ag24 100.96(6) . . ? C16 Ag15 O5 126.0(5) 1_445 . ? C16 Ag15 O37 122.9(6) 1_445 . ? O5 Ag15 O37 100.2(6) . . ? C16 Ag15 O40 112.1(5) 1_445 . ? O5 Ag15 O40 81.2(4) . . ? O37 Ag15 O40 105.8(5) . . ? C16 Ag15 Ag14 46.6(3) 1_445 . ? O5 Ag15 Ag14 85.3(3) . . ? O37 Ag15 Ag14 120.4(5) . . ? O40 Ag15 Ag14 133.4(3) . . ? C16 Ag15 Ag13 50.3(4) 1_445 . ? O5 Ag15 Ag13 88.4(3) . . ? O37 Ag15 Ag13 171.4(5) . . ? O40 Ag15 Ag13 75.0(3) . . ? Ag14 Ag15 Ag13 60.13(6) . . ? C16 Ag15 Ag24 44.5(4) 1_445 . ? O5 Ag15 Ag24 133.3(3) . . ? O37 Ag15 Ag24 80.2(5) . . ? O40 Ag15 Ag24 144.2(3) . . ? Ag14 Ag15 Ag24 56.95(5) . . ? Ag13 Ag15 Ag24 94.10(7) . . ? Ag28 Ag16 O11 85.8(6) . . ? Ag28 Ag16 Ag27 167.5(6) . . ? O11 Ag16 Ag27 106.5(4) . . ? Ag28 Ag16 C8 103.3(8) . 1_545 ? O11 Ag16 C8 118.0(5) . 1_545 ? Ag27 Ag16 C8 69.2(6) . 1_545 ? Ag28 Ag16 O7 113.0(6) . . ? O11 Ag16 O7 118.4(6) . . ? Ag27 Ag16 O7 63.6(4) . . ? C8 Ag16 O7 113.6(6) 1_545 . ? Ag28 Ag16 C7 96.6(6) . 1_545 ? O11 Ag16 C7 90.7(5) . 1_545 ? Ag27 Ag16 C7 81.3(4) . 1_545 ? C8 Ag16 C7 28.0(4) 1_545 1_545 ? O7 Ag16 C7 138.9(5) . 1_545 ? Ag28 Ag16 Ag9 99.1(6) . . ? O11 Ag16 Ag9 163.0(4) . . ? Ag27 Ag16 Ag9 68.5(3) . . ? C8 Ag16 Ag9 45.1(4) 1_545 . ? O7 Ag16 Ag9 74.8(4) . . ? C7 Ag16 Ag9 72.7(3) 1_545 . ? Ag28 Ag16 Ag11 148.1(6) . . ? O11 Ag16 Ag11 113.3(4) . . ? Ag27 Ag16 Ag11 23.6(3) . . ? C8 Ag16 Ag11 45.7(5) 1_545 . ? O7 Ag16 Ag11 81.3(4) . . ? C7 Ag16 Ag11 59.6(3) 1_545 . ? Ag9 Ag16 Ag11 55.69(10) . . ? Ag28 Ag16 Ag22 69.3(6) . . ? O11 Ag16 Ag22 54.9(4) . . ? Ag27 Ag16 Ag22 119.4(3) . . ? C8 Ag16 Ag22 169.2(5) 1_545 . ? O7 Ag16 Ag22 77.0(4) . . ? C7 Ag16 Ag22 142.6(3) 1_545 . ? Ag9 Ag16 Ag22 141.96(11) . . ? Ag11 Ag16 Ag22 142.46(17) . . ? Ag28 Ag16 Ag17 126.8(6) . . ? O11 Ag16 Ag17 70.1(4) . . ? Ag27 Ag16 Ag17 61.6(3) . . ? C8 Ag16 Ag17 129.9(5) 1_545 . ? O7 Ag16 Ag17 51.3(4) . . ? C7 Ag16 Ag17 129.0(4) 1_545 . ? Ag9 Ag16 Ag17 117.83(14) . . ? Ag11 Ag16 Ag17 84.64(14) . . ? Ag22 Ag16 Ag17 57.90(7) . . ? C40 Ag17 O12 119.6(5) 2 . ? C40 Ag17 O28 162.3(5) 2 . ? O12 Ag17 O28 78.1(6) . . ? C40 Ag17 O7 99.5(6) 2 . ? O12 Ag17 O7 107.6(5) . . ? O28 Ag17 O7 72.1(5) . . ? C40 Ag17 C39 26.9(4) 2 2 ? O12 Ag17 C39 146.3(5) . 2 ? O28 Ag17 C39 135.4(5) . 2 ? O7 Ag17 C39 85.0(5) . 2 ? C40 Ag17 Ag27 144.9(5) 2 . ? O12 Ag17 Ag27 62.7(4) . . ? O28 Ag17 Ag27 39.6(4) . . ? O7 Ag17 Ag27 52.3(4) . . ? C39 Ag17 Ag27 137.3(4) 2 . ? C40 Ag17 Ag22 45.2(4) 2 . ? O12 Ag17 Ag22 91.1(3) . . ? O28 Ag17 Ag22 140.8(4) . . ? O7 Ag17 Ag22 75.8(4) . . ? C39 Ag17 Ag22 61.1(3) 2 . ? Ag27 Ag17 Ag22 102.12(18) . . ? C40 Ag17 Ag21 41.7(4) 2 . ? O12 Ag17 Ag21 81.4(4) . . ? O28 Ag17 Ag21 153.7(4) . . ? O7 Ag17 Ag21 130.6(4) . . ? C39 Ag17 Ag21 67.3(3) 2 . ? Ag27 Ag17 Ag21 138.12(16) . . ? Ag22 Ag17 Ag21 55.29(5) . . ? C40 Ag17 Ag16 103.9(5) 2 . ? O12 Ag17 Ag16 65.2(4) . . ? O28 Ag17 Ag16 81.9(4) . . ? O7 Ag17 Ag16 46.7(4) . . ? C39 Ag17 Ag16 109.5(4) 2 . ? Ag27 Ag17 Ag16 42.57(19) . . ? Ag22 Ag17 Ag16 59.60(9) . . ? Ag21 Ag17 Ag16 104.26(9) . . ? C48 Ag18 O9 128.5(6) 2_655 . ? C48 Ag18 O13 125.5(6) 2_655 2_645 ? O9 Ag18 O13 80.1(5) . 2_645 ? C48 Ag18 O25 127.1(8) 2_655 . ? O9 Ag18 O25 93.0(6) . . ? O13 Ag18 O25 88.3(6) 2_645 . ? C48 Ag18 Ag29 51.4(6) 2_655 . ? O9 Ag18 Ag29 94.7(3) . . ? O13 Ag18 Ag29 86.0(4) 2_645 . ? O25 Ag18 Ag29 169.5(6) . . ? C48 Ag18 Ag19 46.7(5) 2_655 . ? O9 Ag18 Ag19 87.1(3) . . ? O13 Ag18 Ag19 148.7(3) 2_645 . ? O25 Ag18 Ag19 121.0(5) . . ? Ag29 Ag18 Ag19 66.63(18) . . ? C48 Ag18 Ag12 48.0(5) 2_655 . ? O9 Ag18 Ag12 132.3(3) . . ? O13 Ag18 Ag12 145.9(4) 2_645 . ? O25 Ag18 Ag12 80.6(5) . . ? Ag29 Ag18 Ag12 99.33(17) . . ? Ag19 Ag18 Ag12 58.41(6) . . ? C48 Ag18 Ag20 45.5(5) 2_655 . ? O9 Ag18 Ag20 92.9(3) . . ? O13 Ag18 Ag20 97.2(4) 2_645 . ? O25 Ag18 Ag20 172.7(5) . . ? Ag29 Ag18 Ag20 11.76(17) . . ? Ag19 Ag18 Ag20 54.89(10) . . ? Ag12 Ag18 Ag20 92.16(10) . . ? C48 Ag19 N6 156.5(6) 2_655 . ? C48 Ag19 O12 120.4(6) 2_655 . ? N6 Ag19 O12 68.3(5) . . ? C48 Ag19 Ag20 53.1(6) 2_655 . ? N6 Ag19 Ag20 105.5(4) . . ? O12 Ag19 Ag20 140.8(4) . . ? C48 Ag19 Ag18 48.9(5) 2_655 . ? N6 Ag19 Ag18 118.7(4) . . ? O12 Ag19 Ag18 80.6(3) . . ? Ag20 Ag19 Ag18 68.62(12) . . ? C48 Ag19 Ag12 51.4(5) 2_655 . ? N6 Ag19 Ag12 148.3(4) . . ? O12 Ag19 Ag12 82.0(3) . . ? Ag20 Ag19 Ag12 104.50(11) . . ? Ag18 Ag19 Ag12 64.35(6) . . ? C48 Ag19 Ag29 44.2(5) 2_655 . ? N6 Ag19 Ag29 112.5(4) . . ? O12 Ag19 Ag29 127.7(4) . . ? Ag20 Ag19 Ag29 16.49(15) . . ? Ag18 Ag19 Ag29 52.15(18) . . ? Ag12 Ag19 Ag29 94.08(14) . . ? Ag29 Ag20 O20 97.1(7) . 2_645 ? Ag29 Ag20 C48 66.3(7) . 2_655 ? O20 Ag20 C48 163.0(7) 2_645 2_655 ? Ag29 Ag20 Ag19 94.4(5) . . ? O20 Ag20 Ag19 143.3(4) 2_645 . ? C48 Ag20 Ag19 47.2(4) 2_655 . ? Ag29 Ag20 Ag18 38.0(5) . . ? O20 Ag20 Ag18 125.4(4) 2_645 . ? C48 Ag20 Ag18 42.7(5) 2_655 . ? Ag19 Ag20 Ag18 56.49(9) . . ? C40 Ag21 N5 164.3(6) 2 . ? C40 Ag21 O9 120.8(6) 2 . ? N5 Ag21 O9 71.7(4) . . ? C40 Ag21 Ag22 49.5(5) 2 . ? N5 Ag21 Ag22 115.2(3) . . ? O9 Ag21 Ag22 137.1(3) . . ? C40 Ag21 Ag23 54.5(5) 2 . ? N5 Ag21 Ag23 117.8(3) . . ? O9 Ag21 Ag23 158.6(3) . . ? Ag22 Ag21 Ag23 59.00(7) . . ? C40 Ag21 Ag17 48.7(5) 2 . ? N5 Ag21 Ag17 131.6(4) . . ? O9 Ag21 Ag17 81.9(3) . . ? Ag22 Ag21 Ag17 61.87(6) . . ? Ag23 Ag21 Ag17 101.61(7) . . ? C40 Ag22 O1WA 173.8(9) 2 . ? C40 Ag22 O1W 163.8(11) 2 . ? O1WA Ag22 O1W 11.2(15) . . ? C40 Ag22 O8 103.1(5) 2 . ? O1WA Ag22 O8 78.4(9) . . ? O1W Ag22 O8 88.1(8) . . ? C40 Ag22 Ag21 45.9(4) 2 . ? O1WA Ag22 Ag21 134.7(8) . . ? O1W Ag22 Ag21 126.6(7) . . ? O8 Ag22 Ag21 143.9(3) . . ? C40 Ag22 Ag23 55.7(5) 2 . ? O1WA Ag22 Ag23 118.3(9) . . ? O1W Ag22 Ag23 108.4(9) . . ? O8 Ag22 Ag23 120.8(3) . . ? Ag21 Ag22 Ag23 62.36(7) . . ? C40 Ag22 Ag28 125.2(5) 2 . ? O1WA Ag22 Ag28 60.4(9) . . ? O1W Ag22 Ag28 71.0(9) . . ? O8 Ag22 Ag28 50.9(3) . . ? Ag21 Ag22 Ag28 125.20(13) . . ? Ag23 Ag22 Ag28 171.38(13) . . ? C40 Ag22 Ag17 49.1(5) 2 . ? O1WA Ag22 Ag17 137.0(8) . . ? O1W Ag22 Ag17 145.7(8) . . ? O8 Ag22 Ag17 83.0(3) . . ? Ag21 Ag22 Ag17 62.83(6) . . ? Ag23 Ag22 Ag17 104.54(7) . . ? Ag28 Ag22 Ag17 77.76(12) . . ? C40 Ag22 Ag16 110.6(5) 2 . ? O1WA Ag22 Ag16 75.2(9) . . ? O1W Ag22 Ag16 85.5(9) . . ? O8 Ag22 Ag16 54.4(3) . . ? Ag21 Ag22 Ag16 112.58(10) . . ? Ag23 Ag22 Ag16 165.62(11) . . ? Ag28 Ag22 Ag16 15.36(10) . . ? Ag17 Ag22 Ag16 62.50(10) . . ? O27 Ag23 O46 131.9(8) 2_545 . ? O27 Ag23 O45 102.3(8) 2_545 . ? O46 Ag23 O45 93.3(6) . . ? O27 Ag23 C40 108.6(8) 2_545 2 ? O46 Ag23 C40 100.8(7) . 2 ? O45 Ag23 C40 121.3(6) . 2 ? O27 Ag23 Ag22 71.0(7) 2_545 . ? O46 Ag23 Ag22 148.5(5) . . ? O45 Ag23 Ag22 102.9(4) . . ? C40 Ag23 Ag22 47.7(5) 2 . ? O27 Ag23 Ag21 77.7(7) 2_545 . ? O46 Ag23 Ag21 100.9(5) . . ? O45 Ag23 Ag21 160.8(4) . . ? C40 Ag23 Ag21 43.5(4) 2 . ? Ag22 Ag23 Ag21 58.64(6) . . ? C16 Ag24 O43 115.3(6) 1_445 . ? C16 Ag24 O1WA 124.6(9) 1_445 . ? O43 Ag24 O1WA 76.8(10) . . ? C16 Ag24 O1W 134.8(9) 1_445 . ? O43 Ag24 O1W 74.4(10) . . ? O1WA Ag24 O1W 10.3(14) . . ? C16 Ag24 O15 118.6(9) 1_445 1_445 ? O43 Ag24 O15 124.8(8) . 1_445 ? O1WA Ag24 O15 82.5(14) . 1_445 ? O1W Ag24 O15 76.4(14) . 1_445 ? C16 Ag24 O14 144.3(5) 1_445 1_445 ? O43 Ag24 O14 81.6(6) . 1_445 ? O1WA Ag24 O14 88.9(10) . 1_445 ? O1W Ag24 O14 78.6(10) . 1_445 ? O15 Ag24 O14 47.2(6) 1_445 1_445 ? C16 Ag24 C15 26.9(3) 1_445 1_445 ? O43 Ag24 C15 132.4(5) . 1_445 ? O1WA Ag24 C15 139.6(10) . 1_445 ? O1W Ag24 C15 147.2(10) . 1_445 ? O15 Ag24 C15 95.2(10) 1_445 1_445 ? O14 Ag24 C15 118.8(5) 1_445 1_445 ? C16 Ag24 Ag14 45.8(3) 1_445 . ? O43 Ag24 Ag14 72.1(4) . . ? O1WA Ag24 Ag14 101.1(9) . . ? O1W Ag24 Ag14 109.4(9) . . ? O15 Ag24 Ag14 162.9(6) 1_445 . ? O14 Ag24 Ag14 148.6(4) 1_445 . ? C15 Ag24 Ag14 71.1(3) 1_445 . ? C16 Ag24 Ag15 44.0(4) 1_445 . ? O43 Ag24 Ag15 117.3(4) . . ? O1WA Ag24 Ag15 81.4(9) . . ? O1W Ag24 Ag15 91.3(9) . . ? O15 Ag24 Ag15 109.0(6) 1_445 . ? O14 Ag24 Ag15 155.6(4) 1_445 . ? C15 Ag24 Ag15 61.1(3) 1_445 . ? Ag14 Ag24 Ag15 55.73(5) . . ? Ag3 Ag25 O13 108.4(17) . . ? Ag3 Ag25 C32 84.9(15) . 1_655 ? O13 Ag25 C32 163.6(10) . 1_655 ? Ag3 Ag25 O1 64.7(16) . . ? O13 Ag25 O1 79.9(6) . . ? C32 Ag25 O1 115.3(7) 1_655 . ? Ag3 Ag25 Ag2 107.9(17) . . ? O13 Ag25 Ag2 131.8(7) . . ? C32 Ag25 Ag2 47.6(4) 1_655 . ? O1 Ag25 Ag2 88.0(5) . . ? Ag3 Ag25 Ag4 52.0(14) . . ? O13 Ag25 Ag4 150.5(8) . . ? C32 Ag25 Ag4 45.9(4) 1_655 . ? O1 Ag25 Ag4 71.7(5) . . ? Ag2 Ag25 Ag4 56.2(2) . . ? Ag3 Ag25 Ag29 34.3(14) . 2_655 ? O13 Ag25 Ag29 74.8(6) . 2_655 ? C32 Ag25 Ag29 119.2(7) 1_655 2_655 ? O1 Ag25 Ag29 50.6(4) . 2_655 ? Ag2 Ag25 Ag29 129.3(5) . 2_655 ? Ag4 Ag25 Ag29 81.0(4) . 2_655 ? Ag11 Ag26 O36 158.0(6) . 3_655 ? Ag11 Ag26 C8 68.6(6) . 1_545 ? O36 Ag26 C8 95.8(7) 3_655 1_545 ? Ag11 Ag26 O33 98.6(5) . . ? O36 Ag26 O33 78.7(6) 3_655 . ? C8 Ag26 O33 128.7(6) 1_545 . ? Ag11 Ag26 Ag27 9.2(2) . . ? O36 Ag26 Ag27 150.8(5) 3_655 . ? C8 Ag26 Ag27 59.4(6) 1_545 . ? O33 Ag26 Ag27 104.0(5) . . ? Ag11 Ag26 Ag9 66.5(2) . . ? O36 Ag26 Ag9 112.8(5) 3_655 . ? C8 Ag26 Ag9 42.4(4) 1_545 . ? O33 Ag26 Ag9 164.2(5) . . ? Ag27 Ag26 Ag9 60.5(2) . . ? Ag11 Ag27 O28 112.1(8) . . ? Ag11 Ag27 Ag16 116.0(5) . . ? O28 Ag27 Ag16 131.7(8) . . ? Ag11 Ag27 O30A 81.4(14) . . ? O28 Ag27 O30A 55.3(11) . . ? Ag16 Ag27 O30A 136.2(19) . . ? Ag11 Ag27 O7 140.7(7) . . ? O28 Ag27 O7 84.9(8) . . ? Ag16 Ag27 O7 60.6(5) . . ? O30A Ag27 O7 80.4(19) . . ? Ag11 Ag27 C8 60.7(5) . 1_545 ? O28 Ag27 C8 172.7(9) . 1_545 ? Ag16 Ag27 C8 55.4(5) . 1_545 ? O30A Ag27 C8 121.8(10) . 1_545 ? O7 Ag27 C8 101.4(7) . 1_545 ? Ag11 Ag27 Ag26 9.4(2) . . ? O28 Ag27 Ag26 121.4(7) . . ? Ag16 Ag27 Ag26 106.7(3) . . ? O30A Ag27 Ag26 88.2(12) . . ? O7 Ag27 Ag26 137.1(6) . . ? C8 Ag27 Ag26 51.4(5) 1_545 . ? Ag11 Ag27 Ag17 162.4(6) . . ? O28 Ag27 Ag17 56.4(6) . . ? Ag16 Ag27 Ag17 75.9(3) . . ? O30A Ag27 Ag17 99.0(10) . . ? O7 Ag27 Ag17 55.7(5) . . ? C8 Ag27 Ag17 130.3(5) 1_545 . ? Ag26 Ag27 Ag17 166.7(4) . . ? Ag11 Ag27 Ag9 70.8(4) . . ? O28 Ag27 Ag9 137.4(7) . . ? Ag16 Ag27 Ag9 66.5(2) . . ? O30A Ag27 Ag9 84.8(13) . . ? O7 Ag27 Ag9 73.1(5) . . ? C8 Ag27 Ag9 43.4(4) 1_545 . ? Ag26 Ag27 Ag9 64.7(2) . . ? Ag17 Ag27 Ag9 126.8(4) . . ? Ag11 Ag27 Ag28 114.2(5) . . ? O28 Ag27 Ag28 133.7(7) . . ? Ag16 Ag27 Ag28 3.37(17) . . ? O30A Ag27 Ag28 133.9(19) . . ? O7 Ag27 Ag28 59.9(5) . . ? C8 Ag27 Ag28 53.5(5) 1_545 . ? Ag26 Ag27 Ag28 104.9(3) . . ? Ag17 Ag27 Ag28 78.3(3) . . ? Ag9 Ag27 Ag28 63.1(2) . . ? Ag16 Ag28 O11 73.4(6) . . ? Ag16 Ag28 O37 153.9(8) . . ? O11 Ag28 O37 111.9(6) . . ? Ag16 Ag28 O8 98.8(6) . . ? O11 Ag28 O8 112.0(5) . . ? O37 Ag28 O8 102.3(6) . . ? Ag16 Ag28 C8 58.3(7) . 1_545 ? O11 Ag28 C8 103.3(5) . 1_545 ? O37 Ag28 C8 96.0(7) . 1_545 ? O8 Ag28 C8 129.9(5) . 1_545 ? Ag16 Ag28 Ag22 95.3(6) . . ? O11 Ag28 Ag22 57.7(4) . . ? O37 Ag28 Ag22 109.2(5) . . ? O8 Ag28 Ag22 56.1(3) . . ? C8 Ag28 Ag22 152.5(5) 1_545 . ? Ag16 Ag28 Ag27 9.1(5) . . ? O11 Ag28 Ag27 82.4(4) . . ? O37 Ag28 Ag27 148.8(6) . . ? O8 Ag28 Ag27 97.1(4) . . ? C8 Ag28 Ag27 53.0(5) 1_545 . ? Ag22 Ag28 Ag27 101.9(3) . . ? Ag16 Ag28 Ag9 65.8(5) . . ? O11 Ag28 Ag9 136.2(4) . . ? O37 Ag28 Ag9 98.8(5) . . ? O8 Ag28 Ag9 90.0(3) . . ? C8 Ag28 Ag9 40.9(3) 1_545 . ? Ag22 Ag28 Ag9 139.24(17) . . ? Ag27 Ag28 Ag9 56.7(2) . . ? Ag20 Ag29 C48 91.8(8) . 2_655 ? Ag20 Ag29 O20 62.5(6) . 2_645 ? C48 Ag29 O20 154.0(8) 2_655 2_645 ? Ag20 Ag29 O1 131.7(7) . 2_645 ? C48 Ag29 O1 110.5(6) 2_655 2_645 ? O20 Ag29 O1 86.6(5) 2_645 2_645 ? Ag20 Ag29 O10 99.3(7) . . ? C48 Ag29 O10 119.7(6) 2_655 . ? O20 Ag29 O10 71.6(5) 2_645 . ? O1 Ag29 O10 104.9(5) 2_645 . ? Ag20 Ag29 C47 98.6(8) . 2_655 ? C48 Ag29 C47 27.7(5) 2_655 2_655 ? O20 Ag29 C47 145.2(6) 2_645 2_655 ? O1 Ag29 C47 86.4(5) 2_645 2_655 ? O10 Ag29 C47 142.9(6) . 2_655 ? Ag20 Ag29 Ag18 130.2(6) . . ? C48 Ag29 Ag18 54.1(5) 2_655 . ? O20 Ag29 Ag18 146.2(4) 2_645 . ? O1 Ag29 Ag18 96.4(4) 2_645 . ? O10 Ag29 Ag18 75.1(4) . . ? C47 Ag29 Ag18 68.5(5) 2_655 . ? Ag20 Ag29 Ag3 129.4(6) . 2_645 ? C48 Ag29 Ag3 137.6(7) 2_655 2_645 ? O20 Ag29 Ag3 68.4(4) 2_645 2_645 ? O1 Ag29 Ag3 52.7(4) 2_645 2_645 ? O10 Ag29 Ag3 52.4(3) . 2_645 ? C47 Ag29 Ag3 129.9(6) 2_655 2_645 ? Ag18 Ag29 Ag3 86.7(3) . 2_645 ? Ag20 Ag29 Ag19 69.1(5) . . ? C48 Ag29 Ag19 44.3(5) 2_655 . ? O20 Ag29 Ag19 120.9(4) 2_645 . ? O1 Ag29 Ag19 152.5(4) 2_645 . ? O10 Ag29 Ag19 85.6(3) . . ? C47 Ag29 Ag19 71.0(4) 2_655 . ? Ag18 Ag29 Ag19 61.22(13) . . ? Ag3 Ag29 Ag19 133.6(3) 2_645 . ? Ag20 Ag29 Ag25 136.6(7) . 2_645 ? C48 Ag29 Ag25 130.2(7) 2_655 2_645 ? O20 Ag29 Ag25 75.7(4) 2_645 2_645 ? O1 Ag29 Ag25 50.7(4) 2_645 2_645 ? O10 Ag29 Ag25 54.4(4) . 2_645 ? C47 Ag29 Ag25 123.3(6) 2_655 2_645 ? Ag18 Ag29 Ag25 80.3(3) . 2_645 ? Ag3 Ag29 Ag25 7.4(3) 2_645 2_645 ? Ag19 Ag29 Ag25 131.1(4) . 2_645 ? O1 C1 O2 128.9(15) . . ? O1 C1 C2 115.9(14) . . ? O2 C1 C2 115.2(12) . . ? N1 C2 C3 121.3(13) . . ? N1 C2 C1 117.2(12) . . ? C3 C2 C1 121.4(13) . . ? C4 C3 C2 120.4(14) . . ? C3 C4 C5 117.4(15) . . ? C4 C5 C6 119.9(13) . . ? C4 C5 C7 123.5(14) . . ? C6 C5 C7 116.6(13) . . ? N1 C6 C5 122.8(14) . . ? C8 C7 C5 178.6(18) . . ? C8 C7 Ag16 62.6(13) . 1_565 ? C5 C7 Ag16 118.3(10) . 1_565 ? C8 C7 Ag10 65.9(13) . 1_565 ? C5 C7 Ag10 114.6(10) . 1_565 ? Ag16 C7 Ag10 102.7(5) 1_565 1_565 ? C7 C8 Ag9 167.1(15) . 1_565 ? C7 C8 Ag11 109.5(13) . 1_565 ? Ag9 C8 Ag11 81.9(6) 1_565 1_565 ? C7 C8 Ag16 89.5(13) . 1_565 ? Ag9 C8 Ag16 84.7(7) 1_565 1_565 ? Ag11 C8 Ag16 88.3(8) 1_565 1_565 ? C7 C8 Ag26 104.1(13) . 1_565 ? Ag9 C8 Ag26 88.6(6) 1_565 1_565 ? Ag11 C8 Ag26 36.2(3) 1_565 1_565 ? Ag16 C8 Ag26 124.4(10) 1_565 1_565 ? C7 C8 Ag10 86.2(14) . 1_565 ? Ag9 C8 Ag10 86.8(7) 1_565 1_565 ? Ag11 C8 Ag10 148.3(9) 1_565 1_565 ? Ag16 C8 Ag10 120.1(8) 1_565 1_565 ? Ag26 C8 Ag10 114.5(9) 1_565 1_565 ? C7 C8 Ag27 107.3(15) . 1_565 ? Ag9 C8 Ag27 78.7(6) 1_565 1_565 ? Ag11 C8 Ag27 33.0(4) 1_565 1_565 ? Ag16 C8 Ag27 55.4(6) 1_565 1_565 ? Ag26 C8 Ag27 69.2(6) 1_565 1_565 ? Ag10 C8 Ag27 165.0(7) 1_565 1_565 ? C7 C8 Ag28 86.0(13) . 1_565 ? Ag9 C8 Ag28 84.9(6) 1_565 1_565 ? Ag11 C8 Ag28 106.4(9) 1_565 1_565 ? Ag16 C8 Ag28 18.4(2) 1_565 1_565 ? Ag26 C8 Ag28 142.7(10) 1_565 1_565 ? Ag10 C8 Ag28 101.8(7) 1_565 1_565 ? Ag27 C8 Ag28 73.5(7) 1_565 1_565 ? O4 C9 O3 123.9(15) . . ? O4 C9 C10 117.7(14) . . ? O3 C9 C10 118.2(14) . . ? N2 C10 C11 122.4(13) . . ? N2 C10 C9 119.8(12) . . ? C11 C10 C9 117.8(14) . . ? C10 C11 C12 118.1(15) . . ? C13 C12 C11 117.9(14) . . ? C14 C13 C12 120.7(13) . . ? C14 C13 C15 120.3(13) . . ? C12 C13 C15 118.9(13) . . ? N2 C14 C13 121.7(13) . . ? C16 C15 C13 177.1(16) . . ? C16 C15 Ag24 58.8(10) . 1_665 ? C13 C15 Ag24 122.4(10) . 1_665 ? C15 C16 Ag14 157.0(14) . 1_665 ? C15 C16 Ag15 120.0(13) . 1_665 ? Ag14 C16 Ag15 83.0(4) 1_665 1_665 ? C15 C16 Ag24 94.3(11) . 1_665 ? Ag14 C16 Ag24 84.0(5) 1_665 1_665 ? Ag15 C16 Ag24 91.5(5) 1_665 1_665 ? C15 C16 Ag13 100.2(11) . 1_665 ? Ag14 C16 Ag13 82.9(5) 1_665 1_665 ? Ag15 C16 Ag13 80.6(5) 1_665 1_665 ? Ag24 C16 Ag13 165.5(6) 1_665 1_665 ? O6 C17 O5 130.5(15) . . ? O6 C17 C18 114.9(14) . . ? O5 C17 C18 114.5(13) . . ? N4 C18 C19 121.8(12) . . ? N4 C18 C17 117.5(12) . . ? C19 C18 C17 120.6(12) . . ? C20 C19 C18 120.4(13) . . ? C19 C20 C21 118.0(14) . . ? C22 C21 C20 117.7(14) . . ? C22 C21 C23 121.1(14) . . ? C20 C21 C23 121.2(14) . . ? N4 C22 C21 125.1(14) . . ? C24 C23 C21 178(2) . . ? C24 C23 Ag5 65.6(11) . . ? C21 C23 Ag5 115.7(10) . . ? C23 C24 Ag6 158.5(16) . . ? C23 C24 Ag7 117.1(15) . . ? Ag6 C24 Ag7 82.9(5) . . ? C23 C24 Ag5 87.1(12) . . ? Ag6 C24 Ag5 86.1(6) . . ? Ag7 C24 Ag5 86.5(6) . . ? C23 C24 Ag8 103.5(13) . . ? Ag6 C24 Ag8 88.4(6) . . ? Ag7 C24 Ag8 76.6(5) . . ? Ag5 C24 Ag8 162.7(8) . . ? O8 C25 O7 123.7(16) . . ? O8 C25 C26 121.3(15) . . ? O7 C25 C26 114.9(16) . . ? N3 C26 C27 120.2(13) . . ? N3 C26 C25 117.1(13) . . ? C27 C26 C25 122.7(14) . . ? C28 C27 C26 119.6(15) . . ? C27 C28 C29 117.9(14) . . ? C30 C29 C28 120.3(15) . . ? C30 C29 C31 119.9(16) . . ? C28 C29 C31 119.7(15) . . ? N3 C30 C29 122.4(15) . . ? C32 C31 C29 175.4(18) . . ? C31 C32 Ag2 152.1(14) . 1_455 ? C31 C32 Ag4 127.2(13) . 1_455 ? Ag2 C32 Ag4 79.9(4) 1_455 1_455 ? C31 C32 Ag1 104.3(12) . 1_455 ? Ag2 C32 Ag1 81.7(5) 1_455 1_455 ? Ag4 C32 Ag1 85.9(5) 1_455 1_455 ? C31 C32 Ag25 95.1(12) . 1_455 ? Ag2 C32 Ag25 79.2(6) 1_455 1_455 ? Ag4 C32 Ag25 85.5(7) 1_455 1_455 ? Ag1 C32 Ag25 160.2(7) 1_455 1_455 ? C31 C32 Ag3 94.3(12) . 1_455 ? Ag2 C32 Ag3 87.1(5) 1_455 1_455 ? Ag4 C32 Ag3 73.8(5) 1_455 1_455 ? Ag1 C32 Ag3 158.3(7) 1_455 1_455 ? Ag25 C32 Ag3 15.4(4) 1_455 1_455 ? O9 C33 O10 126.1(16) . . ? O9 C33 C34 118.5(14) . . ? O10 C33 C34 115.2(15) . . ? C35 C34 N5 118.3(14) . . ? C35 C34 C33 124.3(14) . . ? N5 C34 C33 117.5(14) . . ? C34 C35 C36 122.6(14) . . ? C35 C36 C37 117.2(14) . . ? C38 C37 C36 119.5(13) . . ? C38 C37 C39 118.7(13) . . ? C36 C37 C39 121.8(14) . . ? N5 C38 C37 122.3(13) . . ? C40 C39 C37 178.2(19) . . ? C40 C39 Ag17 62.4(11) . 2_545 ? C37 C39 Ag17 118.6(11) . 2_545 ? C39 C40 Ag21 158.3(17) . 2_545 ? C39 C40 Ag22 117.0(15) . 2_545 ? Ag21 C40 Ag22 84.7(5) 2_545 2_545 ? C39 C40 Ag17 90.7(13) . 2_545 ? Ag21 C40 Ag17 89.6(6) 2_545 2_545 ? Ag22 C40 Ag17 85.7(7) 2_545 2_545 ? C39 C40 Ag23 103.4(13) . 2_545 ? Ag21 C40 Ag23 82.0(6) 2_545 2_545 ? Ag22 C40 Ag23 76.6(5) 2_545 2_545 ? Ag17 C40 Ag23 161.0(8) 2_545 2_545 ? O12 C41 O11 128.7(17) . . ? O12 C41 C42 117.3(14) . . ? O11 C41 C42 113.9(16) . . ? N6 C42 C43 123.5(16) . . ? N6 C42 C41 116.6(16) . . ? C43 C42 C41 119.8(14) . . ? C44 C43 C42 117.5(17) . . ? C43 C44 C45 122.1(18) . . ? C44 C45 C46 117.3(16) . . ? C44 C45 C47 125.7(19) . . ? C46 C45 C47 116.7(18) . . ? N6 C46 C45 122.0(17) . . ? C48 C47 C45 174(2) . . ? C48 C47 Ag29 55.1(12) . 2_645 ? C45 C47 Ag29 121.2(13) . 2_645 ? C48 C47 Ag12 59.6(13) . 2_645 ? C45 C47 Ag12 125.1(13) . 2_645 ? Ag29 C47 Ag12 113.1(6) 2_645 2_645 ? C47 C48 Ag29 97.3(14) . 2_645 ? C47 C48 Ag19 160.2(17) . 2_645 ? Ag29 C48 Ag19 91.5(8) 2_645 2_645 ? C47 C48 Ag18 115.0(16) . 2_645 ? Ag29 C48 Ag18 74.5(6) 2_645 2_645 ? Ag19 C48 Ag18 84.4(6) 2_645 2_645 ? C47 C48 Ag20 102.4(15) . 2_645 ? Ag29 C48 Ag20 21.9(3) 2_645 2_645 ? Ag19 C48 Ag20 79.7(7) 2_645 2_645 ? Ag18 C48 Ag20 91.8(7) 2_645 2_645 ? C47 C48 Ag12 93.9(15) . 2_645 ? Ag29 C48 Ag12 161.3(9) 2_645 2_645 ? Ag19 C48 Ag12 82.8(6) 2_645 2_645 ? Ag18 C48 Ag12 87.1(7) 2_645 2_645 ? Ag20 C48 Ag12 162.5(9) 2_645 2_645 ? C6 N1 C2 118.2(12) . . ? C6 N1 Ag6 122.5(10) . . ? C2 N1 Ag6 119.3(9) . . ? C10 N2 C14 119.1(12) . . ? C10 N2 Ag2 122.3(9) . . ? C14 N2 Ag2 118.4(9) . . ? C30 N3 C26 119.3(12) . . ? C30 N3 Ag14 121.3(10) . . ? C26 N3 Ag14 119.0(9) . . ? C22 N4 C18 116.9(12) . . ? C22 N4 Ag9 124.0(10) . . ? C18 N4 Ag9 119.1(9) . . ? C38 N5 C34 120.1(13) . . ? C38 N5 Ag21 123.3(10) . . ? C34 N5 Ag21 116.6(10) . . ? C42 N6 C46 117.5(17) . . ? C42 N6 Ag19 122.8(12) . . ? C46 N6 Ag19 119.3(12) . . ? O14 N7 O15A 106(3) . . ? O14 N7 O13 118(2) . . ? O15A N7 O13 129(3) . . ? O14 N7 O15 118(3) . . ? O15A N7 O15 41(3) . . ? O13 N7 O15 122(3) . . ? O18 N8 O17 124.3(19) . . ? O18 N8 O16 119.5(18) . . ? O17 N8 O16 115.4(18) . . ? O21 N9 O19 118(2) . . ? O21 N9 O20 122(2) . . ? O19 N9 O20 120(2) . . ? O24 N10 O23 121(2) . . ? O24 N10 O22 120.6(19) . . ? O23 N10 O22 118.6(18) . . ? O26 N11 O27 117(3) . . ? O26 N11 O25 128(3) . . ? O27 N11 O25 114(2) . . ? O29 N12 O28 112(4) . . ? O29 N12 O30 106(5) . . ? O28 N12 O30 142(4) . . ? O29 N12 O29A 22(5) . . ? O28 N12 O29A 127(3) . . ? O30 N12 O29A 90(4) . . ? O29 N12 O30A 136(6) . . ? O28 N12 O30A 108(4) . . ? O30 N12 O30A 36(4) . . ? O29A N12 O30A 125(3) . . ? O32 N13 O31 120.9(17) . . ? O32 N13 O33 119.2(18) . . ? O31 N13 O33 119.8(16) . . ? O36 N14 O35 123.2(19) . . ? O36 N14 O34 114.7(19) . . ? O35 N14 O34 122.0(19) . . ? O38 N15 O39 122(4) . . ? O38 N15 O37 122(4) . . ? O39 N15 O37 116(4) . . ? O41 N16 O42 121(2) . . ? O41 N16 O40 119(2) . . ? O42 N16 O40 120.8(19) . . ? O44 N17 O45 124(2) . . ? O44 N17 O43 119(2) . . ? O45 N17 O43 117(2) . . ? O47 N18 O46 114(3) . . ? O47 N18 O48 114(3) . . ? O46 N18 O48 132(3) . . ? C1 O1 Ag3 121.6(11) . . ? C1 O1 Ag29 122.5(12) . 2_655 ? Ag3 O1 Ag29 67.8(4) . 2_655 ? C1 O1 Ag25 124.0(12) . . ? Ag3 O1 Ag25 13.9(4) . . ? Ag29 O1 Ag25 78.7(5) 2_655 . ? C1 O2 Ag4 117.4(10) . . ? C1 O2 Ag6 116.2(9) . . ? Ag4 O2 Ag6 124.7(5) . . ? C9 O3 Ag5 106.0(10) . . ? C9 O4 Ag5 124.8(11) . 3_665 ? C17 O5 Ag15 116.6(10) . . ? C17 O5 Ag9 114.6(10) . . ? Ag15 O5 Ag9 128.8(5) . . ? C17 O6 Ag13 120.9(11) . . ? C17 O6 Ag13 126.7(11) . 3 ? Ag13 O6 Ag13 81.0(3) . 3 ? C25 O7 Ag16 96.9(13) . . ? C25 O7 Ag27 149.8(16) . . ? Ag16 O7 Ag27 55.8(4) . . ? C25 O7 Ag17 120.8(12) . . ? Ag16 O7 Ag17 82.0(4) . . ? Ag27 O7 Ag17 71.9(4) . . ? C25 O8 Ag28 101.7(11) . . ? C25 O8 Ag14 111.2(10) . . ? Ag28 O8 Ag14 129.8(6) . . ? C25 O8 Ag22 114.5(11) . . ? Ag28 O8 Ag22 73.0(4) . . ? Ag14 O8 Ag22 121.4(5) . . ? C33 O9 Ag18 113.0(11) . . ? C33 O9 Ag21 115.4(10) . . ? Ag18 O9 Ag21 129.0(5) . . ? C33 O10 Ag3 130.2(12) . 2_645 ? C33 O10 Ag29 120.8(11) . . ? Ag3 O10 Ag29 67.8(4) 2_645 . ? C41 O11 Ag16 108.1(12) . . ? C41 O11 Ag28 128.5(12) . . ? Ag16 O11 Ag28 20.84(18) . . ? C41 O12 Ag17 111.8(10) . . ? C41 O12 Ag19 114.3(10) . . ? Ag17 O12 Ag19 127.6(6) . . ? N7 O13 Ag25 108.7(13) . . ? N7 O13 Ag18 120.6(14) . 2_655 ? Ag25 O13 Ag18 112.2(7) . 2_655 ? N7 O13 Ag3 115.6(12) . . ? Ag25 O13 Ag3 13.8(4) . . ? Ag18 O13 Ag3 98.8(5) 2_655 . ? N7 O14 Ag24 97.7(15) . 1_665 ? N7 O15 Ag24 97(2) . 1_665 ? N8 O16 Ag1 110.6(12) . . ? N8 O16 Ag7 143.8(13) . 3_665 ? Ag1 O16 Ag7 99.5(6) . 3_665 ? N8 O18 Ag8 112.1(13) . 3_665 ? N9 O19 Ag12 104.7(16) . . ? N9 O20 Ag20 107.2(13) . 2_655 ? N9 O20 Ag29 120.2(13) . 2_655 ? Ag20 O20 Ag29 20.4(2) 2_655 2_655 ? N9 O20 Ag4 118.6(13) . . ? Ag20 O20 Ag4 130.5(7) 2_655 . ? Ag29 O20 Ag4 111.5(6) 2_655 . ? N10 O22 Ag7 107.6(11) . 3_665 ? N10 O22 Ag5 112.4(11) . . ? Ag7 O22 Ag5 85.9(4) 3_665 . ? N10 O24 Ag10 109.8(15) . 3_655 ? N11 O25 Ag18 108.4(16) . . ? N11 O27 Ag23 115.0(19) . 2 ? N12 O28 Ag27 102.9(16) . . ? N12 O28 Ag17 113.2(15) . . ? Ag27 O28 Ag17 84.0(7) . . ? N12 O28 Ag12 122.3(13) . . ? Ag27 O28 Ag12 116.7(9) . . ? Ag17 O28 Ag12 111.2(7) . . ? N12 O30A Ag27 82(3) . . ? N12 O30A Ag11 109(4) . . ? Ag27 O30A Ag11 33.4(9) . . ? N13 O31 Ag11 114.7(12) . . ? N13 O31 Ag12 108.6(11) . . ? Ag11 O31 Ag12 111.9(6) . . ? N13 O33 Ag26 104.8(12) . . ? N14 O34 Ag10 110.6(15) . . ? N14 O36 Ag26 98.3(14) . 3_655 ? N15 O37 Ag15 109(2) . . ? N15 O37 Ag28 140(2) . . ? Ag15 O37 Ag28 95.2(7) . . ? N15 O39 Ag8 105(2) . 1_545 ? N16 O40 Ag13 109.4(11) . 3 ? N16 O40 Ag15 120.1(12) . . ? Ag13 O40 Ag15 123.0(6) 3 . ? N16 O41 Ag1 107.0(18) . 3_655 ? N17 O43 Ag24 111.3(14) . . ? N17 O45 Ag23 106.8(14) . . ? N18 O46 Ag23 100.7(15) . . ? Ag22 O1W Ag24 108.0(14) . . ? Ag22 O1WA Ag24 110.1(15) . . ? _diffrn_measured_fraction_theta_max 0.956 _diffrn_reflns_theta_full 26.15 _diffrn_measured_fraction_theta_full 0.956 _refine_diff_density_max 3.360 _refine_diff_density_min -2.401 _refine_diff_density_rms 0.304